NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 A 4.3018 8.2644 123.5838 51.9042 19.9162 176.3848 1 M 3.9590 8.6074 123.2347 54.8430 32.9627 173.6390 2 A 4.7076 8.4845 127.8488 50.4360 22.5281 175.0472 3 N 4.8038 8.3759 118.3593 52.1188 40.1126 175.8274 4 F 4.2847 9.0776 127.8336 61.6759 39.1856 176.8212 5 E 3.9785 8.4527 117.4648 59.2657 29.4490 178.6645 6 D 4.4843 7.9920 119.1865 57.2543 40.8832 178.4579 7 F 4.1354 8.1161 120.6703 61.3193 39.2087 177.0176 8 L 3.6730 7.5003 117.4597 57.2690 41.3836 179.1496 9 T 3.8826 7.2640 108.5738 63.0162 69.1378 174.7922 10 L 3.9079 6.8483 121.8079 54.0845 42.5171 176.0948 11 D 4.5363 8.5921 122.9904 52.6693 42.2873 174.1036 12 L 4.9094 7.9197 125.7303 53.4190 43.5996 176.0305 13 R 5.2560 8.9564 122.0458 54.4689 35.0288 174.3415 14 I 4.8001 8.7341 122.2075 60.8356 38.9598 175.3639 15 G 3.7860 8.7038 111.6514 44.9896 0.0000 171.0883 16 T 4.9941 7.9492 116.5746 61.1797 71.4195 174.3080 17 V 4.1758 8.8373 127.7092 63.3231 31.9919 176.2257 18 T 4.7354 9.0330 117.7359 62.2491 70.8091 173.8193 19 H 4.9189 7.9928 120.5065 55.1012 33.5270 171.9551 20 A 5.2789 8.0416 125.1671 50.6910 22.1917 175.2745 21 E 4.6246 9.1316 119.4685 54.7975 33.4822 173.7944 22 E 4.8149 8.4388 121.8744 54.9999 32.2641 174.6161 23 F 4.2349 9.0796 124.6198 58.5406 40.5785 175.0280 *29 P 4.1861 0.0000 0.0000 62.3923 31.0804 174.4982 30 A 4.9462 7.8123 126.5764 51.3237 23.3184 174.8057 31 I 4.5615 8.6700 119.9211 59.5800 40.1360 175.5361 32 R 4.3189 8.6083 126.4481 55.5450 31.2035 175.5391 33 L 5.3736 9.2887 123.9826 52.8621 45.5923 174.9712 34 E 5.2168 9.0896 123.1950 54.6406 32.5756 174.7458 35 I 4.9396 8.7547 126.1422 59.6526 42.1787 173.7043 36 D 4.8080 8.9262 127.0487 52.9131 42.4526 176.4911 37 F 4.6872 8.9020 126.4693 57.1795 40.6759 177.2836 38 G 4.0003 8.2218 112.4080 46.1888 0.0000 178.3458 39 E 3.9618 9.0310 123.2501 58.9189 29.3055 177.8156 40 L 4.0381 7.7491 116.9685 55.3362 42.2793 177.6443 41 G 3.8704 8.3274 107.4286 44.4273 0.0000 171.8877 42 M 4.9837 8.2385 117.6453 55.0924 32.8448 176.4931 43 K 4.9636 9.4050 121.2946 55.0110 37.2447 175.4237 44 Q 5.2041 9.3199 121.7399 55.1667 31.1746 174.7786 45 S 5.0145 9.3488 115.6593 57.0630 66.5892 172.3702 46 S 5.3481 9.0240 120.7523 56.6789 63.7884 173.0721 47 A 4.6867 8.9162 128.4579 49.9439 21.9424 176.2252 48 Q 4.4939 8.7909 123.0409 54.0572 27.4587 175.7808 49 I 4.7027 7.3291 110.7085 60.6790 38.6553 178.6435 50 T 4.0573 8.1410 112.6925 64.6005 69.3056 175.4844 51 K 4.0423 8.3444 123.1216 59.0424 32.1733 177.3047 52 R 4.3404 7.8952 113.6157 55.6858 31.9378 175.2862 53 Y 4.6796 7.5525 115.6028 55.9753 40.7009 174.6580 54 N 4.9450 8.7563 121.5348 50.9125 40.5934 174.3352 55 P 4.2502 0.0000 0.0000 65.9303 31.5311 178.3924 56 E 3.9416 8.3844 117.0786 59.5872 29.4746 178.9310 57 D 4.4518 7.9018 117.0155 56.8689 41.0961 177.5135 58 L 4.3496 7.8723 117.8457 55.2834 42.3553 176.5988 59 I 4.0084 7.1859 120.3198 62.4722 37.1337 176.5603 60 G 3.9024 9.1704 114.5775 45.0043 0.0000 173.1478 61 Q 4.0946 8.0888 122.7190 56.1901 30.1120 174.8320 62 Q 4.9563 8.6387 125.7387 54.9678 30.3808 174.8918 63 I 4.7748 8.6693 116.9093 59.0351 41.7449 173.9942 64 V 5.0178 8.2466 120.7133 61.1470 33.9403 173.9981 65 A 5.2027 9.0499 128.3684 50.2709 23.3338 174.7576 66 V 4.1090 8.6457 120.9330 62.4424 32.4128 176.7895 67 V 4.1140 8.3523 120.7661 60.4911 32.5982 176.0479 68 N 4.8466 7.3624 117.7212 52.3167 37.6796 174.5274 69 F 4.8756 7.7146 116.4062 56.6402 40.3422 174.0483 70 P 4.4168 0.0000 0.0000 61.9686 31.6901 174.8692 71 P 4.8604 0.0000 0.0000 62.8765 32.3537 175.3849 72 K 4.7438 8.9056 118.9507 55.3040 36.3637 174.9809 73 R 5.0180 8.5620 120.3963 54.6201 32.1243 175.8905 74 V 4.1701 8.8367 123.3896 61.7500 33.2963 175.2355 75 A 3.8241 9.8961 131.7787 53.1408 16.0443 177.5009 76 G 3.9894 8.4667 108.6079 46.4230 0.0000 