NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 P 4.3921 0.0000 0.0000 62.4669 32.3466 174.7245 9 S 4.5871 8.5607 116.1974 55.8445 64.9205 172.6431 10 D 5.1814 9.2480 125.7186 52.3118 40.6105 175.0885 11 M 4.2360 7.6858 119.0658 54.5662 32.7749 174.5366 12 P 4.7342 0.0000 0.0000 63.5542 32.5605 175.5603 13 V 5.0640 8.3472 122.0518 60.6165 35.0615 173.3096 14 A 4.8150 9.0301 123.2309 51.3338 23.3009 175.3647 15 H 4.7494 9.3847 121.8512 55.4632 32.5174 172.6196 16 V 4.9444 8.8240 119.5397 59.6263 35.2085 175.2912 17 V 5.4798 8.6967 114.4260 59.2042 36.1964 175.0305 18 A 3.9679 8.3902 124.0097 51.9721 19.0111 177.0582 19 N 4.4208 8.6944 122.3710 52.4490 39.3947 174.2775 20 P 4.3500 0.0000 0.0000 64.9232 31.6325 177.0126 21 Q 4.1876 8.3393 116.9014 56.7220 29.8675 175.9478 22 A 4.6409 7.5240 123.5783 50.4264 18.4574 176.9618 23 E 4.3517 7.9660 120.8798 58.3387 30.4023 178.6930 24 G 3.9377 9.4814 110.3945 45.6860 0.0000 172.5320 25 Q 4.4674 8.0042 116.7066 54.1136 32.9000 174.5949 26 L 4.0901 8.1816 121.1164 53.2558 42.0702 174.7755 27 Q 4.4642 7.5898 127.0033 53.4052 31.4137 174.4435 28 W 4.9762 8.9757 127.7137 56.9431 30.1093 175.8081 29 L 4.9759 9.3959 125.2052 53.5350 44.6638 176.3601 30 N 4.9064 9.0403 121.2104 52.9785 39.3999 175.5357 31 R 4.3201 7.7379 119.8746 54.0664 28.6013 175.1679 32 R 4.5354 7.2829 118.3525 54.5689 33.5093 173.8011 33 A 4.0046 8.4633 125.5675 53.7404 18.8025 177.0248 34 N 4.2304 8.9165 116.2457 54.2036 36.1467 173.8987 35 A 5.1282 7.6192 117.8599 50.2661 22.2635 176.4996 36 L 4.7564 8.7350 118.5302 53.4486 46.6334 176.0705 37 L 4.5770 8.4009 119.2512 54.9575 43.8054 172.7950 38 A 4.4995 8.9783 127.4165 50.5811 23.6573 174.9253 39 N 4.1240 10.0539 111.9481 54.9651 36.2006 176.2851 40 G 4.1145 8.5089 106.6594 45.4861 0.0000 175.2299 41 V 4.0190 7.3591 119.4341 62.9256 32.1818 175.3622 42 E 4.7835 8.7417 125.4726 54.3800 33.7674 174.7795 43 L 5.1422 8.4872 123.6111 53.6051 43.8815 175.8404 44 R 4.5700 8.6073 125.6430 55.5683 33.5620 175.6405 45 D 4.5265 9.5275 122.1422 55.6767 38.3209 173.5717 46 N 4.4399 8.6370 112.1228 54.3448 37.8445 172.7900 47 Q 5.0559 7.9640 114.4859 53.7707 32.9208 174.3615 48 L 4.6909 8.5699 121.9654 53.8475 43.5792 175.7641 49 V 4.6604 8.5964 124.3773 60.8562 33.6714 174.9147 50 V 3.7653 8.4533 129.1849 62.5352 31.9137 175.2093 51 P 4.2761 0.0000 0.0000 65.1959 31.5947 176.5049 52 S 4.7220 7.5244 109.1124 56.2570 65.9928 173.5751 53 E 5.0541 8.2110 118.8203 55.6597 30.0285 176.7598 54 G 4.0731 8.1077 107.6591 44.7999 0.0000 170.9089 55 L 4.9960 7.7718 119.7741 54.1218 42.8187 175.7888 56 Y 5.1119 9.3801 122.7192 55.9891 41.1526 174.7738 57 L 4.9529 8.8521 126.1338 54.5079 43.7037 175.3267 58 I 5.3051 9.2404 127.3303 59.9291 40.7769 174.1129 59 Y 5.2831 8.2591 122.5756 56.6642 41.8080 173.2107 60 S 5.0140 8.4174 112.2832 57.6691 66.6327 173.7066 61 Q 4.9227 8.5333 126.2698 54.3613 32.3838 174.2620 62 V 4.6396 8.5015 117.5618 59.2984 36.3330 174.1606 63 L 5.0801 8.0720 123.9261 53.4274 45.0234 175.0453 64 F 5.5972 9.2747 125.0448 56.1590 41.9999 174.7615 65 S 3.8333 8.9791 115.4735 57.1747 65.9277 173.3703 66 G 3.5023 5.9725 106.4775 45.1648 0.0000 171.6039 67 Q 4.5282 8.4800 122.3120 55.0307 30.0929 176.5252 68 G 4.0462 8.7187 116.3830 45.1898 0.0000 171.2738 69 C 4.8841 8.4111 115.7341 54.1307 40.1972 172.7533 70 P 4.5419 0.0000 0.0000 62.6949 31.5412 177.4443 71 S 4.2677 8.6715 115.0794 60.5867 62.6827 174.2590 72 T 4.5530 6.9356 117.0548 61.3832 70.0480 173.7665 73 H 4.1542 8.8053 