NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 32 E 4.3206 8.3033 121.4702 55.8343 31.0398 176.5017 33 L 3.7711 8.5245 126.6533 57.0915 41.6608 177.9091 34 S 4.0868 8.9378 113.9404 61.4239 62.8583 175.6607 35 Q 3.9812 8.0498 120.3488 58.9341 28.5019 178.2784 36 E 3.9534 7.7840 119.8865 59.4549 29.6973 179.1605 37 R 4.0686 8.3200 118.2384 59.3251 30.1781 179.1365 38 T 3.9074 8.3021 115.8480 66.5776 68.3531 176.6184 39 A 4.0621 8.2241 122.7482 54.9468 18.3483 179.6798 40 R 3.8793 8.0405 117.5070 59.6236 30.1636 178.8053 41 L 4.0102 7.9006 118.4325 57.7865 41.5961 179.2188 42 N 4.3492 8.0860 116.0942 56.1980 38.5297 177.0338 43 E 3.9493 8.5044 121.0291 59.1705 29.6502 178.6008 44 L 3.9736 8.0870 120.3742 58.3475 42.0548 179.0417 45 Q 3.9788 8.1405 118.0061 58.8881 28.7092 178.7744 46 R 3.9088 8.1761 118.9477 59.1783 30.1179 178.9952 47 A 4.0403 7.9612 120.1806 55.2441 18.4425 179.6706 48 L 3.9702 8.1835 117.8456 58.0872 41.8454 180.0714 49 V 3.7637 8.1738 118.3542 66.0715 31.1221 178.0663 50 M 4.1413 8.0424 118.2702 58.6600 31.7402 178.6032 51 M 4.4358 8.2587 120.2154 57.8791 32.0806 178.4803 52 D 4.3702 8.6690 119.5763 57.6650 40.8617 179.1135 53 S 4.2858 7.9409 113.5590 60.8126 62.9971 175.8316 54 D 4.6838 7.6377 120.4177 56.6830 41.0578 178.9005 55 F 3.8713 8.2719 117.0880 59.8881 38.9969 177.0826 56 R 4.2864 7.7346 118.4691 57.7022 30.3591 176.7587 57 Q 4.8827 7.7032 117.9078 55.3239 29.8146 175.7252 58 I 4.3547 7.9741 120.1527 61.5174 37.6308 176.1670 59 A 4.3121 8.7140 129.8731 51.0690 19.4083 178.3407 60 L 4.3701 8.2478 122.3818 53.2028 40.2600 176.0036 61 R 4.6224 7.4056 118.4217 54.4453 33.6353 174.1849 62 Q 4.5537 8.7462 124.6619 56.0977 29.6517 175.5113 63 T 4.7634 8.9485 114.1141 59.9034 72.0881 173.1616 64 R 4.8381 8.2844 118.5432 54.6630 31.9457 175.1680 65 T 4.1724 8.4234 116.6949 60.8804 68.1731 174.5431 66 N 4.9308 8.5401 131.6638 53.3959 40.3168 175.2244 67 G 3.9814 7.3124 110.0900 45.0098 0.0000 176.6707 68 E 4.8028 8.7465 118.4270 55.4576 31.2935 173.7392 *72 K 4.2014 8.3527 121.9165 55.9822 32.8435 174.8808 73 K 4.6887 8.3891 124.5439 54.6372 36.5175 177.5735 74 L 4.0213 8.6169 121.1712 57.3916 42.2868 176.4815 75 L 4.9597 7.8593 117.3938 53.2644 44.1948 175.4967 76 H 4.9492 9.5290 122.2938 54.4066 30.7432 174.6770 77 W 5.7179 8.7480 132.9862 57.3072 32.9898 172.9554 78 A 4.1700 8.0737 127.6409 50.7782 23.1341 174.7243 79 D 4.0717 8.1748 119.0009 55.1898 41.8995 177.0139 80 Y 4.0686 8.2639 118.3553 58.0756 36.4268 169.9040 81 L 4.1252 7.3391 121.9979 56.1345 42.5903 176.9401 82 L 3.9908 9.1817 123.4385 55.8187 39.1316 173.6682 83 D 4.4523 8.4372 113.8172 55.1775 39.7034 173.5796 84 S 4.5641 7.7871 110.4202 57.7843 63.1296 174.5883 85 D 4.7160 9.1544 126.5787 56.7322 42.4049 176.6101 86 N 4.9592 7.6872 112.6423 52.7710 38.8595 178.2458 87 K 4.1075 9.1815 112.6335 55.9829 33.0595 175.3338 88 G 4.4081 8.4951 109.2331 44.6160 0.0000 171.3038 89 I 5.6714 9.1680 123.0182 59.6133 41.9174 173.7912 90 M 5.4063 9.3318 126.6097 54.5317 36.2057 173.3904 91 F 5.2443 8.7242 119.2288 55.9801 42.1402 172.6921 92 A 4.7721 8.7006 120.9486 51.6357 20.0339 176.4305 93 R 5.0156 9.5427 121.0630 54.4316 34.0408 173.9574 94 L 4.8678 9.0459 128.2175 53.5687 43.3476 175.4783 95 G 4.1436 9.0758 114.8121 44.6460 0.0000 173.0280 96 W 4.3728 9.0411 122.2873 57.4538 31.3808 175.6422 97 H 4.8681 8.0743 115.4079 54.1704 