NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 32 E 4.3606 8.4449 116.7589 55.1189 31.9146 176.8594 33 P 5.2392 0.0000 0.0000 61.2830 29.4997 173.9275 34 K 4.6251 8.4678 124.6966 52.9275 37.0725 178.2630 35 F 4.8593 8.6356 117.9324 59.3946 39.2060 173.8440 36 T 4.6741 9.5578 107.5143 61.9131 70.4585 173.4034 37 K 4.6061 7.9089 118.8080 54.0260 36.2774 175.2888 38 C 5.8742 8.6076 124.1577 54.8455 36.7118 173.2072 39 R 4.7868 8.4073 122.0543 54.8187 33.8328 173.2619 40 S 5.3633 9.5374 121.3597 55.2865 63.5213 172.7590 41 P 4.4252 0.0000 0.0000 64.2959 31.8511 175.5358 42 E 4.6564 7.7994 114.7016 54.5719 33.2569 175.8427 43 R 4.4448 8.3474 119.0925 55.1901 28.9162 176.0997 44 E 4.9292 8.0528 115.8088 56.5507 33.7605 175.2207 45 T 5.0569 8.8180 108.9661 60.4244 73.3316 172.2746 46 F 5.5259 9.0760 115.5960 57.8715 41.7696 172.5158 47 S 5.6978 8.3204 111.8795 58.4541 66.3366 173.7392 48 C 5.6905 8.8164 116.4102 55.6716 44.8257 172.9123 49 H 5.8461 9.3786 117.6255 53.1834 32.8580 172.7044 50 W 5.8315 7.8304 115.9857 55.9803 31.5148 173.1300 51 T 4.6488 8.5840 111.6063 60.5569 70.4795 175.5691 52 D 5.0587 8.2505 124.7931 52.0885 41.7079 171.3914 53 E 4.5594 8.0067 113.2407 57.5515 30.8769 177.1218 54 V 3.7819 8.0570 125.0055 64.2902 28.3975 170.6536 *55 H 4.4322 7.8350 119.2322 53.9687 30.1409 176.0133 *56 H 4.7094 8.6535 118.9790 53.2287 30.8621 170.3094 *62 G 3.9055 8.6909 108.7983 44.6307 0.0000 173.0764 63 P 4.6499 0.0000 0.0000 61.4474 33.6723 175.9428 64 I 4.6790 8.2710 125.2772 59.9688 39.0791 175.1212 65 Q 4.5046 8.3105 123.0786 54.0893 33.6348 173.5727 66 L 4.8635 8.6634 123.5273 53.5113 44.5963 175.1642 67 F 5.7725 9.0213 123.8199 55.9742 42.8791 173.5959 68 Y 6.2745 9.5620 119.8656 54.9949 42.2642 174.4474 69 T 4.4573 8.2435 116.0962 62.0298 72.9142 173.2257 70 R 3.7130 8.3973 126.2392 55.2905 30.5241 176.7694 71 R 3.8784 8.3536 127.1985 57.2579 30.4200 177.2412 72 N 4.3725 8.4539 120.3167 52.3531 41.4125 171.6998 *73 T 4.2480 8.3922 110.8930 59.9760 70.4303 172.9010 *78 Q 3.9765 8.2361 125.2364 56.6050 30.0043 175.2118 79 E 4.5237 8.0300 118.5971 54.1626 32.9476 174.4306 80 W 4.7179 8.7494 124.7541 54.6070 30.5942 176.8670 81 K 4.5002 8.5107 124.4298 55.5167 33.8625 174.8831 82 E 5.0990 8.5072 121.1032 53.9593 33.0410 175.4852 83 C 3.4755 8.1954 123.1350 56.5816 43.1353 172.1068 84 P 3.9595 0.0000 0.0000 65.3742 31.2464 176.6528 85 D 4.5958 6.8096 117.2280 53.5623 41.7937 174.4538 86 Y 4.5394 8.1859 118.5371 57.8109 37.8772 177.0688 87 V 4.3674 8.2040 120.3312 62.7491 33.8438 177.9054 88 S 3.9288 8.4052 115.5981 60.7548 62.6466 174.8401 89 A 4.2428 7.9244 120.2245 51.6284 19.5380 177.1331 90 G 3.7630 8.2969 102.7175 45.2019 0.0000 173.6727 91 E 3.8011 7.6786 116.5762 56.9783 30.0535 178.1822 92 N 4.6584 7.5073 119.0617 50.8613 39.7774 172.7066 93 S 5.2777 7.4950 115.7320 55.8250 67.6098 174.5414 94 C 4.5439 8.4503 119.6038 55.7125 46.4363 171.7540 95 Y 4.5919 8.3277 128.7074 56.2116 39.5706 175.0658 96 F 4.0410 8.4985 128.0464 55.9495 40.0281 176.1323 97 N 4.4943 8.0834 122.6876 51.4116 39.5734 175.6109 98 S 4.2859 8.8397 113.3025 62.3934 62.8442 177.5688 99 S 4.0255 7.6415 114.3199 61.2018 62.4967 175.5142 100 F 4.6655 8.1832 116.6841 58.0885 