125.5837 56.4060 30.2528 174.7184 74 V 4.3772 7.8915 119.8164 59.3546 33.9340 174.8058 75 L 4.7359 8.1682 122.5325 52.8688 44.4100 175.6150 76 L 4.5910 8.7994 124.1054 53.1554 43.7918 175.7182 77 T 5.1849 9.3819 113.7250 60.2949 72.6282 172.4647 78 H 5.6348 9.0066 122.4009 55.1730 33.6725 172.1554 79 T 5.1294 9.1667 114.9040 60.2162 72.7170 172.4936 80 I 4.7988 8.8568 125.1179 59.5765 39.5998 174.8871 81 S 5.1376 9.0104 121.4748 56.3524 66.8214 172.7203 82 R 4.8993 8.9340 121.3296 54.5993 32.9543 174.4091 83 I 4.8472 8.8840 127.0122 59.6643 40.3021 175.0301 84 S 5.6383 8.7528 122.0347 56.2719 65.1726 175.4058 85 T 4.0834 8.5864 110.4922 63.7876 68.8583 175.1502 86 T 4.2546 7.5949 111.0908 61.4933 69.0848 173.9430 87 H 4.2188 7.7337 117.8250 56.0592 32.8886 173.8400 88 N 4.5682 8.9903 123.7512 54.0580 38.5087 174.7550 89 Q 4.2961 7.7001 120.4589 54.0962 29.0385 173.5521 90 P 4.6734 0.0000 0.0000 62.7505 32.2809 176.2098 91 V 4.4007 8.4334 123.6297 59.6840 34.0629 174.5348 92 N 4.8070 8.8116 123.0454 53.4019 38.3406 174.7426 93 L 4.3415 8.6926 124.8233 56.2382 43.1610 177.5874 94 L 4.9001 7.4780 117.3216 53.1924 45.9997 175.5965 95 S 5.1275 8.6252 116.0124 57.3968 65.6172 172.7763 96 A 4.8588 8.9598 125.9929 50.8879 22.9035 175.0824 97 I 5.1140 8.2285 118.7731 59.7601 41.5055 175.0351 98 R 4.6728 8.9798 124.3844 54.8447 34.0333 174.0448 99 S 4.7977 8.4614 120.7006 55.7868 63.3784 171.9722 100 P 4.1026 0.0000 0.0000 64.5819 31.2468 177.5104 101 C 4.8434 7.2777 114.4133 54.8782 43.2175 173.4063 102 Q 4.0003 8.5607 123.3122 57.4056 28.6521 175.0520 103 R 4.1581 7.0712 113.6744 57.2627 33.4699 175.3249 *111 A 4.1936 7.4699 121.9164 52.0990 19.8747 175.1686 112 N 4.9834 7.6897 119.7108 50.5359 41.0261 174.0823 113 P 4.8745 0.0000 0.0000 62.6310 32.3342 175.5717 114 W 5.1053 8.4441 120.4930 55.0854 31.3987 174.1892 115 Y 5.2458 8.7671 117.4311 56.6570 41.6486 174.8082 116 E 4.8575 9.9933 123.2006 54.4208 33.3296 172.7389 117 P 5.3128 0.0000 0.0000 61.7381 33.6575 175.2748 118 I 4.8011 8.9034 122.1898 59.8175 40.8638 173.6213 119 Y 5.1606 8.9210 127.4112 55.7323 41.3954 174.5060 120 L 4.9230 7.9239 125.5310 53.0472 45.9452 175.7975 121 G 4.4013 8.4931 105.3935 45.9302 0.0000 172.5657 122 G 4.2474 8.9748 110.2285 45.8504 0.0000 171.8599 123 V 5.0661 8.0815 119.8963 61.2584 33.0859 174.9606 124 F 4.9444 9.4388 125.7201 55.6837 43.7453 173.5320 125 Q 4.8096 8.9554 123.8889 56.0308 29.4947 174.9324 126 L 4.9961 9.5397 126.2245 53.0294 45.8888 175.2929 127 E 5.1420 9.6683 120.5787 53.4365 33.0056 174.1186 128 P 4.4255 0.0000 0.0000 64.6511 31.5327 176.9538 129 G 3.9524 8.9366 110.4493 45.1340 0.0000 173.4590 130 D 4.6442 7.9281 120.5396 54.5323 42.2121 175.4610 131 R 5.0221 9.0740 121.8991 54.4276 32.9871 174.7950 132 L 5.1938 8.9372 124.3354 52.9869 44.4157 175.3832 133 S 5.1056 9.0779 117.9110 56.3146 65.6321 172.5541 134 A 4.6976 8.4372 127.9430 50.2957 20.1341 174.9838 135 E 4.9893 9.1308 120.8999 55.2646 33.5845 175.4957 136 I 5.6274 8.4981 113.9599 58.3463 40.4139 174.8284 137 N 4.5959 8.4552 119.6181 54.0031 38.6338 175.7022 138 R 4.7198 7.9440 118.9172 53.2540 30.3905 173.9064 139 P 4.4693 0.0000 0.0000 64.7744 31.9405 178.8079 140 D 4.4395 8.0102 117.2952 55.0582 39.7899 175.9340 141 Y 4.8968 7.9141 116.7914 57.6781 40.1083 175.5402 142 L 4.2517 7.7517 122.3915 55.3813 42.9423 175.9558 143 D 4.5518 9.0414 125.6840 51.9211 43.2849 175.1756 144 F 5.0326 7.3839 123.6028 56.2468 38.5209 177.2504 145 A 4.0657 8.4120 126.7082 55.4281 18.1269 