NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.8032 8.5798 109.0751 45.4123 0.0000 172.2566 1 S 4.5232 7.2365 112.7727 55.1141 65.6907 172.5761 2 F 4.9060 9.8748 126.4823 58.7827 40.7529 175.7890 3 T 4.1115 9.2004 123.0543 60.8791 70.0218 172.2195 4 P 3.5598 0.0000 0.0000 63.1781 31.8598 177.2225 5 S 4.5452 7.8710 114.2641 55.5500 64.9181 174.7368 6 G 4.4423 7.7967 110.9329 45.8218 0.0000 168.5661 7 T 4.5558 7.8037 110.7872 61.2964 71.3403 173.4943 8 T 4.9287 8.4053 117.9786 61.9212 70.4629 174.8320 9 G 4.1518 9.3276 114.4886 45.5965 0.0000 172.2847 10 T 5.2404 8.1504 115.3759 62.0924 73.0720 173.7471 11 T 4.4958 9.2433 122.0556 61.9390 70.8269 173.2491 12 K 5.1323 8.6059 125.9471 54.6605 34.7769 175.9135 13 L 4.8246 9.1305 125.6084 54.0661 46.1033 174.4949 14 T 5.0700 9.0653 123.5521 62.1171 70.7363 173.6084 15 V 4.8710 9.0804 127.9661 61.8421 33.2022 174.8477 16 T 5.0474 9.4123 118.3267 59.6420 72.7192 173.6654 17 E 4.3192 8.5887 121.9579 55.6450 30.6824 176.6215 18 E 3.9082 8.7414 119.7542 59.4744 29.5550 176.3692 19 C 4.3624 7.8953 119.9324 58.0380 30.4529 171.3079 20 Q 4.5649 8.3446 124.1929 53.8888 30.0670 175.3576 21 V 4.1377 8.3355 122.1261 61.0875 32.8521 175.2118 22 R 4.3634 8.4032 127.0112 54.6451 29.6098 175.3784 23 V 3.9845 8.1148 122.8027 62.6248 33.2933 177.6009 24 G 3.8628 8.5972 113.7497 45.6330 0.0000 172.9655 25 D 4.4980 8.4741 122.4838 54.1059 41.5849 175.6124 26 L 4.2756 8.1781 123.4851 54.9715 42.8288 175.9219 27 T 4.6102 7.8540 113.7828 59.9741 72.0565 172.7740 28 V 3.9260 8.2395 121.1114 62.8370 32.2405 174.6656 29 A 5.3412 8.4618 128.4323 50.5534 22.5335 174.9139 30 K 4.7191 9.1703 118.1420 55.3845 37.2739 175.8725 31 T 5.2480 8.3663 112.8874 60.2761 70.4423 175.7547 32 R 3.9710 8.8447 122.8565 59.8521 29.7641 179.2902 33 G 3.7293 8.0850 103.8753 47.9221 0.0000 174.9093 34 Q 4.2580 8.1188 118.1131 56.6712 29.9019 176.7382 35 L 4.3054 7.8038 122.9265 54.4861 40.8077 176.4741 36 T 4.6059 7.4207 109.8351 60.3521 70.6149 173.4447 37 D 4.3044 8.3458 120.9646 55.3423 41.5527 175.9149 38 A 3.6930 8.7322 126.9806 52.2163 17.4758 177.4679 39 A 4.3191 7.6821 120.2620 51.2580 19.2209 175.8543 40 P 4.5432 0.0000 0.0000 62.1201 32.3186 175.1087 41 I 4.3460 8.4201 123.5882 61.5664 37.8623 179.4963 42 G 3.9149 8.5029 124.1648 44.8000 0.0000 169.1799 43 P 5.0575 0.0000 0.0000 61.1416 35.3390 173.7415 44 V 4.3976 8.3042 118.4698 61.7043 34.7193 174.1217 45 T 4.7811 8.5743 124.5724 63.2120 69.7052 174.3437 46 V 4.5262 8.8322 124.4761 61.4098 35.8085 174.1958 47 Q 4.6077 8.6883 127.3716 54.4814 31.3756 172.6743 48 A 4.8041 9.1362 128.9631 51.2688 19.4786 176.4077 49 L 4.6775 8.6116 121.8064 53.1017 45.1118 176.2942 50 G 4.1495 8.6584 108.2065 47.2856 0.0000 173.1481 51 C 4.9141 8.1109 113.5085 59.2359 28.9164 175.6030 52 N 4.6815 8.3176 115.2780 54.5117 38.5105 175.6089 53 A 4.7852 7.7478 117.4181 51.2716 20.8329 175.8277 54 R 4.5720 7.7548 114.7675 54.9182 35.4621 174.6238 55 Q 4.4500 8.5310 120.4846 54.6922 29.8454 175.4889 56 V 4.0827 8.3902 124.3531 63.9119 32.3889 174.5799 57 A 5.3083 9.4846 127.0474 50.7413 23.4117 174.8618 58 L 4.8936 8.8391 118.2529 52.7676 46.3305 175.8479 59 K 4.8849 8.7384 123.5498 54.3060 34.7990 175.3447 60 A 5.3167 8.5897 129.6815 51.2369 19.3376 176.7728 61 D 4.6580 8.7893 119.6836 54.7455 41.7800 178.1375 62 T 4.2197 8.8632 116.8607 66.3576 68.6061 175.0725 63 D 4.8745 8.1266 118.9518 53.2243 39.5706 176.3272 64 N 4.3687 8.4727 115.5478 51.9967 39.7365 173.9236 65 F 5.0009 7.4447 112.1483 55.6001 40.3621 173.3886 66 E 4.3004 9.5789 123.4568 56.3719 32.8603 175.0181 67 Q 3.9211 9.6317 125.3135 57.1737 26.4297 173.1868 68 G 3.8200 9.1303 98.9838 45.8639 0.0000 174.6484 69 K 4.5470 7.5702 116.8058 55.0591 37.0237 175.4782 70 F 5.3494 8.8428 122.4739 56.5455 41.2937 174.7526 71 F 5.2582 8.1237 116.2140 55.4617 41.4850 173.5277 72 L 4.3628 9.1871 123.0610 54.9425 42.7566 175.8072 73 I 4.9697 8.9486 123.7812 59.5013 40.6121 175.0270 74 S 4.6931 8.5197 122.6675 56.7870 63.5405 174.6233 75 D 4.3886 8.4926 121.9124 56.1052 40.3308 177.0079 