29.6187 173.6742 98 N 4.6744 8.3833 122.4003 51.7992 41.3845 171.8060 99 P 4.5085 0.0000 0.0000 64.2124 32.0485 174.4013 100 Q 4.4645 9.1664 122.7286 56.4192 26.0458 174.0961 101 Q 4.0579 7.7446 117.8723 56.5174 29.5447 176.1017 102 Q 4.7307 8.3415 127.7238 54.3857 29.2678 174.9618 103 F 4.5774 7.7341 118.1085 56.9884 42.6674 171.4675 104 P 4.7522 0.0000 0.0000 62.9694 31.4850 177.0718 105 R 3.9292 7.8311 120.8425 61.1141 29.9476 175.9833 106 G 2.5501 7.7379 107.6742 44.3477 0.0000 171.3900 107 E 3.9753 9.1225 128.5249 55.8814 30.8397 175.2996 108 V 4.7078 8.3060 127.8296 62.1670 32.5705 174.9974 109 T 4.8268 9.0949 117.6533 59.8013 72.8642 172.8568 110 K 4.7149 8.6144 123.9556 56.3235 33.9046 175.8268 111 V 5.2279 8.9333 118.9543 60.3535 36.7604 174.1712 112 G 4.4978 8.6665 107.8536 46.0597 0.0000 171.7619 113 Y 5.5188 9.2469 117.5184 56.5295 42.6691 174.8170 114 R 4.8080 8.9321 117.0865 55.9384 33.9161 173.2158 115 I 5.0895 8.7066 120.0096 59.4409 40.1177 175.4327 116 K 4.8847 8.8149 127.2001 56.0854 35.2416 175.7504 117 D 4.3092 9.7522 126.8479 56.0982 38.9995 173.1640 118 E 4.3479 8.0759 110.1039 56.6363 27.7867 174.5103 119 R 5.0920 7.6475 115.8957 54.0457 34.1176 175.0681 120 L 4.7479 9.1099 126.5855 55.1764 43.3774 175.3530 121 E 5.2036 9.4992 125.9475 54.5497 33.3709 174.8138 122 R 4.1611 9.0402 124.9639 55.0960 31.9113 174.9347 123 V 4.6001 8.4363 126.3188 60.7218 34.1810 173.9914 124 W 5.3028 8.3804 135.0000 55.3804 34.0118 173.6073 125 W 4.4618 8.9145 127.2802 55.1343 29.1834 176.4696 126 R 2.9009 8.0870 124.9256 57.6392 29.8167 176.4837 127 Y 4.7216 8.3643 114.0169 54.9407 40.6023 173.6658 128 P 4.4056 0.0000 0.0000 62.5217 32.0342 175.7419 129 D 4.5489 8.3695 120.1544 54.1115 41.7777 175.5629 130 T 4.7566 8.0147 114.7842 59.3451 72.0269 172.7666 131 P 4.3411 0.0000 0.0000 64.5086 31.5783 177.9810 132 A 4.0074 7.5034 120.4008 53.5635 18.7149 176.8168 133 G 3.8547 8.4783 100.2904 45.4514 0.0000 172.2621 134 Q 4.3868 7.9176 116.3371 55.1154 31.5900 174.4534 135 E 4.1584 8.7536 125.2805 55.2159 29.2363 176.3683 136 G 3.2976 8.2711 114.0335 45.9627 0.0000 172.4681 137 V 4.1382 8.1605 123.4992 61.1726 32.5801 174.5783 138 V 4.4512 8.0925 128.6126 61.9192 32.6526 175.0643 139 T 4.6842 8.9178 125.4279 60.8367 71.5267 171.6140 140 P 4.7481 0.0000 0.0000 63.1422 31.5142 175.8979 141 L 4.5127 9.1376 125.1014 55.9686 43.2367 177.0931 142 L 4.8463 7.6384 120.3011 53.2616 45.3451 176.4917 143 S 4.6565 9.0640 121.3247 57.8321 64.6160 172.9774 144 D 4.2707 8.3573 117.2713 55.6647 38.3329 174.5488 145 V 4.6130 7.8522 118.6905 61.2076 32.9384 175.4131 146 E 4.0672 8.9984 127.8420 59.0891 29.5773 177.1597 147 E 4.9962 8.1475 118.0371 54.3281 33.6882 174.0182 148 L 5.1775 8.8421 124.6211 53.4468 44.4608 175.1933 149 N 5.4835 9.1341 123.5043 52.2457 42.9122 173.0695 150 V 4.3648 7.9882 123.9901 60.9716 34.5636 174.4388 151 R 4.6104 8.1355 125.6504 54.2331 33.7787 174.5658 152 F 5.3377 9.0953 120.3307 55.9149 42.6467 173.7430 153 Y 4.3134 8.6493 125.0978 55.7559 39.5003 175.0704 154 D 4.9426 8.0761 126.6362 53.5097 39.7970 176.0152 155 G 4.1299 7.0634 110.0172 45.8101 0.0000 175.1890 156 K 4.4061 7.3846 115.9271 56.5500 34.8444 175.7564 157 Q 4.5754 7.7791 115.9820 53.9930 33.0454 173.4698 158 W 5.0047 8.7799 120.0434 56.1932 30.0774 176.1683 159 I 4.8119 9.2901 116.2935 59.1298 39.9034 175.9838 160 N 4.7245 8.8618 