178.1794 146 E 4.8247 7.7051 115.6233 53.9733 32.9665 175.1756 147 S 4.4136 8.5056 119.2898 60.0002 63.3867 175.1474 148 G 4.1377 9.0048 110.9010 45.9797 0.0000 174.3135 149 Q 4.3652 7.6502 118.8502 57.1860 29.5344 176.1886 150 V 4.7415 7.8566 117.8947 61.3556 34.7227 173.7048 151 Y 5.7489 8.8007 124.9257 56.4353 42.3115 173.5320 152 F 5.0508 9.0497 122.0104 57.0504 43.0770 173.2735 153 G 3.9259 8.4387 112.5877 45.0208 0.0000 171.1236 154 I 5.2659 8.4377 112.3989 59.7779 41.6071 173.8558 155 I 5.0038 8.7601 123.0965 59.7038 41.7114 173.5535 156 A 3.6412 8.6254 132.3324 51.4899 18.8927 177.3012 157 L 4.2139 8.7158 122.4163 54.7856 41.5043 176.7725 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 8 P 0.00 4.39 0.00 2.05 2.00 0.00 3.58 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.07 0.00 9 S 8.56 4.59 0.00 3.84 3.68 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 10 D 9.25 5.18 0.00 2.77 2.67 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 0.00 0.00 0.00 0.00 11 M 7.69 4.24 0.00 2.13 2.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.62 0.00 12 P 0.00 4.73 0.00 2.24 2.15 0.00 3.51 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 2.19 2.31 0.00 13 V 8.35 5.06 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 0.68 0.00 0.00 1.03 0.00 0.00 14 A 9.03 4.81 1.01 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 15 H 9.38 4.75 0.00 3.28 3.18 0.00 5.73 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 V 8.82 4.94 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 0.66 0.00 0.00 0.66 0.00 0.00 17 V 8.70 5.48 2.35 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 0.90 0.00 0.00 1.01 0.00 0.00 18 A 8.39 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 N 8.69 4.42 0.00 2.74 2.50 0.00 0.00 6.70 7.41 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 20 P 0.00 4.35 0.00 2.28 2.23 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 1.97 1.99 0.00 21 Q 8.34 4.19 0.00 2.04 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.42 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 22 A 7.52 4.64 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 23 E 7.97 4.35 0.00 2.02 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 2.39 2.63 0.00 24 G 9.48 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 25 Q 8.00 4.47 0.00 2.14 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 26 L 8.18 4.09 0.00 1.35 1.36 -0.41 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 27 Q 7.59 4.46 0.00 1.99 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.86 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 28 W 8.98 4.98 0.00 3.28 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 29 L 9.40 4.98 0.00 1.70 1.67 0.93 0.72 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 30 N 9.04 4.91 0.00 2.84 2.89 0.00 0.00 6.19 7.66 0.00 0.00 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 R 7.74 4.32 0.00 1.83 1.95 0.00 3.25 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 32 R 7.28 4.54 0.00 1.82 1.74 0.00 3.21 0.00 0.00 3.38 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 33 A 8.46 4.00 1.26 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 0.00 0.00 34 N 8.92 4.23 0.00 2.90 2.91 0.00 0.00 6.70 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 35 A 7.62 5.13 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 36 L 8.73 4.76 0.00 1.62 1.51 0.94 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.40 4.58 0.00 1.55 1.51 0.86 0.98 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 