NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 I 4.1034 8.0249 121.4632 59.6578 37.7854 174.6739 4 E 3.7568 8.7367 123.3241 58.2315 28.4817 174.9718 5 K 4.0134 8.0463 120.1216 59.3058 33.7348 178.4495 6 L 4.0779 7.7063 120.1480 58.2095 41.8561 178.6754 7 K 3.8670 8.1774 117.7030 59.7330 31.7923 179.0037 8 A 4.0890 8.2538 119.7710 54.7727 18.3276 179.2129 9 A 4.0561 7.6901 118.4822 53.5636 18.7799 178.2168 10 L 3.8930 6.9086 116.6879 54.3697 42.4036 175.6889 11 P 4.2729 0.0000 0.0000 62.0243 32.4358 176.9578 12 E 3.8211 8.3321 120.1341 59.4269 29.6888 177.8671 13 Y 4.3991 7.2362 112.9463 57.4518 38.1401 175.2318 14 A 4.7748 7.5767 122.5114 51.6941 20.0380 178.3659 15 K 3.7805 8.0570 122.4512 61.5377 31.9672 178.2163 16 D 4.3705 8.1054 118.1624 57.6342 40.7130 178.8155 17 I 3.7169 7.7450 119.9977 63.9087 36.9235 178.4245 18 K 3.8804 7.9441 120.1368 59.5523 32.1622 178.5874 19 L 3.9779 7.8544 119.1769 58.0490 41.5579 179.3836 20 N 4.4412 8.2925 117.7090 55.4712 38.5072 177.3737 21 L 3.8648 8.1975 122.0753 58.1531 41.8380 178.6442 22 S 4.1189 8.3132 113.7640 61.6353 61.7665 176.4328 23 S 4.2071 8.1262 116.6832 61.4047 62.7982 176.2854 24 I 3.6518 7.6750 121.2639 63.6610 37.7369 177.2797 25 T 3.9006 7.6219 112.7742 63.9919 67.3384 175.8856 26 R 4.3099 7.2870 116.9082 56.1232 30.8649 176.8375 27 S 4.2823 7.2589 113.5648 58.5620 62.8706 173.8061 28 S 4.6613 8.3127 119.8503 58.6759 64.4405 175.7964 29 V 3.6610 7.1075 119.0077 65.2899 31.3683 175.9785 30 L 4.8377 7.5203 117.2993 52.7670 43.9123 176.3600 31 D 4.7206 8.6894 122.2229 52.7500 41.7273 177.2435 32 Q 4.2566 8.7178 119.9521 59.4950 28.7803 178.1425 33 E 4.1664 8.3330 119.7427 59.2875 29.9188 178.3706 34 Q 4.3188 9.8330 119.2085 59.0802 28.8613 178.6327 35 L 3.8430 8.4475 121.3750 58.2658 42.2153 179.1931 36 W 4.0221 8.5001 118.7280 59.2049 28.9486 178.9556 37 G 2.7956 8.6874 106.5645 47.5001 0.0000 176.0893 38 T 3.8844 7.9564 118.0278 66.3747 68.4188 176.9922 39 L 3.8659 7.8117 121.0210 57.3580 41.5193 179.4005 40 L 3.8494 7.8299 120.1681 58.0134 42.0907 178.7379 41 A 3.8839 7.6970 120.7277 55.2498 18.1371 179.8246 42 S 3.9640 8.0610 113.2413 61.6699 62.7223 176.5154 43 A 3.9490 7.8785 121.9802 55.2640 18.3538 179.2028 44 A 4.0476 8.0922 118.7143 55.4058 18.3091 179.8289 45 A 4.0335 7.7387 117.8845 55.1346 18.4518 179.5300 46 T 3.9336 7.7605 107.4417 62.6988 69.0098 175.8559 47 R 3.8029 7.5975 118.4939 56.4387 28.7982 175.2681 48 N 4.6134 8.0245 118.8155 51.9706 39.2556 174.0108 49 P 4.2944 0.0000 0.0000 65.9708 31.2263 178.3135 50 Q 3.9097 8.1115 118.8845 58.9924 29.1021 177.9864 51 V 3.5784 8.4400 119.7018 65.8455 31.4861 177.7781 52 L 3.9241 7.8948 119.5500 57.8844 41.9469 178.8131 53 A 3.9593 7.9682 120.7031 55.3254 18.4082 179.3907 54 D 4.3109 8.2603 117.4340 57.6409 40.8890 179.1856 55 I 4.0753 8.1016 120.5439 64.3950 36.9010 178.6882 56 G 3.6244 8.3537 105.7293 47.7363 0.0000 175.3365 57 A 4.1062 8.1352 123.0076 55.0652 18.4278 179.6916 58 E 3.7199 8.2963 116.7788 58.9953 29.5266 178.7030 59 A 4.2073 8.0851 119.6610 53.4037 17.9102 179.3120 60 T 3.8459 7.5585 109.2194 64.5016 68.7460 176.1817 61 D 4.2633 7.2437 118.5293 55.8925 40.9348 176.3624 62 H 4.8745 7.2682 114.2214 54.7116 30.7514 173.2061 63 L 4.7615 7.6597 120.0054 52.1617 43.9270 177.2241 64 S 4.4005 8.5763 118.5645 57.9000 65.1393 175.1135 65 A 3.9158 8.4415 122.4895 55.2130 18.0346 179.5692 66 A 4.0205 8.0459 118.6426 55.2129 18.4509 179.5805 67 A 4.2480 8.3719 119.4330 55.5555 18.5640 180.0297 68 R 3.7432 8.1030 116.5952 59.8396 30.0850 179.0916 69 H 4.4073 8.2583 115.6106 58.4662 28.5998 177.7652 70 A 4.2870 8.4259 122.8378 55.1158 