NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 31 A 4.3475 8.2649 123.5887 51.3598 19.8876 176.3093 32 P 4.2822 0.0000 0.0000 59.7685 32.2239 174.1097 33 W 5.0123 8.3459 119.9256 54.4506 32.1321 174.2029 34 F 4.5785 8.7421 117.6686 55.6120 41.9089 173.9534 35 L 4.8748 9.2841 127.6357 53.2940 44.9932 174.4921 36 E 5.2045 9.2210 127.8441 54.9739 30.9672 174.2020 37 Y 5.3689 9.2736 128.5726 55.9923 42.2667 174.1398 38 S 5.0691 8.8976 119.5641 56.4983 66.7523 173.2171 39 K 4.5431 8.8685 120.6190 54.8013 35.7277 175.4159 40 S 4.9387 8.8369 120.8410 57.0118 64.4132 172.9153 41 E 4.5448 9.0916 125.6678 55.0542 31.2735 174.7436 42 C 5.0817 8.8078 121.9975 55.6441 36.7277 172.7500 43 H 4.7040 8.7608 122.0620 53.9634 30.4903 174.0645 44 F 5.0983 8.4493 121.2308 55.7192 42.1071 174.3250 45 Y 4.5217 8.3562 119.8807 56.6975 40.8134 174.3354 46 N 4.2711 9.6950 123.0198 54.3372 35.9252 175.2439 47 G 3.8538 7.8197 108.3364 45.9221 0.0000 172.0683 48 T 4.4237 8.0323 114.4912 61.9273 69.2815 175.9056 49 Q 3.9908 7.8586 125.3669 59.2882 29.3222 176.3194 50 R 4.5604 7.8835 118.7202 54.6836 32.6551 173.9888 51 V 4.6693 8.4584 126.1662 61.4005 34.1276 175.0540 52 R 4.5386 8.2699 125.4506 54.9913 33.6394 173.1805 53 L 4.9397 9.0202 129.4236 53.6867 44.3186 175.0316 54 L 5.1590 9.1036 127.7388 53.6410 45.1398 174.7176 55 V 4.6706 8.8471 127.6568 61.5978 33.3516 174.7367 56 R 5.0093 9.1235 126.8241 54.5667 33.5924 173.9614 57 Y 5.0442 8.8258 121.2284 56.2767 40.7553 174.8706 58 F 5.5151 9.9926 121.9863 55.8868 43.8124 173.5397 59 Y 4.9714 9.1123 123.2227 57.0200 41.1179 177.1158 60 N 3.9402 8.9895 128.2210 54.6155 37.6104 175.7095 61 L 4.7029 9.0816 125.6669 55.2864 42.8903 175.4215 62 E 4.7120 8.1849 120.1558 54.3751 31.1816 174.7198 63 E 4.3630 9.0153 125.1456 55.6414 29.9360 175.2348 64 N 4.9395 8.7429 123.8290 53.2002 39.6390 174.0680 65 L 5.0669 7.6750 120.0963 54.5862 45.7355 173.4308 66 R 5.3466 8.6861 117.9747 55.2916 33.5796 173.6008 67 F 4.4927 9.3376 122.4356 56.4770 42.3483 173.0266 68 D 5.0731 7.8048 127.0010 52.2830 42.4526 177.0522 69 S 4.1584 9.1186 122.5225 61.4848 63.0531 175.9539 70 D 4.5192 8.1067 118.8495 55.5129 40.6925 176.8201 71 V 3.8905 8.0259 118.8441 62.2010 32.7237 176.7913 72 G 3.9060 9.0254 105.9939 44.9518 0.0000 172.2969 73 E 4.7965 6.7093 114.8759 54.7830 32.1443 174.7282 74 F 4.6234 9.0669 118.5767 58.0198 40.1251 175.5886 75 R 4.7029 9.1891 120.2566 54.2643 34.0004 174.6754 76 A 4.2082 8.9081 126.2070 52.6477 18.5421 176.9423 77 V 4.2171 8.9900 121.3660 64.1754 33.1476 175.8392 78 T 4.7703 7.5338 108.2052 58.6143 72.2554 174.0549 79 E 3.8800 8.9893 121.1133 59.8515 29.1412 179.4636 80 L 4.0092 7.3869 118.0711 57.0716 41.9426 178.0749 81 G 3.9039 7.9974 104.1402 44.4725 0.0000 175.1909 82 R 3.8211 7.9752 122.1646 59.0122 30.1159 176.2908 83 P 4.0560 0.0000 0.0000 66.0423 31.2731 178.2405 84 D 3.3711 7.5456 116.5070 56.6247 40.5160 178.5278 85 A 3.8928 7.3058 120.7735 55.1044 18.2164 179.3448 86 E 3.8580 7.9180 115.8624 59.6897 29.7217 178.8778 87 N 4.3442 8.1564 117.0482 56.7295 39.1726 176.9622 88 W 4.4878 8.2628 120.4989 59.8906 28.9237 178.3841 89 N 4.7474 8.6027 116.1042 55.5786 37.9137 175.7842 90 S 4.7288 7.5452 113.9849 58.1958 63.4360 174.7911 91 Q 4.6046 7.9621 121.9709 52.5769 29.0111 173.7366 92 P 4.3066 0.0000 0.0000 66.1278 30.7647 178.0906 93 E 3.9898 8.2361 117.4170 59.2673 29.6121 179.0450 94 F 4.3982 8.2422 120.0435 61.3006 39.7061 