NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.2517 0.0000 0.0000 62.6103 32.5459 175.6277 2 Q 4.0874 8.4557 121.1725 54.3117 28.8639 173.6642 3 I 4.1797 8.0000 127.9652 59.9892 38.4826 175.8978 4 T 4.3017 8.3739 116.1462 61.5073 69.6749 173.8610 5 L 4.8527 7.6190 118.5200 54.3019 42.5495 178.4549 6 W 4.1949 8.3602 121.3659 58.7371 29.1793 175.6065 7 K 4.6946 7.6917 116.8518 53.5163 34.7423 174.8720 8 R 3.8639 8.6254 118.2550 56.6265 30.5534 176.3750 9 P 4.6817 0.0000 0.0000 62.2915 29.3604 174.7471 10 L 4.8455 7.6556 123.2927 55.0997 43.2355 177.3578 11 V 4.6194 9.3704 116.6515 59.6053 36.2360 174.8389 12 T 4.7814 8.4882 119.3619 63.3700 69.1659 174.2996 13 I 4.8997 9.0736 119.3225 58.9014 41.4174 174.1211 14 K 5.1310 9.2086 124.8320 54.6430 35.1825 175.2996 15 V 4.6311 8.8041 126.4859 60.9388 35.0727 175.1238 16 G 4.0470 9.1064 114.4708 46.4410 0.0000 174.5189 17 G 3.9464 8.5278 106.8625 44.9510 0.0000 174.1704 18 Q 4.6217 8.1944 119.1475 54.0539 30.9536 174.1348 19 L 5.1453 8.2460 120.6081 53.4273 43.2620 176.0405 20 K 4.7335 9.0375 122.3376 54.6394 36.8906 174.6641 21 E 5.0928 8.6743 121.9438 55.0939 31.3948 174.7474 22 A 4.8146 9.0464 126.0713 50.6244 23.6051 174.5862 23 L 5.0154 8.9122 122.6975 53.4344 43.9002 175.6687 24 L 4.3382 8.8119 127.5893 55.0041 42.1954 176.5747 25 D 4.8381 9.2105 125.9053 52.2058 42.3697 176.3907 26 T 3.9908 8.6799 116.0335 63.5229 69.1349 175.7020 27 G 3.7740 8.1647 109.9351 45.5425 0.0000 172.8769 28 A 4.6169 7.7343 123.2478 50.0118 20.6404 177.6443 29 D 4.4266 8.9922 123.1472 56.8740 42.1281 176.2352 30 D 5.3508 8.0243 116.2199 52.6776 45.2098 175.2010 31 T 4.8152 8.0968 116.0775 62.4550 70.4891 174.2261 32 V 4.8915 8.9332 126.1348 61.1287 34.8358 174.0568 33 L 5.3160 9.2267 127.9745 52.8920 44.9014 175.5907 34 E 4.8441 9.2630 120.5797 54.6306 32.1800 174.7274 35 D 4.3924 8.5042 117.0052 55.5703 38.6554 173.9199 36 I 4.3374 7.4608 109.6523 58.5546 40.0631 174.7906 37 A 4.0357 8.5783 127.3161 51.9767 18.1430 176.4050 38 L 4.4855 8.0355 123.1448 52.5175 43.4924 175.1965 39 P 4.4741 0.0000 0.0000 63.3202 32.3589 176.8237 40 G 3.9368 8.7304 106.9740 44.2576 0.0000 173.0022 41 K 4.1114 8.2035 117.5716 56.7886 33.1991 175.2243 42 W 4.8249 7.1461 115.5241 55.8784 30.8228 173.3004 43 K 4.7584 8.8803 118.6779 53.5718 35.5846 174.6292 44 P 5.0062 0.0000 0.0000 63.2538 32.1434 175.3623 45 K 4.7740 9.0141 122.4101 55.4757 36.3129 174.2067 46 M 5.4453 8.7402 123.8422 53.4530 34.8962 175.0523 47 I 4.6386 8.8450 116.4729 59.0847 40.7881 174.7412 48 G 3.0034 8.3614 111.1199 44.6269 0.0000 173.6119 49 G 3.8781 8.0899 109.9300 44.3146 0.0000 172.2607 50 I 3.6220 8.2486 120.0471 62.0719 38.5409 178.2322 51 G 3.9668 8.7937 113.9247 45.7143 0.0000 174.3325 52 G 3.7902 5.9899 106.9503 44.7081 0.0000 171.6771 53 F 5.3782 8.5701 120.1422 55.5922 42.1242 174.9209 54 I 4.6481 8.6149 116.2354 59.0069 40.4669 174.8410 55 K 4.8672 8.5630 123.2411 56.3816 33.1433 176.5073 56 V 4.6326 9.1322 116.3795 59.6647 36.9024 174.3566 57 K 4.3800 9.0384 122.3431 54.9575 33.8363 175.6190 58 Q 4.7362 9.1857 127.8444 55.4677 30.4755 173.7383 59 Y 5.0126 9.1996 125.1143 56.4467 40.2813 175.4172 60 E 4.6620 9.0442 123.3586 54.7760 31.7423 175.2106 61 N 4.1195 8.4242 115.8406 54.2999 36.5055 174.7950 62 V 4.1657 7.9365 117.7412 61.9835 33.5664 175.1069 63 S 4.9023 8.5848 122.5258 57.7789 63.9937 172.5320 64 L 5.1159 9.0342 126.3689 53.0600 46.0589 175.1417 65 E 5.0170 9.6869 124.0813 54.4862 31.8006 176.7231 66 I 4.3766 8.8726 128.6490 61.1430 37.8669 177.6910 *68 G 4.2193 8.1418 107.1228 43.0345 0.0000 172.7613 69 