18.3253 179.5103 71 A 3.8330 8.2960 119.5480 55.4023 18.4790 179.9578 72 L 4.0814 8.1038 117.6521 57.8345 41.6730 180.0482 73 G 3.7586 8.8192 106.0726 47.5191 0.0000 175.7091 74 A 4.0610 8.3067 122.5800 55.0092 18.4398 179.2478 75 A 4.0573 7.6835 117.5168 55.0949 18.5181 179.4645 76 A 4.1519 7.6466 117.6811 55.1760 18.6902 181.8422 77 I 4.0354 7.6487 115.8491 60.9550 38.1439 176.5950 *79 G 3.7842 7.8753 104.2399 45.1362 0.0000 174.0167 *81 N 4.8528 8.0418 118.8406 53.1480 40.1096 176.5771 82 N 4.4142 8.1825 114.9030 56.0405 38.4577 177.3237 83 V 3.8803 7.7000 119.1901 65.4596 31.8348 177.5128 84 F 3.8273 8.0000 119.8593 61.6097 39.2880 176.6027 85 Y 3.8460 7.9775 116.2833 60.8074 37.5420 178.6580 86 R 3.6207 7.5253 120.3427 59.0314 29.9250 178.8186 87 G 3.4179 7.4693 104.4058 47.8401 0.0000 175.3031 88 R 3.8737 7.6273 122.0878 58.8092 29.7779 178.7319 89 G 3.5572 7.8475 104.8447 47.5350 0.0000 174.9228 90 F 4.9248 7.4808 117.3429 58.5468 39.4080 176.0211 91 L 4.5007 7.7752 119.1355 54.1236 41.3917 176.5828 92 E 3.5459 9.1186 116.0356 57.5675 27.1320 175.7916 93 G 4.2339 8.3601 104.1871 46.2450 0.0000 176.1319 94 R 4.1655 8.0933 118.2470 58.0828 30.2404 176.8222 95 Y 4.5901 7.9497 114.4486 57.6570 39.2499 176.7726 96 D 4.6059 8.2216 121.2994 56.2802 41.0206 177.5715 97 D 4.6446 8.0057 117.2281 54.0187 40.1757 176.2273 98 L 4.5817 7.4029 120.8636 53.2981 43.0675 176.1342 99 R 4.3660 8.3454 118.8472 54.7355 30.5862 174.4888 100 P 4.1305 0.0000 0.0000 65.0035 31.3855 178.2577 101 G 3.9768 7.9229 103.1968 46.4266 0.0000 172.7204 102 L 4.5223 6.8616 116.1581 52.3563 43.2148 177.1487 103 R 4.1538 8.3002 122.5614 56.7812 30.8963 176.7619 104 M 4.7786 8.4520 118.1277 55.2714 34.1339 175.7825 105 N 4.3576 8.5561 117.8145 56.5801 38.2343 176.5884 106 I 3.7431 7.7201 118.4812 63.8260 38.0574 177.5653 107 I 3.5322 7.9343 120.3442 64.3617 37.1124 178.0169 108 A 4.2179 7.8380 119.2337 53.4792 19.6790 177.2007 109 N 4.8629 7.4379 113.9034 51.0235 38.7162 172.5870 110 P 4.0962 0.0000 0.0000 63.0949 32.3305 178.5191 111 G 3.9279 9.3690 107.1735 45.5765 0.0000 172.4160 112 I 4.5436 7.0288 111.4849 57.5907 40.1301 172.7978 113 P 4.3658 0.0000 0.0000 62.8019 32.7659 177.3190 114 K 4.0090 8.6940 120.2617 59.2730 32.0508 179.0623 115 A 3.8815 8.0190 120.8268 55.6511 18.1708 179.4017 116 N 3.5711 7.7368 113.9564 55.9263 38.5033 177.2673 117 F 3.9190 7.4122 120.8934 61.3622 39.4757 177.1048 118 E 3.9575 8.7767 118.5036 59.1365 29.2143 179.0658 119 L 3.9078 7.4883 120.4483 57.9743 42.1393 179.1648 120 W 4.4287 7.8807 118.9229 59.9448 28.9892 178.8141 121 S 4.0445 8.1282 115.2822 61.1848 62.1027 176.5868 122 F 4.1208 8.3991 123.3998 61.2280 39.0575 177.0363 123 A 3.9477 8.2511 120.5190 55.2304 18.1699 179.8397 124 V 3.5284 7.8735 116.7422 66.1727 31.5605 178.5081 125 S 4.8414 8.3593 116.0772 60.8825 62.3454 176.5954 126 A 3.7949 7.4697 122.9402 55.0405 18.1574 179.4806 127 I 3.7628 7.0806 117.2282 64.6929 37.3079 178.2501 128 N 4.5091 8.4724 116.3094 53.8106 39.2564 175.1105 129 G 3.5438 8.3511 107.3196 46.9911 0.0000 174.8009 130 C 4.6188 7.5500 118.5231 56.9989 33.7053 172.8115 131 S 4.0947 8.4807 124.6162 61.7860 62.8266 175.4393 132 H 3.9611 8.2493 121.5600 59.3019 29.3724 176.7520 133 C 4.1526 8.0571 117.6654 62.5675 28.2527 175.4027 134 L 3.9206 7.9883 121.9753 58.2647 41.5860 179.3707 135 V 3.6283 8.0792 117.8600 65.9964 31.5980 177.8380 136 A 3.9452 7.7487 120.1230 55.5638 18.1562 179.3414 137 H 4.4462 8.5331 114.8975 58.7370 28.8927 177.5220 138 E 3.8450 8.5853 121.3338 59.3644 29.3221 178.4426 139 H 4.1039 8.3475 118.1714 59.5810 30.0279 177.2502 140 T 3.7412 7.7596 117.2664 