76 N 4.6838 7.9771 116.2477 51.6387 37.6488 174.8126 77 N 4.7897 8.0088 114.8686 54.7878 36.3815 174.4302 78 R 4.4276 6.8987 113.8943 57.6605 33.0769 174.7455 79 D 4.6905 7.7712 117.0469 54.6305 42.2895 175.0542 80 K 5.2712 8.5364 119.9690 54.6161 36.5620 175.8188 81 L 4.5033 8.7074 124.8659 53.1663 44.3574 175.0426 82 Y 4.8421 8.7513 124.9753 58.3236 38.9176 175.7438 83 V 5.1529 9.0325 116.5223 59.9602 36.3818 174.4466 84 N 5.0641 9.2428 120.1770 51.9035 41.1745 174.0707 85 I 4.6825 8.0117 122.7129 59.3357 39.2777 175.2475 86 R 4.6038 8.8023 123.6456 53.6361 32.7113 173.0820 87 P 5.1804 0.0000 0.0000 62.1378 30.8620 174.4521 *89 D 4.5701 8.3404 117.9184 52.8481 40.4549 175.3140 90 N 4.5139 9.0189 115.8497 56.2191 38.6653 175.9832 91 S 4.0395 7.6486 110.7164 56.7510 64.0812 173.3859 92 A 4.9589 8.4066 123.6857 50.3061 21.5467 175.4947 93 W 4.8470 8.5662 119.3130 55.0178 33.8835 174.6203 94 T 4.3296 7.7350 116.7690 62.0549 71.4544 173.6103 95 T 4.7910 8.3267 122.6466 62.6615 70.4181 174.8071 96 D 4.2172 9.2941 125.4834 54.2294 42.8588 173.9380 97 N 4.5741 9.7325 127.7600 54.4974 37.0563 174.6863 98 G 2.3953 7.4438 106.9142 44.8598 0.0000 171.7754 99 V 4.5104 7.0895 119.6835 61.8945 33.6794 174.8899 100 F 5.1800 9.5495 129.2155 56.5187 41.1712 172.6920 101 Y 5.1482 7.4726 123.7771 54.3252 40.9397 175.1232 102 K 2.4962 8.0506 123.1454 55.6806 32.1030 177.0470 103 N 4.4066 8.0155 124.7424 55.3884 38.7688 175.2154 104 D 4.9198 7.2168 115.5438 51.8279 44.0868 176.3203 105 V 4.1145 7.4327 114.5524 60.0844 32.1511 175.1457 106 G 4.1533 7.8414 108.9625 45.0895 0.0000 175.7654 107 S 4.5759 8.4740 120.1910 57.7797 60.9874 174.1308 108 W 4.3650 7.9342 132.4774 57.7931 31.7531 174.6027 109 G 4.5655 5.9839 109.7577 45.0039 0.0000 172.9770 110 G 3.3196 6.8880 106.7825 44.7598 0.0000 172.3516 111 T 5.0456 8.2884 118.3926 61.8097 72.4766 173.5730 112 I 4.4821 8.8739 126.2678 59.4008 39.3394 175.5905 113 G 3.9705 9.6162 116.4819 46.0395 0.0000 172.1240 114 I 4.9244 7.3338 121.2458 59.6123 40.9072 173.8517 115 Y 5.0821 8.5554 124.5613 55.4392 41.8162 175.6705 116 V 3.9045 8.8664 122.7396 64.0357 32.8432 174.7391 117 D 4.8966 9.4775 128.6029 53.2187 40.7295 172.2789 118 G 4.0293 9.6289 120.3534 44.1424 0.0000 171.4912 119 Q 4.0253 8.7430 120.6889 57.2160 29.2630 177.6240 120 Q 4.6529 8.9373 123.5291 55.1706 29.3409 176.6148 121 T 4.3558 8.0625 104.5697 63.1772 69.1953 174.8064 122 N 4.8169 7.7842 118.0772 53.3454 39.1147 174.5841 123 T 3.9829 7.6352 116.6861 62.4857 68.5854 172.6595 124 P 4.3478 0.0000 0.0000 62.4413 31.5864 174.5083 125 P 4.5813 0.0000 0.0000 62.1525 32.1010 176.7830 126 G 3.7313 7.6584 107.7643 45.9075 0.0000 170.3329 127 N 5.0547 7.6990 117.4765 52.0791 40.0742 173.9176 128 Y 4.9560 9.1972 122.6785 56.7341 40.6483 175.3768 129 T 5.2249 9.0926 118.7997 61.8806 73.7640 172.8649 130 L 5.1583 8.7271 125.2336 52.8656 45.5731 174.9507 131 T 4.9953 8.5531 123.1367 61.8998 70.9713 173.4771 132 L 5.2323 9.2168 126.3652 53.1508 45.3363 175.4917 133 T 5.0306 8.5702 119.8882 61.5517 71.3222 174.5293 134 G 4.1565 9.2903 113.8146 45.4851 0.0000 173.1464 135 G 5.0076 7.2830 109.3383 45.4125 0.0000 170.4328 136 Y 5.5060 7.2806 117.6001 55.0017 41.3903 174.3821 137 W 5.7823 9.0178 127.8047 56.0364 34.0040 173.7094 138 A 4.5237 7.9870 126.2422 50.1564 22.9238 176.5300 139 K 3.7454 8.0817 117.0407 56.8233 32.8230 176.2385 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 0 G 8.58 3.80 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 1 S 7.24 4.52 0.00 3.90 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 2 F 9.87 4.91 0.00 3.33 3.20 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 3 T 9.20 4.11 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 0.57 0.00 0.00 4 P 0.00 3.56 0.00 1.68 1.80 0.00 3.23 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.61 0.00 5 S 7.87 4.55 0.00 3.47 3.34 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 6 G 7.80 4.44 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 7 T 7.80 4.56 4.26 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 