H 4.7808 8.1454 118.2648 53.5397 30.3257 173.7290 70 K 4.8016 8.5836 124.3423 56.2145 32.7845 176.3513 71 A 4.8795 9.3232 125.4838 50.3024 23.1720 174.7745 72 I 4.8685 9.1111 120.0453 59.3320 40.6582 176.2319 73 G 3.9433 8.1677 113.0532 46.3144 0.0000 170.9958 74 T 4.7344 8.5387 117.1938 63.4077 69.4162 174.5954 75 V 4.5419 9.1634 126.3293 61.0965 34.6996 174.2264 76 L 5.0151 9.1697 128.4551 53.8548 43.6772 175.7517 77 V 4.7131 8.5393 123.1427 61.5023 34.1865 174.9525 78 G 3.9766 8.2522 113.9069 45.0247 0.0000 171.0213 79 P 4.7103 0.0000 0.0000 62.1203 30.8621 176.1932 80 T 4.1373 7.3590 112.3850 61.9550 68.4032 172.2076 81 P 4.5111 0.0000 0.0000 63.5937 32.1241 176.1765 82 V 4.3777 7.2539 118.3550 60.7877 34.5497 174.3555 83 N 4.6640 8.7854 124.4985 53.5756 39.6714 173.6732 84 I 4.8119 9.1240 125.2155 59.5591 40.2049 174.6383 85 I 4.4265 9.1642 128.8525 60.1077 38.6869 175.8312 86 G 4.3644 8.5860 115.7185 43.9677 0.0000 174.1314 87 R 4.0488 9.0887 118.7563 58.9930 28.9859 178.8386 88 N 4.3229 7.9642 116.9636 56.3286 36.8228 176.7228 89 M 4.2844 7.8701 119.3664 57.1342 32.6663 178.3044 90 L 4.0108 8.0414 119.6349 57.8902 41.7738 179.5556 91 T 3.8505 8.3749 110.2138 65.0870 68.4107 176.5578 92 Q 4.1311 7.4338 116.5671 57.5193 28.7611 177.5531 93 I 4.3491 7.2616 112.3021 60.2214 38.0698 176.2058 94 G 3.8351 7.8435 108.4580 46.1587 0.0000 173.1634 95 C 4.3067 8.0912 120.3834 58.8374 32.0419 173.0167 96 T 4.7458 8.1076 115.5867 59.7421 71.6020 172.9651 97 L 4.6291 8.2682 122.1396 53.7878 43.1402 176.1994 98 N 5.0465 8.4399 118.7419 51.7363 42.5521 174.5468 99 F 4.4863 8.1538 116.2633 57.4383 37.4902 173.8708 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 P 0.00 4.25 0.00 2.21 2.14 0.00 3.72 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 1.88 1.98 0.00 2 Q 8.46 4.09 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.87 0.00 0.00 0.00 0.00 0.00 2.30 2.46 0.00 3 I 8.00 4.18 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 1.48 0.70 0.92 0.00 0.00 4 T 8.37 4.30 4.40 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 1.36 0.00 0.00 5 L 7.62 4.85 0.00 1.32 1.48 0.82 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 6 W 8.36 4.19 0.00 3.33 3.29 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 7 K 7.69 4.69 0.00 1.72 1.74 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.49 7.81 8 R 8.63 3.86 0.00 1.84 1.90 0.00 3.25 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 9 P 0.00 4.68 0.00 2.10 2.20 0.00 3.66 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 2.16 1.97 0.00 10 L 7.66 4.85 0.00 1.56 1.63 0.92 0.93 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 11 V 9.37 4.62 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 0.73 0.00 0.00 0.98 0.00 0.00 12 T 8.49 4.78 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 1.26 0.00 0.00 13 I 9.07 4.90 1.86 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 1.24 0.77 0.91 0.00 0.00 14 K 9.21 5.13 0.00 1.76 1.65 0.00 1.61 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.30 1.46 7.81 15 V 8.80 4.63 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 0.65 0.00 0.00 0.87 0.00 0.00 16 G 9.11 4.05 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 0.00 0.00 0.00 17 G 8.53 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 Q 8.19 4.62 0.00 2.13 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.74 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 19 L 8.25 5.15 0.00 1.51 1.59 0.92 0.81 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 20 K 9.04 4.73 0.00 1.59 1.62 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.75 