39.1931 175.4928 101 T 4.7989 7.7040 117.9334 61.8157 69.5462 173.5693 102 S 4.8487 9.1739 121.7925 56.5896 64.4523 173.3376 103 I 4.0192 8.0740 125.9791 60.9589 37.5839 175.7669 104 W 4.6604 8.0962 117.7680 56.4947 29.8158 175.9245 105 I 4.7128 7.4837 111.5800 57.6548 40.0836 173.3567 106 P 4.5301 0.0000 0.0000 63.5381 32.3754 174.8178 107 Y 4.9494 8.7137 120.3420 56.7121 41.1278 173.9081 108 C 5.6513 8.7642 117.5698 55.5432 41.5787 173.2435 109 I 6.3000 9.2364 113.3234 59.4279 41.3354 173.8990 110 K 5.1550 8.9106 122.6991 55.2003 36.1123 174.3806 111 L 4.6600 8.8931 126.7299 54.0722 43.6157 175.1771 112 T 5.3144 8.7400 124.2935 61.3727 70.1241 173.8797 113 S 4.5169 8.7178 125.2273 57.4764 62.0095 173.8892 114 N 4.0142 9.3318 125.8417 52.8138 34.5640 171.2293 115 G 4.1941 7.9656 116.4558 45.4588 0.0000 172.4787 116 G 3.7007 7.6480 108.6151 45.4313 0.0000 172.2600 117 T 4.4296 8.2509 119.9513 62.6607 68.8889 173.4780 118 V 3.7387 7.6466 127.5840 62.4664 32.3547 175.1279 119 D 5.0912 7.4509 117.0052 53.1272 44.3345 174.8962 120 E 5.6917 8.6061 118.8467 55.5125 32.6535 174.4227 121 K 4.7306 9.7508 119.6509 56.4191 36.2165 173.7279 122 C 5.5670 8.8302 120.5810 55.7843 41.9820 172.5627 123 F 4.8714 7.9987 115.7031 56.5858 41.0884 172.6678 124 S 4.9171 8.4458 111.9606 56.0453 66.0910 175.2005 125 V 3.4156 8.0821 120.6514 65.9987 31.6029 178.0497 126 D 4.2781 7.9514 119.2688 57.1638 40.8379 178.2874 127 E 3.9754 7.7024 116.9309 58.4654 29.7338 177.5389 128 I 4.3429 7.4070 111.8514 60.3469 39.0314 175.1991 129 V 4.1868 7.5309 123.9480 63.4219 32.3937 175.3752 130 Q 4.8078 8.5429 129.5021 54.3179 29.8723 172.1598 131 P 4.7357 0.0000 0.0000 60.9178 32.6499 176.5890 132 D 4.4563 8.4376 119.7235 53.7630 41.2610 174.7381 133 P 4.5287 0.0000 0.0000 62.2779 32.1110 174.0700 134 P 4.6916 0.0000 0.0000 62.7868 32.1780 176.3067 135 I 4.1523 8.9371 123.7520 60.8012 39.4565 175.1319 136 A 4.2413 8.4449 123.2373 53.4552 15.4945 175.8969 137 L 4.8143 7.9575 119.4604 54.5261 43.5683 176.7895 138 N 5.1454 8.9093 119.4734 53.4665 42.8212 172.3627 139 W 5.8156 8.2045 115.0567 56.2697 31.3970 173.8686 140 T 4.5214 9.2817 116.0637 61.7088 72.6497 173.1319 141 L 4.8148 8.4218 127.2321 54.5565 42.3644 176.1244 142 L 4.3434 9.3341 128.2805 55.7894 41.8735 177.0303 143 N 4.3345 7.3470 113.3648 52.9721 39.8320 172.6062 144 V 5.0349 8.3212 111.9285 59.2038 34.7291 176.1978 145 S 4.4038 8.3664 118.3025 57.7448 63.8024 174.3448 146 L 4.1274 8.3719 122.2950 58.1711 41.9394 178.1224 147 T 3.8619 7.8899 107.7634 62.7151 68.8128 175.3997 148 G 3.9555 7.9024 108.3989 45.7272 0.0000 174.3417 149 I 3.9787 7.5504 121.4749 63.7644 38.3023 175.6709 150 H 5.6877 8.1734 116.5553 53.9826 33.0464 172.4034 151 A 5.1859 8.9935 120.5405 50.6506 23.4677 174.8220 152 D 5.3422 9.2444 119.0876 52.8108 43.7284 176.0076 153 I 4.9082 8.5078 117.2308 59.1545 41.3318 174.1250 154 Q 4.8042 9.0864 122.4535 54.3981 32.6004 173.8499 155 V 4.9921 8.8559 121.9364 60.4944 34.2747 176.0494 156 R 4.8954 8.6636 125.5737 55.3620 32.7046 171.6253 157 W 5.5485 7.5670 114.0312 56.8434 31.3945 173.2726 158 E 4.6990 9.1799 118.9350 54.3850 32.6430 175.0504 159 A 4.7431 8.9274 127.9746 51.4851 19.5014 175.5669 160 P 4.4021 0.0000 