174.0439 77 F 4.4156 8.1720 123.3377 56.9325 40.0198 174.1682 78 K 4.2971 8.0082 129.8106 56.5188 32.7297 175.6704 79 S 4.6811 9.3834 124.0951 57.1534 63.2884 173.9623 80 E 4.5461 9.2240 127.0550 56.7601 30.9113 176.6641 81 V 4.6192 7.7026 110.7116 59.3420 36.1812 174.9239 82 L 4.5871 8.7080 125.7403 53.6077 43.3556 175.4737 83 V 4.3813 8.4391 127.3859 62.5518 32.5489 175.1638 84 L 4.6799 8.9700 128.4164 54.0116 43.4564 175.9096 85 G 4.4492 8.4330 108.0077 45.0650 0.0000 172.4376 86 G 4.0524 9.0554 108.7785 45.4464 0.0000 173.3294 87 V 4.9443 8.5759 123.2705 59.4392 32.0796 173.2123 88 P 4.5310 0.0000 0.0000 64.0703 32.3155 176.1665 89 E 4.6461 7.6412 115.1218 54.6116 31.9655 174.1748 90 A 4.1869 8.3785 123.5350 53.9384 18.7661 178.3610 91 G 3.9788 9.1143 110.9226 44.8538 0.0000 172.4846 92 D 5.0849 7.9276 119.7414 52.5010 43.8962 175.1454 93 V 4.8088 8.2909 123.3599 61.3547 35.0624 173.9886 94 V 4.6868 8.8400 127.6357 60.8769 33.6749 174.9242 95 L 4.4312 8.9579 128.4814 54.7951 42.1490 177.1503 96 L 4.5406 8.2736 122.3899 54.8441 42.4842 176.3906 97 Q 4.6064 8.2769 118.1711 53.9018 30.9096 172.6647 98 P 4.4533 0.0000 0.0000 62.6173 32.0212 177.0202 99 N 4.4443 8.6169 118.2452 55.8482 39.2954 174.4362 100 M 4.8326 7.2466 116.3709 53.2184 35.6263 174.0273 101 E 4.2288 8.7334 124.2509 56.4184 30.3381 176.0433 102 L 4.8995 8.5452 124.8600 51.7813 45.4495 174.6906 103 P 4.3667 0.0000 0.0000 62.3513 31.6828 176.1815 104 N 4.4294 8.6056 119.8662 55.0321 38.9060 176.1733 105 G 4.1521 9.2455 110.9174 45.3337 0.0000 173.8360 106 T 3.9869 7.6685 117.3484 63.9923 69.3786 173.8069 107 K 4.6535 8.6794 125.3453 56.2650 33.2488 176.2175 108 I 4.6380 8.1485 124.8103 59.8201 39.0664 176.1808 109 S 4.4054 8.4414 119.4865 58.9043 62.7115 173.8239 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 A 8.26 4.30 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 1 M 8.61 3.96 0.00 2.07 1.98 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.67 0.00 2 A 8.48 4.71 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 3 N 8.38 4.80 0.00 2.78 2.94 0.00 0.00 6.55 7.71 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 4 F 9.08 4.28 0.00 3.15 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 5 E 8.45 3.98 0.00 2.12 2.02 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 2.57 2.56 0.00 6 D 7.99 4.48 0.00 2.87 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 7 F 8.12 4.14 0.00 3.00 2.94 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 8 L 7.50 3.67 0.00 1.64 1.54 1.03 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 9 T 7.26 3.88 4.18 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 1.24 0.00 0.00 10 L 6.85 3.91 0.00 1.37 1.33 0.95 0.75 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 11 D 8.59 4.54 0.00 2.58 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 0.00 0.00 0.00 0.00 12 L 7.92 4.91 0.00 1.59 1.55 0.74 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.96 5.26 0.00 1.68 1.92 0.00 3.49 0.00 0.00 3.14 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.56 0.00 14 I 8.73 4.80 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.93 0.90 0.00 0.00 15 G 8.70 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 16 T 7.95 4.99 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 1.15 0.00 0.00 17 V 8.84 4.18 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 0.87 0.00 0.00 0.90 0.00 0.00 18 T 9.03 4.74 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 19 H 7.99 4.92 0.00 3.27 3.15 0.00 5.86 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 20 A 8.04 5.28 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 21 E 9.13 4.62 0.00 1.81 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 2.13 2.15 0.00 22 E 8.44 4.81 0.00 1.90 1.73 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 2.17 2.47 0.00 23 F 9.08 4.23 0.00 3.07 