176.9281 95 L 3.8637 8.1372 118.7031 57.7875 41.3070 179.1256 96 E 3.9558 8.3103 119.2279 59.2692 29.3155 178.6984 97 Q 3.9340 7.4265 118.4479 58.8831 29.4119 178.1289 98 K 3.9120 7.4729 119.0239 59.5439 31.6472 179.4149 99 R 4.1793 7.7651 117.6071 59.4642 29.9493 178.7728 100 A 4.1853 7.8848 119.6029 54.4152 18.4324 179.3040 101 E 4.5521 8.4591 119.0857 58.7216 29.3827 179.3261 102 V 3.7763 7.5303 117.3717 65.3675 31.3173 177.0595 103 D 4.6087 7.7568 117.2972 56.3133 41.9693 178.7191 104 T 3.9550 8.6327 110.4140 64.2180 68.6121 174.5251 105 V 4.2185 8.2371 118.6686 64.8372 33.4042 176.2701 106 C 4.2669 8.2834 114.5469 61.1323 36.8468 176.3067 107 R 4.0579 8.6192 118.9441 59.7556 30.0804 178.6960 108 H 4.0685 8.1194 117.6529 59.6341 29.8195 177.1514 109 N 3.9954 8.6611 118.5043 55.9788 38.2408 176.8522 110 Y 3.7001 8.2201 121.2507 60.5403 38.6058 177.5905 111 E 4.0141 7.9832 119.1581 59.4611 29.8846 178.8069 112 I 3.8459 6.9517 118.7351 64.5480 37.2145 178.5657 113 F 4.1936 7.7786 118.4683 60.0628 38.4276 176.9039 114 D 4.2445 8.0508 117.0030 56.1710 41.0396 176.8943 115 N 4.7795 7.8619 114.9918 54.7269 39.0250 175.0645 116 F 4.9948 7.6716 110.8010 57.2056 43.2533 175.4285 117 L 3.8640 7.6067 121.8283 56.7344 42.1255 178.9350 118 V 3.5429 7.6357 116.7360 65.3086 31.3270 174.7509 119 P 4.5889 0.0000 0.0000 62.5531 31.7869 175.9108 120 R 3.9756 7.4890 120.1197 57.3226 30.3062 175.7024 121 R 5.1471 8.4840 122.8363 54.6803 34.4289 174.6805 122 V 4.4911 9.3314 123.2265 61.0368 34.6930 174.3705 123 E 4.9885 9.2786 128.1240 55.1831 29.9891 175.3239 124 P 4.8825 0.0000 0.0000 63.2441 33.0027 175.4220 125 T 4.5958 8.8554 117.9065 61.9839 70.5829 173.6304 126 V 5.0063 8.4687 126.6998 61.2734 33.6128 174.7275 127 T 4.8723 8.8133 117.0152 60.1187 72.4343 172.8717 128 V 5.0902 8.1777 122.6147 61.7023 34.6606 174.0757 129 Y 4.8158 7.8997 120.4371 55.8650 41.2871 171.9783 130 P 4.9349 0.0000 0.0000 62.6864 32.9348 174.6552 131 T 4.3114 8.4249 112.7106 62.5979 71.9419 173.7296 *132 K 4.1678 8.9913 123.1631 55.8435 33.4528 173.8026 *133 T 3.8990 8.0456 117.9307 62.1938 67.9083 175.6845 *134 Q 4.7325 7.4388 130.4138 54.6103 26.2954 177.7640 *135 P 4.3998 0.0000 0.0000 63.3877 31.2830 177.6161 *136 L 4.3927 8.1653 121.0086 55.3874 44.2800 172.0043 *137 E 3.6123 8.7444 120.7414 61.4605 25.8581 169.8793 *138 H 4.6368 7.8943 130.9420 51.4918 26.5642 170.8208 *139 H 4.5885 6.9487 112.1922 52.7593 29.3660 176.7357 140 N 5.8433 8.4291 119.2288 50.0865 39.7026 173.6602 141 L 4.8794 7.6251 119.9385 52.8215 45.6089 174.7927 142 L 4.2505 8.4363 126.9386 53.1098 43.9730 174.9362 143 V 4.3848 8.1725 127.2520 61.3144 33.6814 173.4931 144 C 4.7326 9.2444 128.8394 55.1049 41.8785 172.2621 145 S 4.9317 8.9712 123.4328 57.1204 63.5478 172.9463 146 V 4.7122 8.8848 128.5135 61.3012 33.5906 174.3730 147 S 5.2614 8.6513 121.9948 55.8968 67.0787 172.8792 148 D 4.4471 8.5657 116.6694 55.6985 39.0884 171.5848 149 F 5.4882 7.4648 113.4964 55.7641 42.5182 174.5901 150 Y 5.0849 8.7287 117.3528 56.3427 42.6687 172.6613 151 P 2.9700 0.0000 0.0000 61.6261 32.8347 175.9956 152 G 2.6881 8.1187 107.5683 47.7235 0.0000 173.8494 153 N 4.3926 7.7590 118.0512 52.5508 37.8312 173.9344 154 I 4.6294 7.8004 121.7084 59.7225 41.5628 173.1174 155 E 4.6945 9.0592 125.2201 54.4091 32.9232 175.3077 156 V 4.6182 8.3488 123.0007 61.3087 34.1255 174.5533 157 R 4.7177 9.1363 127.0305 54.0934 34.0804 174.7234 158 W 5.3544 8.4188 