0.0000 62.5595 32.0310 177.6213 161 R 4.0997 8.9385 120.4038 59.7988 30.0662 177.9735 162 N 4.6604 8.2417 110.6924 53.6240 37.5104 175.5216 163 A 4.5616 8.1035 121.8066 53.5592 19.8521 179.0887 164 D 4.3179 7.6341 116.7268 57.7902 41.0437 178.3911 165 I 3.8821 7.8334 118.1764 64.4407 37.2571 176.4608 166 Q 3.8816 8.3480 119.1720 53.7342 28.7039 172.0128 167 K 3.8435 7.1793 122.8405 56.7948 33.9296 176.1286 168 G 3.9957 8.8975 110.7016 44.4216 0.0000 173.1673 169 W 4.2087 8.9672 135.0000 57.9016 33.0308 170.1013 170 M 2.8742 7.8719 132.1711 54.9156 28.1366 176.1347 171 V 4.2500 8.5599 123.6548 60.7090 33.8280 174.5735 172 L 4.6983 8.3379 127.5601 54.1749 42.9534 176.3629 173 E 4.4858 8.6282 118.9552 54.8300 33.1779 173.7490 174 Y 5.2520 9.1592 120.5254 56.2731 41.3051 174.4737 175 E 4.7855 8.9789 124.0118 54.2888 32.2075 174.3012 176 L 4.5453 8.3742 130.0800 54.4987 43.7590 175.3232 177 Q 5.3980 9.2836 123.4497 55.0502 32.4889 173.2486 178 Y 5.9083 9.3993 118.5612 56.2365 42.1202 173.5459 179 K 4.4316 8.6516 118.5899 55.6625 36.5329 174.2043 180 E 3.7398 8.4791 123.9947 56.3044 30.1144 178.5097 181 V 3.5698 8.3556 128.0100 64.1844 31.9805 176.8795 182 N 4.8282 7.9409 112.7888 52.3034 39.4239 179.7567 183 E 4.2174 7.9915 123.2473 57.4713 31.2295 175.5465 184 T 4.2602 8.2513 109.9272 62.7263 70.9845 170.8935 185 K 4.4078 7.6051 122.5888 53.0962 32.7362 178.3563 186 W 4.1820 8.5852 123.6216 55.5069 30.0328 176.1672 187 K 4.1568 8.7894 124.9948 56.5230 32.4695 176.1483 188 M 4.9700 8.6876 124.3060 54.2608 34.1039 175.2134 189 M 4.8874 8.5272 120.7002 53.2977 35.1598 175.8416 190 D 4.4584 8.6603 120.8115 53.4032 41.5913 174.7749 191 P 4.5753 0.0000 0.0000 63.2109 31.5372 175.5090 192 I 4.6159 8.7412 117.5504 58.8425 39.5478 176.5970 193 L 4.2991 8.5773 122.2281 56.4102 42.0249 177.2272 194 T 4.4912 7.7408 108.7706 60.7791 70.4518 173.7951 195 T 2.9789 7.7695 110.4118 60.9535 69.2743 174.0795 196 S 4.9402 7.0626 115.8755 58.7580 67.1165 174.3986 197 V 4.6367 8.2149 123.0114 59.4200 34.7566 172.7076 198 P 4.8809 0.0000 0.0000 62.3161 32.9690 175.2075 199 V 3.9979 8.4419 121.3856 61.2910 34.0391 174.2577 200 Y 5.3138 8.0631 123.9212 55.7302 41.1250 175.4133 201 S 3.7685 8.9456 112.6556 59.4408 60.6440 172.0629 202 L 4.2086 7.4345 121.4035 54.4734 42.6149 176.5460 203 K 4.6841 8.8843 123.7920 56.1154 32.3246 178.1209 204 V 3.5641 8.5654 126.6097 64.2904 31.5439 176.6163 205 D 4.9198 7.8446 118.7970 51.7189 41.0840 173.9664 206 K 4.5152 8.4646 118.6603 54.4267 36.7506 176.2286 207 E 4.3591 8.5897 124.6378 56.3761 31.1136 174.8011 208 Y 5.1080 9.3790 122.4718 56.2174 42.8985 174.0215 209 E 5.3071 9.3521 121.1366 54.6889 32.9846 175.1287 210 V 5.1653 8.9228 124.7216 61.0696 34.3608 174.3964 211 R 5.0083 9.1697 124.2319 54.2321 32.8874 174.5753 212 V 4.9013 8.4616 120.6149 59.8591 34.9590 174.4750 213 R 5.0418 8.7030 118.5981 54.3576 33.3454 173.7881 214 S 5.2906 8.2890 112.4116 56.8567 67.0637 172.4523 215 K 4.5980 8.2656 119.8241 54.9268 35.7524 174.5143 216 Q 4.1847 8.3892 128.7482 55.9597 30.0207 175.6469 217 R 3.6494 8.6433 127.1215 57.7199 29.8039 174.7620 218 N 3.8693 8.5721 116.8801 50.9748 35.4948 173.7024 219 S 4.7520 8.2206 123.0625 59.4900 65.1350 179.7677 