66.7111 68.1120 176.2120 141 L 3.8880 7.9956 119.6943 58.3175 42.0570 179.7833 142 R 4.7022 7.7244 118.7571 58.6747 29.7241 179.0640 143 T 3.8478 7.7925 115.6674 66.2787 68.5129 176.0718 144 V 4.2176 7.1266 117.8274 61.7081 32.5752 175.3365 145 G 3.8910 8.7354 105.6028 42.3037 0.0000 175.0092 146 V 3.1612 8.5305 126.4988 62.8422 31.2956 171.9569 147 D 4.6974 8.2068 125.1825 52.3801 40.8256 177.3469 148 R 3.9029 8.6599 120.2366 59.6670 29.8744 179.0557 149 E 3.9273 8.1663 116.6438 59.2830 29.5848 179.0609 150 A 3.9573 8.0805 121.6748 54.9197 18.5216 179.6036 151 I 3.3746 7.6083 117.8235 64.4881 37.1749 178.1907 152 F 4.2532 8.8534 121.9371 61.4504 39.1136 176.7303 153 E 3.8511 8.5541 118.7637 59.0176 29.3407 178.7635 154 A 3.9855 8.0106 120.9843 55.0005 18.4673 179.1526 155 L 3.8959 8.1915 118.9110 58.3893 42.1076 179.3687 156 K 3.7291 7.9754 118.0456 59.3234 31.9487 179.1477 157 A 3.8529 8.1945 121.1078 55.0781 18.3115 179.4975 158 A 4.0920 8.8556 120.6868 54.6788 18.4593 179.8016 159 A 3.8865 8.1274 119.3491 55.3335 18.4879 179.9325 160 I 3.6195 8.2777 118.7062 64.5396 37.1816 178.8742 161 V 3.5717 8.1925 119.4907 66.0525 31.2876 178.2791 162 S 4.2386 8.1386 115.1977 61.4461 62.5765 176.9137 163 G 3.5855 8.1365 108.5697 47.5199 0.0000 175.9722 164 V 3.5513 7.9385 120.3657 65.7481 31.5033 177.9027 165 A 3.9689 7.9981 120.4172 55.2008 18.2565 179.3927 166 Q 3.8474 8.0731 117.6896 59.2823 28.9775 178.0201 167 A 4.0673 8.0966 120.7627 55.5260 18.4750 179.3595 168 L 4.0690 8.2528 116.1187 57.7963 41.7639 179.3470 169 A 4.1393 8.0690 119.7250 54.3821 18.3602 177.7919 170 T 4.2273 7.6121 116.0100 62.4158 67.6310 174.0097 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 3 I 8.02 4.10 1.99 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.42 0.99 0.00 0.00 4 E 8.74 3.76 0.00 2.31 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 2.31 2.43 0.00 5 K 8.05 4.01 0.00 1.75 1.84 0.00 1.77 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.49 7.81 6 L 7.71 4.08 0.00 1.93 1.68 0.93 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 7 K 8.18 3.87 0.00 1.85 1.87 0.00 1.73 0.00 0.00 1.91 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.55 1.56 7.81 8 A 8.25 4.09 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 9 A 7.69 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 10 L 6.91 3.89 0.00 1.78 1.57 0.94 0.98 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 11 P 0.00 4.27 0.00 0.86 1.79 0.00 3.56 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 1.53 1.65 0.00 12 E 8.33 3.82 0.00 1.99 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 2.36 2.35 0.00 13 Y 7.24 4.40 0.00 3.09 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 14 A 7.58 4.77 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 15 K 8.06 3.78 0.00 2.09 1.85 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.50 7.81 16 D 8.11 4.37 0.00 2.81 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.75 3.72 2.02 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.68 0.88 0.00 0.00 18 K 7.94 3.88 0.00 1.79 1.95 0.00 1.69 0.00 0.00 1.79 0.00 0.00 3.08 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.63 7.81 19 L 7.85 3.98 0.00 1.90 1.70 0.92 0.82 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 20 N 8.29 4.44 0.00 2.89 2.83 0.00 0.00 6.22 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 21 L 8.20 3.86 0.00 1.78 1.88 0.87 0.99 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 22 S 8.31 4.12 0.00 3.99 4.02 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 23 S 8.13 4.21 0.00 4.10 4.09 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 24 I 7.68 3.65 