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.32 1.47 7.81 21 E 8.67 5.09 0.00 1.94 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 2.20 2.51 0.00 22 A 9.05 4.81 1.21 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 0.00 0.00 23 L 8.91 5.02 0.00 1.72 1.69 0.91 0.73 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 24 L 8.81 4.34 0.00 1.54 1.61 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 25 D 9.21 4.84 0.00 2.70 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.68 3.99 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 1.20 0.00 0.00 27 G 8.16 3.77 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 0.00 0.00 0.00 28 A 7.73 4.62 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 29 D 8.99 4.43 0.00 2.62 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 30 D 8.02 5.35 0.00 2.56 2.54 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 31 T 8.10 4.82 4.41 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 1.23 0.00 0.00 32 V 8.93 4.89 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 1.00 0.00 0.00 0.92 0.00 0.00 33 L 9.23 5.32 0.00 1.48 1.45 0.86 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 34 E 9.26 4.84 0.00 1.91 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 2.29 2.50 0.00 35 D 8.50 4.39 0.00 2.78 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 36 I 7.46 4.34 1.77 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.52 0.85 0.00 0.00 37 A 8.58 4.04 1.25 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 0.00 0.00 38 L 8.04 4.49 0.00 0.63 0.54 0.40 0.93 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 39 P 0.00 4.47 0.00 2.24 2.08 0.00 3.70 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.97 0.00 40 G 8.73 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.20 4.11 0.00 1.70 1.75 0.00 1.66 0.00 0.00 1.77 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.31 7.81 42 W 7.15 4.82 0.00 2.95 1.74 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 43 K 8.88 4.76 0.00 1.75 1.71 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.27 1.27 7.81 44 P 0.00 5.01 0.00 2.19 2.29 0.00 3.75 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.99 0.00 45 K 9.01 4.77 0.00 1.91 1.68 0.00 1.62 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.48 7.81 46 M 8.74 5.45 0.00 2.08 2.02 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.48 0.00 47 I 8.85 4.64 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.69 0.99 0.00 0.00 48 G 8.36 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.09 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 50 I 8.25 3.62 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 1.32 1.17 0.88 0.00 0.00 51 G 8.79 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 52 G 5.99 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 F 8.57 5.38 0.00 2.84 2.95 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 0.00 0.00 0.00 0.00 54 I 8.61 4.65 1.88 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.94 0.92 0.00 0.00 55 K 8.56 4.87 0.00 1.68 1.80 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.51 7.81 56 V 9.13 4.63 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 0.76 0.00 0.00 1.00 0.00 0.00 57 K 9.04 4.38 0.00 1.40 0.77 0.00 1.13 0.00 0.00 0.61 0.00 0.00 2.14 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.30 0.63 7.81 58 Q 9.19 4.74 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 59 Y 9.20 5.01 0.00 3.10 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 60 E 9.04 4.66 0.00 1.90 1.91 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 0.00 2.32 