220 G 3.5859 8.4445 108.8212 46.1314 0.0000 171.3409 221 N 4.6449 7.8492 118.9349 51.7024 40.4571 173.7569 222 Y 4.2659 8.2774 115.8300 58.4513 38.5762 177.2922 223 G 4.1765 8.1325 109.4687 44.9215 0.0000 172.8313 224 E 4.3676 8.4847 120.3087 55.5690 31.0359 176.3960 225 F 4.6651 8.4650 119.2059 56.7485 40.2653 176.2205 226 S 4.5196 8.5971 117.1503 58.0365 63.8580 173.3403 227 E 4.2750 8.5448 118.4043 56.1353 30.1429 176.9586 228 V 3.9361 8.1474 123.4444 61.3376 32.4801 175.7689 229 L 4.2235 8.8567 126.1764 54.5786 43.1205 175.6207 230 Y 5.2288 8.5392 120.3187 56.5098 40.1558 175.1125 231 V 4.1718 8.7592 126.0424 61.4481 33.2623 174.7060 232 T 4.9747 8.5294 117.5816 59.9607 71.0927 173.2055 233 L 4.6683 8.6450 126.6476 52.4998 43.1476 174.7142 234 P 4.4159 0.0000 0.0000 62.1895 32.1667 176.2108 235 Q 4.1008 8.5029 121.8685 56.3557 28.2587 175.7808 236 M 4.2348 8.4651 124.1185 55.4837 32.1717 176.6059 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 8.44 4.36 0.00 2.01 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 2.13 1.91 0.00 33 P 0.00 5.24 0.00 2.03 1.99 0.00 3.62 0.00 0.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.10 0.00 34 K 8.47 4.63 0.00 1.37 1.65 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.75 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.26 1.25 7.81 35 F 8.64 4.86 0.00 3.35 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 36 T 9.56 4.67 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 1.32 0.00 0.00 37 K 7.91 4.61 0.00 1.82 1.68 0.00 1.67 0.00 0.00 1.80 0.00 0.00 2.80 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.43 7.81 38 C 8.61 5.87 0.00 2.24 2.57 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 39 R 8.41 4.79 0.00 1.82 1.74 0.00 3.13 0.00 0.00 3.29 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 40 S 9.54 5.36 0.00 3.83 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 41 P 0.00 4.43 0.00 2.29 2.31 0.00 3.96 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.01 0.00 42 E 7.80 4.66 0.00 2.20 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 2.40 2.40 0.00 43 R 8.35 4.44 0.00 1.82 1.89 0.00 2.92 0.00 0.00 2.76 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.18 0.00 44 E 8.05 4.93 0.00 2.06 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 0.00 2.22 2.38 0.00 45 T 8.82 5.06 4.51 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 1.32 0.00 0.00 46 F 9.08 5.53 0.00 3.09 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 47 S 8.32 5.70 0.00 3.87 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 0.00 48 C 8.82 5.69 0.00 3.18 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 49 H 9.38 5.85 0.00 3.07 3.05 0.00 5.61 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 W 7.83 5.83 0.00 3.41 3.28 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 51 T 8.58 4.65 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 1.26 0.00 0.00 52 D 8.25 5.06 0.00 2.66 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 53 E 8.01 4.56 0.00 2.05 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 0.00 2.24 2.37 0.00 54 V 8.06 3.78 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 0.65 0.00 0.00 0.94 0.00 0.00 *55 H 7.84 4.43 0.00 2.89 2.85 0.00 7.23 