120.6827 55.1152 32.3189 174.7894 159 F 5.3942 9.8093 121.7395 55.7476 42.9889 174.0427 160 R 4.4176 9.2952 123.3937 54.4092 32.0572 175.2864 161 N 4.1890 10.0967 126.8957 54.2179 36.8170 175.9156 162 G 3.9813 8.7674 105.9615 44.8641 0.0000 173.9565 163 K 4.6257 8.1033 120.3028 54.1039 33.6631 175.3061 164 E 3.5737 8.9490 125.3531 55.9385 29.7733 175.8929 165 E 4.2087 8.7299 127.5597 56.0130 29.3956 176.6013 166 K 4.2003 8.6356 124.3496 57.4899 33.0863 177.3003 167 T 4.4595 7.7802 106.9210 60.7559 71.1706 174.4976 168 G 3.8465 8.7674 109.8329 45.3392 0.0000 172.5594 169 I 4.7577 7.2854 119.9039 60.1982 38.4884 175.4284 170 V 4.4891 8.9200 126.2090 61.1854 34.5920 174.1628 171 S 5.3403 8.5995 121.0768 56.8573 65.3966 173.6000 172 T 4.1157 8.6709 114.1576 62.1431 69.4615 175.5071 173 G 3.7658 8.5451 109.8885 44.4781 0.0000 172.8699 174 L 4.2576 8.0780 120.5849 54.4842 42.0610 176.1817 175 V 4.1059 8.6353 128.1180 61.7030 32.5715 174.7594 176 R 4.2232 8.5914 129.3215 55.9522 30.2593 176.0027 177 N 4.4033 8.5436 123.3873 53.6831 39.1039 176.4603 178 G 3.8791 8.1599 106.3783 45.0452 0.0000 173.5078 179 D 4.9445 7.4655 117.8278 52.8756 39.6897 175.8508 180 W 3.2872 8.3041 116.5238 58.3946 26.0261 173.9230 181 T 5.0268 7.4081 105.8967 60.2889 72.3137 172.1942 182 F 5.2836 8.7243 120.8362 55.9094 43.4829 173.7931 183 Q 5.1362 8.5555 116.8693 55.9324 32.3420 173.2033 184 T 4.7225 8.8245 112.5783 61.5990 71.8807 171.6750 185 L 5.2195 8.6306 125.3404 52.8775 45.5175 175.8026 186 V 4.5951 8.8047 122.7204 61.5927 34.3005 173.9412 187 M 5.1603 9.5747 128.2965 53.4613 35.1909 174.6850 188 L 4.7057 8.3083 124.4194 52.9981 44.7024 174.6632 189 E 4.6442 8.5125 128.0842 55.8941 30.2584 175.4669 190 T 4.5130 8.7150 122.7471 62.6806 73.9151 173.4326 191 V 4.6235 8.1561 123.6322 60.0093 31.0873 172.4805 192 P 4.5460 0.0000 0.0000 62.4066 32.0723 176.1050 193 Q 4.5564 9.1289 122.5546 53.8547 29.9037 175.0710 194 S 4.1984 8.6031 116.9852 59.4624 63.1105 174.3845 195 G 4.0647 8.9468 112.3661 45.6947 0.0000 173.7476 196 E 4.3323 7.9459 119.5028 55.6517 30.4099 175.8354 197 V 4.5830 9.3835 123.5524 61.4067 34.1378 173.6891 198 Y 5.4879 9.6147 125.9984 56.9114 40.5782 174.8610 199 T 5.2878 9.5600 119.7459 62.0562 72.7250 171.8933 200 C 4.3327 9.1904 127.0285 54.8443 42.5472 171.8089 201 Q 5.1610 9.1667 127.9014 54.2242 31.5025 173.9986 202 V 4.8319 9.0350 126.4815 61.1051 34.2881 173.7779 203 E 5.0022 8.8539 127.5025 54.9511 32.3656 174.5488 204 H 4.8094 8.5208 121.3608 54.5073 32.8101 172.4778 205 P 4.2512 0.0000 0.0000 65.6946 31.6003 177.5448 206 S 4.4398 8.1399 110.7188 59.0749 63.5714 173.2481 207 L 5.0201 7.8960 122.3522 53.1587 43.7074 176.7605 208 T 4.1532 8.5427 112.9422 63.5857 69.4318 174.5926 209 D 4.9730 7.6101 119.3055 51.0924 44.4723 173.4683 210 P 4.4857 0.0000 0.0000 63.2859 32.3340 175.6455 211 V 4.4585 8.8209 123.3332 61.4989 33.4386 174.6940 212 T 5.1926 8.4174 116.8118 59.9782 72.0442 173.3843 213 V 4.4509 8.4935 122.6264 61.6380 34.8268 174.2005 214 E 5.3148 8.9618 126.8994 55.1383 32.2073 175.8295 215 W 4.7582 9.4276 130.9074 58.0268 31.2991 174.3210 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 31 A 8.26 4.35 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 32 P 0.00 4.28 0.00 2.14 1.92 0.00 3.68 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 2.09 2.16 0.00 33 W 8.35 5.01 0.00 3.41 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 34 F 8.74 4.58 