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 *29 P 0.00 4.19 0.00 2.26 2.28 0.00 3.67 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 30 A 7.81 4.95 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 31 I 8.67 4.56 1.86 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 1.23 0.69 0.93 0.00 0.00 32 R 8.61 4.32 0.00 1.53 0.76 0.00 3.00 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.18 0.00 33 L 9.29 5.37 0.00 1.70 1.56 0.92 0.44 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 34 E 9.09 5.22 0.00 2.17 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 2.23 2.33 0.00 35 I 8.75 4.94 1.81 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.65 0.16 0.00 0.00 36 D 8.93 4.81 0.00 2.63 2.43 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 37 F 8.90 4.69 0.00 3.32 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 38 G 8.22 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 0.00 0.00 0.00 0.00 39 E 9.03 3.96 0.00 1.98 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 2.33 2.36 0.00 40 L 7.75 4.04 0.00 1.85 1.67 0.77 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.33 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 0.00 0.00 0.00 42 M 8.24 4.98 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.53 0.00 43 K 9.40 4.96 0.00 1.95 1.73 0.00 1.62 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.50 1.45 7.81 44 Q 9.32 5.20 0.00 1.88 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.72 0.00 0.00 0.00 0.00 0.00 2.38 2.24 0.00 45 S 9.35 5.01 0.00 3.98 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 46 S 9.02 5.35 0.00 4.22 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 47 A 8.92 4.69 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 48 Q 8.79 4.49 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.43 0.00 0.00 0.00 0.00 0.00 2.52 2.33 0.00 49 I 7.33 4.70 2.02 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.02 0.92 0.00 0.00 50 T 8.14 4.06 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 1.22 0.00 0.00 51 K 8.34 4.04 0.00 1.87 1.90 0.00 1.61 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.51 7.81 52 R 7.90 4.34 0.00 1.12 1.37 0.00 3.04 0.00 0.00 3.07 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.66 0.00 53 Y 7.55 4.68 0.00 3.09 2.84 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 54 N 8.76 4.95 0.00 2.96 2.92 0.00 0.00 6.66 7.44 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 55 P 0.00 4.25 0.00 2.11 2.06 0.00 3.59 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.09 0.00 56 E 8.38 3.94 0.00 2.06 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 2.38 2.37 0.00 57 D 7.90 4.45 0.00 2.93 2.84 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 58 L 7.87 4.35 0.00 1.85 1.64 0.89 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 59 I 7.19 4.01 1.85 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 1.20 0.70 0.89 0.00 0.00 60 G 9.17 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 0.00 0.00 0.00 61 Q 8.09 4.09 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.84 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 62 Q 8.64 4.96 0.00 1.95 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.54 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 63 I 8.67 4.77 1.87 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.67 0.83 0.00 0.00 64 V 8.25 5.02 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 1.12 0.00 0.00 0.97 0.00 0.00 65 A 9.05 5.20 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 66 V 8.65 4.11 1.85 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 -0.11 0.00 0.00 0.88 0.00 0.00 67 V 8.35 4.11 1.63 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 -0.07 0.00 0.00 0.67 0.00 0.00 68 N 7.36 4.85 0.00 2.63 2.65 0.00 0.00 6.11 7.43 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 69 F 7.71 4.88 0.00 3.05 2.81 