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *56 H 8.65 4.71 0.00 2.67 2.91 0.00 5.84 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *62 G 8.69 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 63 P 0.00 4.65 0.00 2.05 1.93 0.00 3.56 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.08 0.00 64 I 8.27 4.68 1.53 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 1.40 1.01 0.60 0.00 0.00 65 Q 8.31 4.50 0.00 2.03 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.79 0.00 0.00 0.00 0.00 0.00 2.08 2.18 0.00 66 L 8.66 4.86 0.00 1.81 1.46 1.35 1.36 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 67 F 9.02 5.77 0.00 2.93 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 68 Y 9.56 6.27 0.00 3.33 3.37 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 69 T 8.24 4.46 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 0.84 0.00 0.00 70 R 8.40 3.71 0.00 1.48 1.54 0.00 3.15 0.00 0.00 3.08 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.46 0.00 71 R 8.35 3.88 0.00 1.60 1.79 0.00 3.13 0.00 0.00 3.07 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 72 N 8.45 4.37 0.00 2.68 2.51 0.00 0.00 6.76 7.71 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 0.00 0.00 0.00 0.00 0.00 0.00 152 D 9.24 5.34 0.00 2.61 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 0.00 153 I 8.51 4.91 2.10 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.13 0.94 0.00 0.00 154 Q 9.09 4.80 0.00 2.16 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.80 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 155 V 8.86 4.99 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 0.89 0.00 0.00 1.12 0.00 0.00 156 R 8.66 4.90 0.00 1.52 1.78 0.00 3.26 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.42 0.00 157 W 7.57 5.55 0.00 3.08 3.07 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 0.00 158 E 9.18 4.70 0.00 2.04 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 2.22 2.24 0.00 159 A 8.93 4.74 1.38 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 0.00 0.00 0.00 160 P 0.00 4.40 0.00 2.28 2.56 0.00 3.93 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.19 0.00 161 R 8.94 4.10 0.00 1.88 2.08 0.00 3.31 0.00 0.00 3.42 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.62 0.00 162 N 8.24 4.66 0.00 2.88 2.97 0.00 0.00 5.86 7.26 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 0.00 163 A 8.10 4.56 1.38 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 0.00 0.00 0.00 164 D 7.63 4.32 0.00 2.89 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 0.00 165 I 7.83 3.88 1.92 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 1.56 0.37 0.96 0.00 0.00 166 Q 8.35 3.88 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.01 0.00 0.00 0.00 0.00 0.00 2.80 2.69 0.00 167 K 7.18 3.84 0.00 1.99 1.86 0.00 2.10 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.41 1.68 7.81 168 G 8.90 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 0.00 169 W 8.97 4.21 0.00 3.51 3.14 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 0.00 170 M 7.87 2.87 0.00 2.20 2.20 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.35 0.00 171 V 8.56 4.25 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 1.01 0.00 0.00 0.90 0.00 0.00 172 