0.00 3.06 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 35 L 9.28 4.87 0.00 2.06 1.84 1.00 0.82 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 36 E 9.22 5.20 0.00 2.23 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 2.41 2.59 0.00 37 Y 9.27 5.37 0.00 3.10 2.93 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 38 S 8.90 5.07 0.00 3.19 3.51 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.87 4.54 0.00 1.68 1.70 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.67 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.27 0.92 7.81 40 S 8.84 4.94 0.00 3.73 3.81 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 41 E 9.09 4.54 0.00 1.99 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 2.41 0.00 42 C 8.81 5.08 0.00 2.94 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 43 H 8.76 4.70 0.00 3.02 2.79 0.00 5.56 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 F 8.45 5.10 0.00 2.87 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 45 Y 8.36 4.52 0.00 2.88 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 46 N 9.69 4.27 0.00 2.97 2.87 0.00 0.00 6.99 7.76 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 47 G 7.82 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 48 T 8.03 4.42 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 0.78 0.00 0.00 49 Q 7.86 3.99 0.00 2.13 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.75 0.00 0.00 0.00 0.00 0.00 2.40 2.32 0.00 50 R 7.88 4.56 0.00 1.99 1.92 0.00 2.97 0.00 0.00 2.83 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.55 0.00 51 V 8.46 4.67 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 0.56 0.00 0.00 0.95 0.00 0.00 52 R 8.27 4.54 0.00 2.02 1.82 0.00 3.23 0.00 0.00 3.12 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.67 0.00 53 L 9.02 4.94 0.00 1.80 1.57 0.98 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 54 L 9.10 5.16 0.00 1.74 1.53 0.99 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 55 V 8.85 4.67 2.24 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 0.98 0.00 0.00 0.92 0.00 0.00 56 R 9.12 5.01 0.00 1.71 1.49 0.00 3.21 0.00 0.00 3.40 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 57 Y 8.83 5.04 0.00 3.01 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 58 F 9.99 5.52 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 59 Y 9.11 4.97 0.00 3.10 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 60 N 8.99 3.94 0.00 2.25 1.51 0.00 0.00 6.96 7.23 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 61 L 9.08 4.70 0.00 1.71 1.81 1.08 0.99 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 62 E 8.18 4.71 0.00 2.19 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 0.00 2.32 2.30 0.00 63 E 9.02 4.36 0.00 1.90 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.78 0.00 64 N 8.74 4.94 0.00 2.88 3.09 0.00 0.00 5.98 6.23 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 65 L 7.67 5.07 0.00 1.74 1.52 1.06 0.52 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 66 R 8.69 5.35 0.00 2.04 1.99 0.00 2.75 0.00 0.00 3.08 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.58 0.00 67 F 9.34 4.49 0.00 2.20 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 68 D 7.80 5.07 0.00 2.60 2.28 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 69 S 9.12 4.16 0.00 4.04 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 70 D 8.11 4.52 0.00 2.78 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 71 V 8.03 3.89 