1.89 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 1.28 0.56 0.87 0.00 0.00 25 T 7.62 3.90 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 1.38 0.00 0.00 26 R 7.29 4.31 0.00 1.88 1.98 0.00 3.43 0.00 0.00 3.21 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.79 0.00 27 S 7.26 4.28 0.00 3.97 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 28 S 8.31 4.66 0.00 3.89 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 29 V 7.11 3.66 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 0.81 0.00 0.00 0.96 0.00 0.00 30 L 7.52 4.84 0.00 1.65 1.58 0.93 1.13 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 31 D 8.69 4.72 0.00 2.98 2.85 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 32 Q 8.72 4.26 0.00 2.30 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.97 0.00 0.00 0.00 0.00 0.00 2.57 2.62 0.00 33 E 8.33 4.17 0.00 2.24 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 2.83 2.72 0.00 34 Q 9.83 4.32 0.00 2.34 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.57 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 35 L 8.45 3.84 0.00 1.89 1.51 0.73 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 36 W 8.50 4.02 0.00 3.65 3.30 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 37 G 8.69 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 0.00 0.00 0.00 38 T 7.96 3.88 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 1.26 0.00 0.00 39 L 7.81 3.87 0.00 1.37 1.46 -0.37 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 40 L 7.83 3.85 0.00 1.81 1.54 0.90 0.71 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 41 A 7.70 3.88 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 42 S 8.06 3.96 0.00 4.02 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 43 A 7.88 3.95 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 44 A 8.09 4.05 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 45 A 7.74 4.03 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 46 T 7.76 3.93 4.23 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 1.26 0.00 0.00 47 R 7.60 3.80 0.00 2.01 2.10 0.00 3.32 0.00 0.00 3.28 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 48 N 8.02 4.61 0.00 2.74 2.70 0.00 0.00 6.94 7.73 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 49 P 0.00 4.29 0.00 2.30 2.30 0.00 3.75 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 2.07 2.02 0.00 50 Q 8.11 3.91 0.00 2.19 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.94 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 51 V 8.44 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 1.01 0.00 0.00 0.96 0.00 0.00 52 L 7.89 3.92 0.00 2.00 1.64 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 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0.00 2.21 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 62 H 7.27 4.87 0.00 3.33 3.33 0.00 5.59 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 L 7.66 4.76 0.00 1.77 1.56 1.09 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 64 S 8.58 4.40 0.00 4.08 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 65 A 8.44 3.92 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 66 A 8.05 4.02 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 67 A 8.37 4.25 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 0.00 0.00 0.00 0.00 0.00 0.00 68 R 8.10 3.74 0.00 1.98 1.87 0.00 3.07 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 69 H 8.26 4.41 0.00 3.27 3.38 0.00 5.62 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 C 7.55 4.62 0.00 3.10 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 S 8.48 4.09 0.00 4.09 4.12 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 