L 8.34 4.70 0.00 1.43 1.03 0.82 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 173 E 8.63 4.49 0.00 1.88 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 2.10 2.17 0.00 174 Y 9.16 5.25 0.00 3.32 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 E 8.98 4.79 0.00 2.15 1.58 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 2.29 2.25 0.00 176 L 8.37 4.55 0.00 1.55 1.48 0.95 0.48 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 0.00 177 Q 9.28 5.40 0.00 2.47 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.45 0.00 0.00 0.00 0.00 0.00 2.16 1.66 0.00 178 Y 9.40 5.91 0.00 3.19 3.11 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 0.00 179 K 8.65 4.43 0.00 1.41 1.17 0.00 0.63 0.00 0.00 0.61 0.00 0.00 2.43 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.51 7.81 180 E 8.48 3.74 0.00 1.88 1.60 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 1.47 2.07 0.00 181 V 8.36 3.57 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 0.70 0.00 0.00 0.93 0.00 0.00 182 N 7.94 4.83 0.00 2.70 2.63 0.00 0.00 6.95 7.68 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 0.00 183 E 7.99 4.22 0.00 1.69 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 184 T 8.25 4.26 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 0.00 185 K 7.61 4.41 0.00 1.77 1.62 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.33 1.02 7.81 186 W 8.59 4.18 0.00 3.03 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 0.00 187 K 8.79 4.16 0.00 1.06 1.20 0.00 1.37 0.00 0.00 1.53 0.00 0.00 2.83 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.26 1.36 7.81 188 M 8.69 4.97 0.00 1.90 2.01 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.61 0.00 189 M 8.53 4.89 0.00 1.94 2.19 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 2.75 2.60 0.00 190 D 8.66 4.46 0.00 2.72 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 0.00 191 P 0.00 4.58 0.00 2.31 2.22 0.00 3.78 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 2.04 2.03 0.00 192 I 8.74 4.62 2.02 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.82 1.11 0.00 0.00 193 L 8.58 4.30 0.00 1.71 1.81 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 194 T 7.74 4.49 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 1.21 0.00 0.00 195 T 7.77 2.98 3.49 0.00 0.00 0.00 0.00 0.00 0.00 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 0.00 196 S 7.06 4.94 0.00 3.51 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 V 8.21 4.64 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 1.02 0.00 0.00 0.96 0.00 0.00 198 P 0.00 4.88 0.00 1.52 2.01 0.00 3.58 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.82 0.00 199 V 8.44 4.00 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 0.18 0.00 0.00 0.61 0.00 0.00 200 Y 8.06 5.31 0.00 2.81 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 0.00 201 S 8.95 3.77 0.00 4.09 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 0.00 202 L 7.43 4.21 0.00 1.35 1.13 0.09 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 203 K 8.88 4.68 0.00 1.85 1.80 0.00 1.77 0.00 0.00 1.78 0.00 0.00 3.34 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.47 7.81 204 V 8.57 3.56 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 0.76 0.00 0.00 1.00 