1.95 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 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0.00 0.00 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 0.82 0.00 0.00 147 S 8.65 5.26 0.00 3.99 4.02 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 0.00 148 D 8.57 4.45 0.00 2.83 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 0.00 149 F 7.46 5.49 0.00 3.07 3.06 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 0.00 150 Y 8.73 5.08 0.00 3.38 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 0.00 151 P 0.00 2.97 0.00 1.78 1.56 0.00 3.86 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.91 0.00 152 G 8.12 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 0.00 0.00 0.00 153 N 7.76 4.39 0.00 2.76 2.76 0.00 0.00 5.74 7.81 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 0.00 154 I 7.80 4.63 1.58 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.60 0.68 0.00 0.00 155 E 9.06 4.69 0.00 1.81 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 2.15 2.43 0.00 156 V 8.35 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 0.58 0.00 0.00 0.78 0.00 0.00 157 R 9.14 4.72 0.00 1.78 1.49 0.00 3.30 0.00 0.00 3.41 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 158 W 8.42 5.35 0.00 3.22 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 0.00 159 F 9.81 5.39 0.00 3.12 2.98 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 0.00 160 R 9.30 4.42 0.00 1.89 1.80 0.00 3.52 0.00 0.00 3.16 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.13 0.00 161 N 10.10 4.19 0.00 2.80 2.82 0.00 0.00 7.31 7.27 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 0.00 162 G 8.77 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 0.00 0.00 0.00 163 K 8.10 4.63 0.00 1.97 1.78 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.39 7.81 164 E 8.95 3.57 0.00 1.61 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 2.07 1.84 0.00 165 E 8.73 4.21 0.00 1.99 1.88 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 2.40 2.49 0.00 166 K 8.64 4.20 0.00 1.72 1.83 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.16 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.34 7.81 167 T 7.78 4.46 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 1.20 0.00 0.00 168 G 8.77 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 0.00 169 I 7.29 4.76 1.87 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 1.22 0.91 0.96 0.00 0.00 170 V 8.92 4.49 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 0.92 0.00 0.00 0.89 0.00 0.00 171 S 8.60 5.34 0.00 3.88 3.66 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 0.00 0.00 0.00 0.00 172 T 8.67 4.12 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 0.00 173 G 8.55 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 0.00 174 L 8.08 4.26 0.00 1.63 1.63 0.72 0.51 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 0.00 175 V 8.64 4.11 2.29 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 0.86 0.00 0.00 1.02 0.00 0.00 176 R 8.59 4.22 0.00 1.89 1.75 0.00 3.15 0.00 0.00 2.98 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.10 0.00 177 N 8.54 4.40 0.00 2.87 2.76 0.00 0.00 7.22 6.97 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 0.00 178 G 8.16 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 0.00 179 D 7.47 4.94 0.00 2.78 2.71 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 0.00 180 W 8.30 3.29 0.00 3.28 3.09 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 0.00 0.00 0.00 0.00 181 T 7.41 5.03 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 1.24 0.00 0.00 182 F 8.72 5.28 0.00 1.51 2.23 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 0.00 183 Q 8.56 5.14 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.72 0.00 0.00 0.00 0.00 0.00 2.24 2.35 0.00 184 T 8.82 4.72 4.42 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 1.39 0.00 0.00 185 L 8.63 5.22 0.00 1.64 1.52 1.