38 A 8.98 4.50 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 39 N 10.05 4.12 0.00 2.98 3.00 0.00 0.00 7.01 7.99 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 40 G 8.51 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 0.00 0.00 0.00 41 V 7.36 4.02 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 0.72 0.00 0.00 1.02 0.00 0.00 42 E 8.74 4.78 0.00 1.88 1.76 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 2.19 2.38 0.00 43 L 8.49 5.14 0.00 1.58 1.57 1.06 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 44 R 8.61 4.57 0.00 1.85 1.76 0.00 3.51 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 45 D 9.53 4.53 0.00 2.83 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 46 N 8.64 4.44 0.00 2.89 2.99 0.00 0.00 7.03 7.08 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 47 Q 7.96 5.06 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.27 6.67 0.00 0.00 0.00 0.00 0.00 2.34 2.60 0.00 48 L 8.57 4.69 0.00 1.28 1.27 -0.33 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 49 V 8.60 4.66 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 0.95 0.00 0.00 0.91 0.00 0.00 50 V 8.45 3.77 1.90 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 0.73 0.00 0.00 0.43 0.00 0.00 51 P 0.00 4.28 0.00 2.15 2.11 0.00 3.87 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.25 0.00 52 S 7.52 4.72 0.00 4.11 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 53 E 8.21 5.05 0.00 2.21 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 0.00 2.31 2.37 0.00 54 G 8.11 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.77 5.00 0.00 1.58 1.63 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 56 Y 9.38 5.11 0.00 2.93 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 57 L 8.85 4.95 0.00 1.89 1.69 1.12 0.93 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 58 I 9.24 5.31 2.05 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 1.33 1.07 0.96 0.00 0.00 59 Y 8.26 5.28 0.00 3.13 3.17 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 0.00 60 S 8.42 5.01 0.00 3.67 3.48 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 0.00 0.00 0.00 0.00 61 Q 8.53 4.92 0.00 1.89 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.48 0.00 0.00 0.00 0.00 0.00 2.17 2.46 0.00 62 V 8.50 4.64 1.43 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 0.35 0.00 0.00 0.53 0.00 0.00 63 L 8.07 5.08 0.00 1.86 1.65 1.13 1.04 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 64 F 9.27 5.60 0.00 3.25 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 65 S 8.98 3.83 0.00 2.72 3.04 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 0.00 0.00 0.00 66 G 5.97 3.50 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 0.00 67 Q 8.48 4.53 0.00 1.97 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.88 0.00 0.00 0.00 0.00 0.00 2.37 2.29 0.00 68 G 8.72 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 69 C 8.41 4.88 0.00 2.96 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 70 P 0.00 4.54 0.00 2.39 2.08 0.00 3.55 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 71 S 8.67 4.27 0.00 3.84 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 72 T 6.94 4.55 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 1.22 0.00 0.00 73 H 8.81 4.15 0.00 3.05 3.19 0.00 5.68 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 7.89 4.38 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 0.91 0.00 0.00 0.59 0.00 0.00 75 L 8.17 4.74 0.00 1.40 1.45 0.91 0.88 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 76 L 