117.3267 54.6068 38.9757 174.7624 161 E 5.2675 8.2563 115.3811 54.4036 33.4438 175.4575 162 W 4.8707 8.3074 128.8050 55.9826 31.0589 174.1882 163 S 4.1048 7.9418 119.3519 59.3291 63.2987 174.3772 164 N 4.0890 6.6446 119.3347 53.4278 37.9686 174.0760 165 E 4.3397 8.4548 125.1714 57.1440 30.3544 177.6689 166 L 4.3165 8.1254 118.8365 56.4038 42.3576 176.9485 167 T 4.7683 7.6886 109.9248 59.8976 70.5430 173.1084 168 L 4.4454 8.4058 126.3181 53.5575 42.5757 175.1839 169 P 4.0521 0.0000 0.0000 62.0103 32.3326 176.2224 170 A 4.2578 8.2886 122.3282 54.9255 19.3417 177.4197 171 A 5.1107 7.6989 114.5141 50.4784 23.4512 175.1994 172 I 4.9494 9.1802 120.3385 59.5470 41.2130 174.6140 173 S 4.6852 9.0142 122.4108 56.4556 64.0816 172.8285 174 V 4.1175 8.0805 129.0586 61.6297 32.7950 174.0880 175 E 4.8371 9.2957 130.0563 54.3909 31.8623 174.2292 176 L 5.0957 8.8816 127.5824 53.4077 44.5616 175.7875 177 T 4.8088 8.6428 121.2326 62.2652 69.5252 173.9630 178 L 4.8141 8.9208 127.6768 53.5441 43.0056 178.8066 179 K 4.0025 8.8714 122.4927 59.2645 32.4206 178.4059 180 D 4.4079 8.0696 116.8906 55.5664 40.0134 177.0253 181 Y 4.4414 7.8665 114.9431 57.1046 39.6845 177.7143 182 G 3.8960 8.1503 107.9854 45.2885 0.0000 173.0747 183 K 4.7906 8.5766 123.5187 56.0968 32.9047 176.7328 184 I 4.6011 9.0121 118.9664 58.8736 40.4102 174.3636 185 A 5.1169 8.4993 126.4717 50.0945 22.1649 175.4269 186 R 4.2553 8.4318 118.4373 54.6032 34.0404 174.5885 187 T 4.5621 8.0117 120.1892 62.3637 70.4621 173.7951 188 Y 4.8345 8.9092 122.7539 56.1803 41.6558 174.6481 189 L 4.8748 8.7813 124.4688 54.4265 42.8067 176.4070 190 T 4.5362 8.1746 113.6573 59.5609 70.7880 173.2400 191 P 4.4363 0.0000 0.0000 63.0259 31.4035 176.4107 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 32 E 8.30 4.32 0.00 2.06 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 0.00 2.38 2.49 0.00 33 L 8.52 3.77 0.00 1.81 1.69 0.91 0.51 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 34 S 8.94 4.09 0.00 3.89 4.01 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 35 Q 8.05 3.98 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.68 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 36 E 7.78 3.95 0.00 2.19 2.21 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 2.30 2.40 0.00 37 R 8.32 4.07 0.00 1.89 2.02 0.00 3.30 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.82 0.00 38 T 8.30 3.91 4.38 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 1.22 0.00 0.00 39 A 8.22 4.06 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 40 R 8.04 3.88 0.00 2.12 2.24 0.00 3.35 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.99 0.00 41 L 7.90 4.01 0.00 1.89 1.67 0.91 0.81 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 42 N 8.09 4.35 0.00 2.93 2.87 0.00 0.00 6.63 7.88 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 43 E 8.50 3.95 0.00 2.14 2.17 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 2.34 2.35 0.00 44 L 8.09 3.97 0.00 1.91 1.83 0.90 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 8.14 3.98 0.00 2.27 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.56 0.00 0.00 0.00 0.00 0.00 2.45 2.52 0.00 46 R 8.18 3.91 0.00 2.07 2.01 0.00 3.14 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.82 0.00 47 A 7.96 4.04 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.18 3.97 0.00 1.69 1.75 0.87 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 