1.23 0.00 0.00 8 T 8.41 4.93 4.26 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 1.28 0.00 0.00 9 G 9.33 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 0.00 0.00 0.00 0.00 10 T 8.15 5.24 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 11 T 9.24 4.50 4.17 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 1.13 0.00 0.00 12 K 8.61 5.13 0.00 1.61 1.71 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.40 7.81 13 L 9.13 4.82 0.00 1.68 1.49 0.97 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 14 T 9.07 5.07 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 15 V 9.08 4.87 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 1.11 0.00 0.00 0.80 0.00 0.00 16 T 9.41 5.05 4.26 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 1.23 0.00 0.00 17 E 8.59 4.32 0.00 1.99 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 2.25 0.00 18 E 8.74 3.91 0.00 1.91 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 2.29 2.37 0.00 19 C 7.90 4.36 0.00 2.97 2.86 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 20 Q 8.34 4.56 0.00 2.18 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.50 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 21 V 8.34 4.14 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 0.93 0.00 0.00 22 R 8.40 4.36 0.00 1.83 1.89 0.00 3.42 0.00 0.00 3.24 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 23 V 8.11 3.98 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 0.78 0.00 0.00 0.93 0.00 0.00 24 G 8.60 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 0.00 0.00 0.00 25 D 8.47 4.50 0.00 2.66 2.62 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 26 L 8.18 4.28 0.00 1.60 1.55 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 27 T 7.85 4.61 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 28 V 8.24 3.93 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 1.00 0.00 0.00 1.02 0.00 0.00 29 A 8.46 5.34 1.19 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 0.00 0.00 30 K 9.17 4.72 0.00 1.66 1.64 0.00 1.53 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.35 1.57 7.81 31 T 8.37 5.25 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 1.30 0.00 0.00 32 R 8.84 3.97 0.00 1.94 2.11 0.00 3.32 0.00 0.00 3.36 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 33 G 8.09 3.73 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 0.00 0.00 0.00 34 Q 8.12 4.26 0.00 2.01 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.58 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 35 L 7.80 4.31 0.00 1.89 1.62 0.85 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.42 4.61 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 1.23 0.00 0.00 37 D 8.35 4.30 0.00 2.76 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 38 A 8.73 3.69 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 39 A 7.68 4.32 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 40 P 0.00 4.54 0.00 1.98 2.15 0.00 3.81 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.09 0.00 41 I 8.42 4.35 1.72 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.79 0.85 0.00 0.00 42 G 8.50 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 43 P 0.00 5.06 0.00 1.95 1.90 0.00 3.65 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.86 0.00 44 V 8.30 4.40 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 0.79 0.00 0.00 0.84 0.00 0.00 45 T 8.57 4.78 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 1.18 0.00 0.00 46 V 8.83 4.53 2.52 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 1.37 0.00 0.00 1.09 0.00 0.00 47 Q 8.69 4.61 0.00 2.15 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.85 0.00 0.00 0.00 0.00 0.00 2.29 2.42 0.00 48 A 9.14 4.80 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 49 L 8.61 4.68 0.00 1.55 1.59 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 50 G 8.66 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 0.00 0.00 0.00 0.00 51 C 8.11 4.91 0.00 3.06 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 52 N 8.32 4.68 0.00 2.70 2.87 0.00 0.00 6.86 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 