8.80 4.59 0.00 1.32 0.76 0.54 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 77 T 9.38 5.18 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 1.20 0.00 0.00 78 H 9.01 5.63 0.00 3.38 3.21 0.00 5.57 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 T 9.17 5.13 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 1.22 0.00 0.00 80 I 8.86 4.80 1.70 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.50 0.77 0.00 0.00 81 S 9.01 5.14 0.00 3.77 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 82 R 8.93 4.90 0.00 1.67 1.67 0.00 2.95 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.47 0.00 83 I 8.88 4.85 1.86 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 1.27 0.56 0.91 0.00 0.00 84 S 8.75 5.64 0.00 3.89 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 85 T 8.59 4.08 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 86 T 7.59 4.25 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 1.22 0.00 0.00 87 H 7.73 4.22 0.00 3.15 3.12 0.00 5.58 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 N 8.99 4.57 0.00 2.76 2.85 0.00 0.00 7.09 7.69 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 89 Q 7.70 4.30 0.00 2.14 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.83 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 90 P 0.00 4.67 0.00 1.96 1.96 0.00 3.67 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 91 V 8.43 4.40 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 0.89 0.00 0.00 0.91 0.00 0.00 92 N 8.81 4.81 0.00 2.59 2.78 0.00 0.00 7.09 7.85 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 93 L 8.69 4.34 0.00 1.01 0.59 0.09 0.89 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 94 L 7.48 4.90 0.00 1.48 1.51 1.04 1.03 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 95 S 8.63 5.13 0.00 3.82 3.68 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 96 A 8.96 4.86 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 97 I 8.23 5.11 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 1.23 0.72 0.93 0.00 0.00 98 R 8.98 4.67 0.00 1.90 1.66 0.00 3.08 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.52 0.00 99 S 8.46 4.80 0.00 3.76 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 0.00 100 P 0.00 4.10 0.00 0.49 0.93 0.00 3.48 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.89 0.00 101 C 7.28 4.84 0.00 2.70 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 0.00 102 Q 8.56 4.00 0.00 1.96 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.88 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 103 R 7.07 4.16 0.00 1.73 1.72 0.00 3.35 0.00 0.00 3.21 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.63 0.00 *111 A 7.47 4.19 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 0.00 112 N 7.69 4.98 0.00 2.72 2.80 0.00 0.00 6.74 8.03 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 0.00 113 P 0.00 4.87 0.00 2.03 1.97 0.00 3.76 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.01 0.00 114 W 8.44 5.11 0.00 3.39 3.18 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 0.00 115 Y 8.77 5.25 0.00 2.85 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 0.00 116 E 9.99 4.86 0.00 2.18 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 0.00 2.49 2.32 0.00 117 P 0.00 5.31 0.00 2.19 2.15 0.00 3.85 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 2.05 2.09 0.00 118 I 8.90 4.80 2.06 0.00 0.00 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 1.28 1.28 1.07 0.00 0.00 119 Y 8.92 5.16 0.00 3.05 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 