49 V 8.17 3.76 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 1.05 0.00 0.00 0.97 0.00 0.00 50 M 8.04 4.14 0.00 2.23 2.42 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 2.66 2.81 0.00 51 M 8.26 4.44 0.00 2.06 2.33 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.09 0.00 52 D 8.67 4.37 0.00 2.99 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 53 S 7.94 4.29 0.00 4.05 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 54 D 7.64 4.68 0.00 3.06 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 55 F 8.27 3.87 0.00 1.85 2.30 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 56 R 7.73 4.29 0.00 2.00 2.04 0.00 3.20 0.00 0.00 3.38 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.82 0.00 57 Q 7.70 4.88 0.00 2.21 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.99 0.00 0.00 0.00 0.00 0.00 2.41 2.38 0.00 58 I 7.97 4.35 1.84 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.35 0.95 0.00 0.00 59 A 8.71 4.31 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 60 L 8.25 4.37 0.00 1.69 1.69 0.96 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 61 R 7.41 4.62 0.00 1.72 1.76 0.00 3.23 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.65 0.00 62 Q 8.75 4.55 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 63 T 8.95 4.76 4.10 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 1.17 0.00 0.00 64 R 8.28 4.84 0.00 1.77 1.90 0.00 2.98 0.00 0.00 3.11 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.58 0.00 65 T 8.42 4.17 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 1.24 0.00 0.00 66 N 8.54 4.93 0.00 2.64 2.74 0.00 0.00 7.07 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 67 G 7.31 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 68 E 8.75 4.80 0.00 1.92 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 2.06 2.06 0.00 *72 K 8.35 4.20 0.00 1.74 1.79 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.48 7.81 73 K 8.39 4.69 0.00 1.41 1.55 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.30 7.81 74 L 8.62 4.02 0.00 1.81 1.80 1.03 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.86 4.96 0.00 1.62 1.66 0.67 1.02 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 76 H 9.53 4.95 0.00 3.31 3.34 0.00 5.63 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 W 8.75 5.72 0.00 3.65 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 78 A 8.07 4.17 1.15 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 79 D 8.17 4.07 0.00 2.38 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 0.00 0.00 0.00 0.00 80 Y 8.26 4.07 0.00 3.11 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 81 L 7.34 4.13 0.00 1.98 1.61 0.99 0.83 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 82 L 9.18 3.99 0.00 1.97 1.88 1.26 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 83 D 8.44 4.45 0.00 2.81 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 84 S 7.79 4.56 0.00 4.12 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 85 D 9.15 4.72 0.00 2.72 2.79 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 86 N 7.69 4.96 0.00 2.70 2.04 0.00 0.00 6.31 7.20 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 87 K 9.18 4.11 0.00 1.87 1.25 0.00 0.61 0.00 0.00 1.15 0.00 0.00 2.60 0.00 0.00 2.48 0.00 0.00 0.00 0.00 1.22 1.32 7.81 88 G 8.50 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 2.21 2.11 0.00 3.26 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 