53 A 7.75 4.79 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 54 R 7.75 4.57 0.00 1.61 1.56 0.00 2.21 0.00 0.00 2.57 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.28 0.00 55 Q 8.53 4.45 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.00 0.00 0.00 0.00 0.00 0.00 2.42 2.33 0.00 56 V 8.39 4.08 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 1.21 0.00 0.00 1.14 0.00 0.00 57 A 9.48 5.31 1.18 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 0.00 0.00 58 L 8.84 4.89 0.00 1.80 1.41 1.04 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 59 K 8.74 4.88 0.00 1.43 1.87 0.00 2.25 0.00 0.00 2.06 0.00 0.00 2.98 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.49 1.36 7.81 60 A 8.59 5.32 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 61 D 8.79 4.66 0.00 2.74 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 62 T 8.86 4.22 4.32 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 1.26 0.00 0.00 63 D 8.13 4.87 0.00 2.86 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 64 N 8.47 4.37 0.00 2.92 2.71 0.00 0.00 6.62 7.72 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 65 F 7.44 5.00 0.00 2.64 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 66 E 9.58 4.30 0.00 1.98 1.94 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 2.23 2.24 0.00 67 Q 9.63 3.92 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.42 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 68 G 9.13 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.57 4.55 0.00 2.03 2.00 0.00 1.53 0.00 0.00 1.83 0.00 0.00 2.88 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.42 1.43 7.81 70 F 8.84 5.35 0.00 3.16 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 71 F 8.12 5.26 0.00 2.73 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 9.19 4.36 0.00 1.69 1.80 0.89 0.50 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 73 I 8.95 4.97 2.23 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.83 1.00 0.00 0.00 74 S 8.52 4.69 0.00 3.34 3.58 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 75 D 8.49 4.39 0.00 2.60 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 76 N 7.98 4.68 0.00 2.83 2.98 0.00 0.00 6.96 8.21 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 77 N 8.01 4.79 0.00 2.84 2.92 0.00 0.00 6.60 7.84 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 78 R 6.90 4.43 0.00 1.69 1.78 0.00 3.26 0.00 0.00 3.22 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 79 D 7.77 4.69 0.00 2.85 2.78 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 80 K 8.54 5.27 0.00 1.04 1.28 0.00 1.12 0.00 0.00 0.61 0.00 0.00 2.54 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.13 1.38 7.81 81 L 8.71 4.50 0.00 1.23 1.35 0.76 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 82 Y 8.75 4.84 0.00 3.09 2.96 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 83 V 9.03 5.15 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 0.69 0.00 0.00 0.98 0.00 0.00 84 N 9.24 5.06 0.00 2.68 2.73 0.00 0.00 7.09 6.83 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 85 I 8.01 4.68 0.89 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 -0.09 -0.68 0.00 0.00 86 R 8.80 4.60 0.00 1.79 1.93 0.00 2.68 0.00 0.00 3.16 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.64 0.00 87 P 0.00 5.18 0.00 2.62 1.65 0.00 3.31 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.98 0.00 *89 D 8.34 4.57 0.00 3.01 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 90 N 9.02 4.51 0.00 2.81 2.99 0.00 0.00 6.83 7.57 0.00 0.00 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 S 7.65 4.04 0.00 4.03 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 0.00 92 A 8.41 4.96 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 93 W 8.57 4.85 0.00 2.08 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 0.00 0.00 0.00 94 T 7.74 4.33 2.91 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 0.00 0.00 0.87 0.00 0.00 95 T 8.33 4.79 4.33 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 1.23 0.00 0.00 96 D 9.29 4.22 0.00 2.69 2.50 