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 0.00 0.00 0.00 70 P 0.00 4.42 0.00 2.05 1.99 0.00 3.77 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 2.04 2.11 0.00 71 P 0.00 4.86 0.00 2.04 2.03 0.00 3.71 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 72 K 8.91 4.74 0.00 1.80 1.88 0.00 1.28 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.33 1.41 7.81 73 R 8.56 5.02 0.00 1.71 1.90 0.00 3.38 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 74 V 8.84 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 1.11 0.00 0.00 1.00 0.00 0.00 75 A 9.90 3.82 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 76 G 8.47 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 77 F 8.17 4.42 0.00 3.08 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 78 K 8.01 4.30 0.00 1.61 1.57 0.00 1.72 0.00 0.00 1.53 0.00 0.00 2.83 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.30 1.35 7.81 79 S 9.38 4.68 0.00 4.01 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 80 E 9.22 4.55 0.00 1.95 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 2.21 2.18 0.00 81 V 7.70 4.62 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 0.43 0.00 0.00 1.14 0.00 0.00 82 L 8.71 4.59 0.00 2.02 1.76 0.99 1.02 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 83 V 8.44 4.38 2.12 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 0.84 0.00 0.00 1.02 0.00 0.00 84 L 8.97 4.68 0.00 1.68 1.60 0.98 1.01 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 85 G 8.43 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 0.00 0.00 0.00 0.00 86 G 9.06 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 87 V 8.58 4.94 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 1.00 0.00 0.00 88 P 0.00 4.53 0.00 2.23 2.17 0.00 3.88 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 2.13 1.96 0.00 89 E 7.64 4.65 0.00 2.13 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 0.00 2.28 2.30 0.00 90 A 8.38 4.19 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 91 G 9.11 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 92 D 7.93 5.08 0.00 2.82 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 93 V 8.29 4.81 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 0.89 0.00 0.00 1.06 0.00 0.00 94 V 8.84 4.69 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 1.10 0.00 0.00 0.97 0.00 0.00 95 L 8.96 4.43 0.00 1.49 1.50 0.20 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 96 L 8.27 4.54 0.00 1.60 1.62 0.96 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 97 Q 8.28 4.61 0.00 2.19 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.00 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 98 P 0.00 4.45 0.00 2.48 2.23 0.00 3.69 0.00 0.00 3.70 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 99 N 8.62 4.44 0.00 2.72 2.90 0.00 0.00 6.71 7.65 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 0.00 100 M 7.25 4.83 0.00 2.15 1.85 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.46 0.00 101 E 8.73 4.23 0.00 1.96 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 2.28 2.50 0.00 102 L 8.55 4.90 0.00 1.63 1.53 0.94 1.10 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 0.00 103 P 0.00 4.37 0.00 2.18 1.97 0.00 3.61 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 104 N 8.61 4.43 0.00 2.77 2.89 0.00 0.00 7.17 7.95 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 0.00 105 G 9.25 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 0.00 106 T 7.67 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 1.23 0.00 0.00 107 K 8.68 4.65 0.00 1.64 1.71 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.39 1.45 7.81 108 I 8.15 4.64 1.90 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.58 1.01 0.00 0.00 109 S 8.44 4.41 0.00 4.10 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 * Residues marked with a * may have inaccurate shift predictions.