0.00 132 H 8.25 3.96 0.00 3.16 3.30 0.00 5.66 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 C 8.06 4.15 0.00 3.10 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 0.00 134 L 7.99 3.92 0.00 1.74 1.64 -0.30 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 135 V 8.08 3.63 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 0.93 0.00 0.00 1.00 0.00 0.00 136 A 7.75 3.95 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 0.00 137 H 8.53 4.45 0.00 3.52 3.50 0.00 5.83 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 E 8.59 3.84 0.00 2.44 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 0.00 2.18 2.57 0.00 139 H 8.35 4.10 0.00 3.35 3.49 0.00 5.85 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 T 7.76 3.74 4.49 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 1.21 0.00 0.00 141 L 8.00 3.89 0.00 1.66 1.60 0.67 0.89 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 0.00 142 R 7.72 4.70 0.00 1.96 1.93 0.00 3.42 0.00 0.00 3.25 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.69 0.00 143 T 7.79 3.85 4.30 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 1.15 0.00 0.00 144 V 7.13 4.22 2.04 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 0.74 0.00 0.00 0.90 0.00 0.00 145 G 8.74 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 0.00 146 V 8.53 3.16 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 0.72 0.00 0.00 0.86 0.00 0.00 147 D 8.21 4.70 0.00 3.17 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 0.00 148 R 8.66 3.90 0.00 1.83 2.01 0.00 3.10 0.00 0.00 3.36 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 149 E 8.17 3.93 0.00 2.18 2.22 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 2.57 2.30 0.00 150 A 8.08 3.96 1.39 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 0.00 151 I 7.61 3.37 1.88 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.89 0.11 0.00 0.00 152 F 8.85 4.25 0.00 3.16 3.26 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 0.00 153 E 8.55 3.85 0.00 2.35 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 0.00 2.30 2.34 0.00 154 A 8.01 3.99 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 L 8.19 3.90 0.00 2.07 1.86 0.81 0.70 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 0.00 156 K 7.98 3.73 0.00 1.86 1.69 0.00 1.47 0.00 0.00 1.52 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.16 0.83 7.81 157 A 8.19 3.85 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 0.00 158 A 8.86 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 0.00 159 A 8.13 3.89 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 0.00 160 I 8.28 3.62 1.95 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 1.36 0.79 0.90 0.00 0.00 161 V 8.19 3.57 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 0.98 0.00 0.00 0.86 0.00 0.00 162 S 8.14 4.24 0.00 4.06 3.87 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 0.00 163 G 8.14 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 0.00 164 V 7.94 3.55 2.22 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 0.92 0.00 0.00 0.92 0.00 0.00 165 A 8.00 3.97 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 0.00 166 Q 8.07 3.85 0.00 2.20 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.70 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 167 A 8.10 4.07 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 0.00 168 L 8.25 4.07 0.00 1.81 1.75 0.94 0.85 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 0.00 169 A 8.07 4.14 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 0.00 170 T 7.61 4.23 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 1.52 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.