0.00 0.00 205 D 7.84 4.92 0.00 2.62 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 0.00 206 K 8.46 4.52 0.00 1.92 1.53 0.00 1.68 0.00 0.00 1.48 0.00 0.00 2.70 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.29 1.36 7.81 207 E 8.59 4.36 0.00 2.00 1.69 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 2.36 2.35 0.00 208 Y 9.38 5.11 0.00 3.00 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 0.00 209 E 9.35 5.31 0.00 1.83 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 0.00 2.72 2.27 0.00 210 V 8.92 5.17 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 1.12 0.00 0.00 0.97 0.00 0.00 211 R 9.17 5.01 0.00 1.60 1.64 0.00 2.21 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.82 0.00 212 V 8.46 4.90 1.44 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 0.20 0.00 0.00 0.10 0.00 0.00 213 R 8.70 5.04 0.00 1.45 1.04 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.00 0.00 214 S 8.29 5.29 0.00 3.71 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 0.00 215 K 8.27 4.60 0.00 0.83 1.04 0.00 0.61 0.00 0.00 0.89 0.00 0.00 2.53 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.95 0.99 7.81 216 Q 8.39 4.18 0.00 1.89 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.82 0.00 0.00 0.00 0.00 0.00 2.10 2.21 0.00 217 R 8.64 3.65 0.00 1.62 1.78 0.00 3.44 0.00 0.00 3.27 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.48 0.00 218 N 8.57 3.87 0.00 2.81 2.87 0.00 0.00 6.19 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 S 8.22 4.75 0.00 3.93 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 0.00 220 G 8.44 3.59 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 0.00 0.00 0.00 221 N 7.85 4.64 0.00 2.70 2.72 0.00 0.00 6.90 8.81 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 0.00 222 Y 8.28 4.27 0.00 2.72 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 0.00 223 G 8.13 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 0.00 0.00 0.00 0.00 224 E 8.48 4.37 0.00 1.83 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 2.27 2.29 0.00 225 F 8.47 4.67 0.00 2.78 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 S 8.60 4.52 0.00 3.84 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 0.00 227 E 8.54 4.28 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 228 V 8.15 3.94 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 0.49 0.00 0.00 0.88 0.00 0.00 229 L 8.86 4.22 0.00 1.80 1.63 1.16 0.90 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 0.00 230 Y 8.54 5.23 0.00 2.91 2.85 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 0.00 231 V 8.76 4.17 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 -0.39 0.00 0.00 0.38 0.00 0.00 232 T 8.53 4.97 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 1.29 0.00 0.00 233 L 8.64 4.67 0.00 1.86 1.69 0.87 0.95 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 0.00 234 P 0.00 4.42 0.00 2.23 2.13 0.00 3.92 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 235 Q 8.50 4.10 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.03 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 236 M 8.47 4.23 0.00 2.07 1.98 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.56 0.00 * Residues marked with a * may have inaccurate shift predictions.