2.37 0.00 61 N 8.42 4.12 0.00 2.84 2.86 0.00 0.00 6.84 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 62 V 7.94 4.17 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 0.95 0.00 0.00 1.09 0.00 0.00 63 S 8.58 4.90 0.00 3.96 3.71 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 64 L 9.03 5.12 0.00 1.61 1.49 0.91 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 65 E 9.69 5.02 0.00 1.85 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 2.23 2.25 0.00 66 I 8.87 4.38 1.88 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 1.23 0.95 0.91 0.00 0.00 *68 G 8.14 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 0.00 0.00 0.00 0.00 69 H 8.15 4.78 0.00 3.32 3.22 0.00 5.62 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 K 8.58 4.80 0.00 1.65 1.74 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.44 1.44 7.81 71 A 9.32 4.88 1.22 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 0.00 0.00 72 I 9.11 4.87 1.89 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 1.17 0.72 0.93 0.00 0.00 73 G 8.17 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 74 T 8.54 4.73 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 1.27 0.00 0.00 75 V 9.16 4.54 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 1.03 0.00 0.00 0.93 0.00 0.00 76 L 9.17 5.02 0.00 1.65 1.58 0.95 0.66 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 77 V 8.54 4.71 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 0.85 0.00 0.00 0.69 0.00 0.00 78 G 8.25 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 79 P 0.00 4.71 0.00 2.17 2.10 0.00 3.75 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.93 0.00 80 T 7.36 4.14 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 1.26 0.00 0.00 81 P 0.00 4.51 0.00 2.20 2.13 0.00 3.74 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 82 V 7.25 4.38 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 0.81 0.00 0.00 0.92 0.00 0.00 83 N 8.79 4.66 0.00 2.83 2.72 0.00 0.00 6.97 7.62 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 84 I 9.12 4.81 1.85 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 1.40 1.09 0.98 0.00 0.00 85 I 9.16 4.43 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.01 0.91 0.00 0.00 86 G 8.59 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 0.00 0.00 0.00 0.00 87 R 9.09 4.05 0.00 1.82 1.99 0.00 3.15 0.00 0.00 3.35 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 88 N 7.96 4.32 0.00 2.88 3.11 0.00 0.00 6.87 8.84 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 89 M 7.87 4.28 0.00 2.05 2.24 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.56 0.00 90 L 8.04 4.01 0.00 1.68 1.71 0.98 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 91 T 8.37 3.85 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 1.26 0.00 0.00 92 Q 7.43 4.13 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.88 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 93 I 7.26 4.35 1.82 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 1.71 0.54 0.98 0.00 0.00 94 G 7.84 3.84 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 0.00 0.00 0.00 95 C 8.09 4.31 0.00 2.91 2.99 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 96 T 8.11 4.75 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 1.20 0.00 0.00 97 L 8.27 4.63 0.00 1.73 1.75 0.95 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 98 N 8.44 5.05 0.00 2.65 2.64 0.00 0.00 6.79 7.45 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 99 F 8.15 4.49 0.00 3.07 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 * Residues marked with a * may have inaccurate shift predictions.