0.00 120 L 7.92 4.92 0.00 1.42 1.41 0.94 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 121 G 8.49 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 0.00 0.00 0.00 0.00 122 G 8.97 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 0.00 0.00 0.00 0.00 123 V 8.08 5.07 1.97 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 0.83 0.00 0.00 0.95 0.00 0.00 124 F 9.44 4.94 0.00 3.03 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 0.00 125 Q 8.96 4.81 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.52 0.00 126 L 9.54 5.00 0.00 1.46 1.33 0.43 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 127 E 9.67 5.14 0.00 1.90 1.82 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 2.24 2.38 0.00 128 P 0.00 4.43 0.00 2.18 2.09 0.00 3.80 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 2.00 1.99 0.00 129 G 8.94 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 0.00 130 D 7.93 4.64 0.00 2.60 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 0.00 131 R 9.07 5.02 0.00 1.68 1.80 0.00 3.08 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 132 L 8.94 5.19 0.00 1.60 1.68 0.74 0.33 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 0.00 133 S 9.08 5.11 0.00 3.87 3.63 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 0.00 134 A 8.44 4.70 -0.11 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 0.00 0.00 135 E 9.13 4.99 0.00 1.90 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 2.24 2.23 0.00 136 I 8.50 5.63 2.25 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 1.04 1.88 0.92 0.00 0.00 137 N 8.46 4.60 0.00 2.82 3.01 0.00 0.00 6.71 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 0.00 138 R 7.94 4.72 0.00 1.96 2.18 0.00 3.31 0.00 0.00 3.42 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 139 P 0.00 4.47 0.00 2.41 2.32 0.00 3.78 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.95 0.00 140 D 8.01 4.44 0.00 2.53 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 0.00 141 Y 7.91 4.90 0.00 3.39 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 0.00 142 L 7.75 4.25 0.00 1.82 1.51 0.97 1.08 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 0.00 143 D 9.04 4.55 0.00 2.50 2.59 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 0.00 144 F 7.38 5.03 0.00 3.20 3.18 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 0.00 145 A 8.41 4.07 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 0.00 146 E 7.71 4.82 0.00 2.09 1.89 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 2.21 2.32 0.00 147 S 8.51 4.41 0.00 3.95 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 0.00 148 G 9.00 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 0.00 0.00 0.00 0.00 149 Q 7.65 4.37 0.00 2.37 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.57 0.00 0.00 0.00 0.00 0.00 2.46 2.50 0.00 150 V 7.86 4.74 2.18 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 0.99 0.00 0.00 1.00 0.00 0.00 151 Y 8.80 5.75 0.00 3.13 3.16 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 0.00 152 F 9.05 5.05 0.00 1.51 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 0.00 153 G 8.44 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 0.00 154 I 8.44 5.27 1.94 0.00 0.00 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 0.87 0.77 0.59 0.00 0.00 155 I 8.76 5.00 1.96 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 1.18 1.10 1.02 0.00 0.00 156 A 8.63 3.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 L 8.72 4.21 0.00 1.55 1.54 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.