106 G 7.74 2.55 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 0.00 0.00 0.00 0.00 107 E 9.12 3.98 0.00 1.98 1.79 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 2.30 2.24 0.00 108 V 8.31 4.71 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 0.87 0.00 0.00 0.91 0.00 0.00 109 T 9.09 4.83 4.62 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 1.31 0.00 0.00 110 K 8.61 4.71 0.00 1.71 1.61 0.00 1.08 0.00 0.00 1.43 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.79 1.32 7.81 111 V 8.93 5.23 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 0.72 0.00 0.00 0.21 0.00 0.00 112 G 8.67 4.50 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 0.00 113 Y 9.25 5.52 0.00 3.25 3.04 0.00 0.00 0.00 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0.00 0.00 0.00 130 T 8.01 4.76 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 0.00 131 P 0.00 4.34 0.00 2.05 2.14 0.00 3.66 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 132 A 7.50 4.01 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 0.00 133 G 8.48 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 0.00 0.00 0.00 134 Q 7.92 4.39 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 7.03 0.00 0.00 0.00 0.00 0.00 2.31 2.44 0.00 135 E 8.75 4.16 0.00 1.94 1.86 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 2.23 2.26 0.00 136 G 8.27 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 0.00 0.00 0.00 137 V 8.16 4.14 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 0.98 0.00 0.00 0.84 0.00 0.00 138 V 8.09 4.45 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 0.82 0.00 0.00 0.81 0.00 0.00 139 T 8.92 4.68 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 1.21 0.00 0.00 140 P 0.00 4.75 0.00 2.10 2.09 0.00 3.75 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 141 L 9.14 4.51 0.00 1.74 1.85 1.01 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 142 L 7.64 4.85 0.00 1.76 1.51 0.97 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 143 S 9.06 4.66 0.00 4.07 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 0.00 144 D 8.36 4.27 0.00 2.84 2.72 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 0.00 0.00 0.00 0.00 145 V 7.85 4.61 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 1.05 0.00 0.00 1.05 0.00 0.00 146 E 9.00 4.07 0.00 2.03 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 0.00 2.36 2.31 0.00 147 E 8.15 5.00 0.00 1.90 1.83 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 2.30 2.28 0.00 148 L 8.84 5.18 0.00 1.76 1.68 1.02 1.23 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 0.00 149 N 9.13 5.48 0.00 2.93 2.56 0.00 0.00 6.31 7.19 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 0.00 150 V 7.99 4.36 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 0.00 0.00 0.03 0.00 0.00 0.55 0.00 0.00 151 R 8.14 4.61 0.00 1.39 1.82 0.00 3.01 0.00 0.00 2.91 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.44 0.00 152 F 9.10 5.34 0.00 3.10 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 0.00 153 Y 8.65 4.31 0.00 1.43 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 0.00 154 D 8.08 4.94 0.00 2.92 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 0.00 155 G 7.06 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 0.00 0.00 0.00 0.00 156 K 7.38 4.41 0.00 1.58 1.73 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.27 1.31 7.81 157 Q 7.78 4.58 