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 186 V 8.80 4.60 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 1.17 0.00 0.00 0.93 0.00 0.00 187 M 9.57 5.16 0.00 1.83 1.86 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.38 0.00 188 L 8.31 4.71 0.00 0.30 0.13 0.74 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 189 E 8.51 4.64 0.00 1.91 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 0.00 2.20 2.19 0.00 190 T 8.72 4.51 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 1.34 0.00 0.00 191 V 8.16 4.62 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 0.85 0.00 0.00 0.92 0.00 0.00 192 P 0.00 4.55 0.00 2.31 2.45 0.00 3.72 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.04 0.00 193 Q 9.13 4.56 0.00 2.23 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.80 0.00 0.00 0.00 0.00 0.00 2.51 2.43 0.00 194 S 8.60 4.20 0.00 3.96 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 0.00 195 G 8.95 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 0.00 0.00 0.00 196 E 7.95 4.33 0.00 2.05 1.53 0.00 0.00 0.00 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 0.00 197 V 9.38 4.58 2.07 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 1.12 0.00 0.00 0.92 0.00 0.00 198 Y 9.61 5.49 0.00 3.43 3.27 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 0.00 199 T 9.56 5.29 4.42 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 1.29 0.00 0.00 200 C 9.19 4.33 0.00 1.68 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 0.00 0.00 0.00 0.00 201 Q 9.17 5.16 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.26 2.24 0.00 202 V 9.03 4.83 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 0.74 0.00 0.00 0.76 0.00 0.00 203 E 8.85 5.00 0.00 1.87 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 2.20 2.19 0.00 204 H 8.52 4.81 0.00 2.99 3.00 0.00 5.69 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 0.00 205 P 0.00 4.25 0.00 1.97 2.07 0.00 2.99 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.99 0.00 206 S 8.14 4.44 0.00 4.12 4.31 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 0.00 0.00 0.00 0.00 207 L 7.90 5.02 0.00 1.68 1.73 0.89 0.73 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 0.00 208 T 8.54 4.15 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 1.22 0.00 0.00 209 D 7.61 4.97 0.00 2.62 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 0.00 210 P 0.00 4.49 0.00 1.90 1.97 0.00 3.63 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 211 V 8.82 4.46 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 0.95 0.00 0.00 0.91 0.00 0.00 212 T 8.42 5.19 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 1.16 0.00 0.00 213 V 8.49 4.45 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 1.05 0.00 0.00 0.92 0.00 0.00 214 E 8.96 5.31 0.00 1.97 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 0.00 2.31 2.33 0.00 215 W 9.43 4.76 0.00 3.54 3.24 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 0.00 * Residues marked with a * may have inaccurate shift predictions.