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 97 N 9.73 4.57 0.00 3.03 2.98 0.00 0.00 7.28 7.98 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 98 G 7.44 2.40 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 0.00 99 V 7.09 4.51 2.31 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 0.91 0.00 0.00 1.07 0.00 0.00 100 F 9.55 5.18 0.00 2.89 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 0.00 101 Y 7.47 5.15 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 K 8.05 2.50 0.00 0.79 0.99 0.00 0.63 0.00 0.00 1.26 0.00 0.00 2.49 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.87 0.21 7.81 103 N 8.02 4.41 0.00 2.58 2.76 0.00 0.00 6.79 8.16 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 0.00 104 D 7.22 4.92 0.00 2.52 2.47 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 0.00 105 V 7.43 4.11 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 0.89 0.00 0.00 0.98 0.00 0.00 106 G 7.84 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 0.00 0.00 0.00 0.00 107 S 8.47 4.58 0.00 3.92 4.11 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 0.00 108 W 7.93 4.37 0.00 3.36 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 0.00 109 G 5.98 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 6.89 3.32 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 0.00 111 T 8.29 5.05 4.26 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 1.24 0.00 0.00 112 I 8.87 4.48 1.90 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.82 0.57 0.00 0.00 113 G 9.62 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 0.00 114 I 7.33 4.92 1.75 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.71 0.76 0.00 0.00 115 Y 8.56 5.08 0.00 2.86 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 0.00 116 V 8.87 3.90 2.27 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 1.02 0.00 0.00 0.97 0.00 0.00 117 D 9.48 4.90 0.00 2.68 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 0.00 118 G 9.63 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 0.00 119 Q 8.74 4.03 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 7.41 0.00 0.00 0.00 0.00 0.00 2.34 2.48 0.00 120 Q 8.94 4.65 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.96 0.00 0.00 0.00 0.00 0.00 2.26 2.61 0.00 121 T 8.06 4.36 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 1.39 0.00 0.00 122 N 7.78 4.82 0.00 2.72 2.86 0.00 0.00 7.04 7.54 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 0.00 123 T 7.64 3.98 4.14 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 0.95 0.00 0.00 124 P 0.00 4.35 0.00 2.25 2.13 0.00 3.86 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.11 0.00 125 P 0.00 4.58 0.00 2.10 2.18 0.00 3.87 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 2.05 2.12 0.00 126 G 7.66 3.73 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 0.00 0.00 0.00 127 N 7.70 5.05 0.00 2.76 2.70 0.00 0.00 6.76 7.48 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 0.00 128 Y 9.20 4.96 0.00 2.96 2.89 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 0.00 129 T 9.09 5.22 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 1.21 0.00 0.00 130 L 8.73 5.16 0.00 1.66 1.40 0.83 0.46 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 0.00 131 T 8.55 5.00 4.55 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 1.26 0.00 0.00 132 L 9.22 5.23 0.00 1.44 1.45 0.69 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 133 T 8.57 5.03 4.47 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 1.33 0.00 0.00 134 G 9.29 4.16 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 0.00 135 G 7.28 5.01 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 0.00 136 Y 7.28 5.51 0.00 2.97 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 0.00 137 W 9.02 5.78 0.00 3.51 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 0.00 138 A 7.99 4.52 1.02 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 0.00 139 K 8.08 3.75 0.00 1.72 1.67 0.00 1.71 0.00 0.00 1.99 0.00 0.00 2.88 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.10 1.33 7.81 * Residues marked with a * may have inaccurate shift predictions.