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.98 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 158 W 8.78 5.00 0.00 3.35 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 0.00 159 I 9.29 4.81 2.06 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.47 1.01 0.00 0.00 160 N 8.86 4.72 0.00 2.91 3.15 0.00 0.00 6.70 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 0.00 161 E 8.26 5.27 0.00 2.07 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 2.43 2.35 0.00 162 W 8.31 4.87 0.00 1.98 2.37 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 0.00 163 S 7.94 4.10 0.00 3.88 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 0.00 164 N 6.64 4.09 0.00 1.85 1.73 0.00 0.00 7.00 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 0.00 165 E 8.45 4.34 0.00 1.96 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 0.00 2.24 2.44 0.00 166 L 8.13 4.32 0.00 1.76 1.72 0.88 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 167 T 7.69 4.77 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 1.37 0.00 0.00 168 L 8.41 4.45 0.00 1.70 1.52 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 169 P 0.00 4.05 0.00 1.75 0.49 0.00 3.41 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.96 0.00 170 A 8.29 4.26 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 0.00 171 A 7.70 5.11 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 0.00 172 I 9.18 4.95 1.97 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 1.21 0.68 0.72 0.00 0.00 173 S 9.01 4.69 0.00 2.80 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 0.00 174 V 8.08 4.12 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 0.66 0.00 0.00 -0.09 0.00 0.00 175 E 9.30 4.84 0.00 1.81 1.77 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 2.13 2.14 0.00 176 L 8.88 5.10 0.00 1.56 1.55 0.90 0.44 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 0.00 177 T 8.64 4.81 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 0.00 178 L 8.92 4.81 0.00 1.65 1.76 1.06 0.76 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 0.00 179 K 8.87 4.00 0.00 1.86 1.85 0.00 1.80 0.00 0.00 1.78 0.00 0.00 3.12 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.56 1.43 7.81 180 D 8.07 4.41 0.00 2.32 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 0.00 181 Y 7.87 4.44 0.00 3.00 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 0.00 182 G 8.15 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 0.00 183 K 8.58 4.79 0.00 1.62 1.72 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.85 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.42 7.81 184 I 9.01 4.60 1.77 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 1.08 1.51 0.85 0.00 0.00 185 A 8.50 5.12 0.96 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 0.00 0.00 186 R 8.43 4.26 0.00 1.39 1.01 0.00 3.05 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.39 0.00 187 T 8.01 4.56 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 1.28 0.00 0.00 188 Y 8.91 4.83 0.00 2.80 2.79 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 0.00 189 L 8.78 4.87 0.00 1.54 1.60 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 190 T 8.17 4.54 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 1.24 0.00 0.00 191 P 0.00 4.44 0.00 2.11 2.05 0.00 3.74 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.13 0.00 * Residues marked with a * may have inaccurate shift predictions.