NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 58 D 4.3780 8.3649 120.4716 54.1386 41.9582 175.3419 59 F 4.5260 8.3332 123.5242 55.1984 40.6316 172.5738 60 Y 4.8911 8.3884 118.5317 56.7621 40.8050 173.5250 61 D 4.8360 9.1957 121.4777 56.1998 42.1546 177.3881 62 V 4.6636 7.7808 115.5374 60.2607 34.8331 173.4487 63 A 5.0777 8.1537 122.9227 50.2800 22.0001 175.2822 64 F 4.9552 9.0432 118.4420 55.6947 44.1344 173.9035 65 K 5.1627 9.2122 120.2530 55.0672 34.1933 175.4480 66 V 4.9749 8.9845 125.1440 61.3301 34.5868 174.0305 67 M 5.4354 9.0451 126.7063 53.6410 35.3256 174.4720 68 L 5.0149 8.9143 123.1289 53.5697 43.4501 176.4315 69 V 4.2234 9.3428 115.7754 59.1223 36.3257 174.6280 70 G 3.6001 6.7767 108.5954 42.6570 0.0000 172.7715 71 D 4.8896 8.2994 120.2706 54.1370 41.4345 176.5334 72 S 4.3294 8.6225 116.3925 60.0567 62.1180 174.6822 73 G 3.8624 9.1716 115.5480 45.3436 0.0000 175.3883 74 V 3.6980 7.2522 112.2295 62.5510 31.8909 176.8610 75 G 4.2082 7.7612 106.0349 45.5932 0.0000 175.8151 76 K 3.8872 8.6055 120.7792 59.7602 31.9175 179.0641 77 T 4.0173 7.9355 114.9827 67.0902 68.4377 176.3890 78 C 4.2113 8.1772 118.0579 62.7111 28.2099 175.8019 79 L 4.0692 8.4889 122.4163 58.1914 41.6147 179.0973 80 L 4.1096 8.0698 118.9205 57.7871 41.5495 179.6249 81 V 3.5641 8.1726 118.5333 65.8895 31.4374 178.0330 82 R 4.3061 8.3888 120.1424 58.9036 29.7511 178.2902 83 F 4.2823 8.0633 119.0690 61.2249 39.4424 176.7653 84 K 3.6427 8.0830 118.1852 58.7977 31.9921 177.6683 85 D 4.7772 8.4791 117.1184 52.8604 41.4526 177.5341 86 G 4.2914 8.0499 106.8913 45.8119 0.0000 173.2659 87 A 4.7617 7.4976 120.9693 49.7818 22.0844 175.7193 88 F 4.8488 8.9028 124.1814 56.9131 40.8975 175.6059 89 L 4.1631 7.9594 128.7483 52.7568 41.5378 174.0144 90 A 3.9898 8.0716 131.9263 50.0551 17.6750 176.4891 91 G 4.1253 6.9785 115.5597 44.6083 0.0000 172.0944 92 T 3.9842 8.3190 120.1299 62.9990 69.0978 174.0053 93 F 4.4783 8.8708 128.4026 58.5258 38.8970 174.7692 94 I 3.9976 8.0261 130.1948 58.9393 37.5560 175.8557 95 S 3.9965 7.5430 121.8837 58.5664 63.4278 174.9063 96 T 4.0565 8.5274 122.4458 63.6459 68.9253 175.3517 97 V 3.9226 8.5433 125.9430 64.3351 32.3266 174.9418 98 G 4.4491 7.5910 104.0373 44.5581 0.0000 171.7831 99 I 5.0855 8.6732 112.7570 59.8918 39.4281 174.7997 100 D 4.9660 8.6614 121.0604 52.5451 42.3570 173.8021 101 F 5.1922 7.8291 114.2702 54.9662 41.1153 174.2527 102 R 4.6012 8.8016 115.2554 54.8795 32.9567 173.4348 103 N 5.4958 8.7034 118.4104 51.8507 40.9294 174.2231 104 K 4.4853 8.9647 123.0401 54.9263 36.2855 174.6436 105 V 4.7464 8.2857 126.4649 61.4980 32.9886 174.7641 106 L 4.9778 9.1279 127.3263 52.9256 46.0023 174.7747 107 D 5.2183 8.5985 121.2442 53.2698 43.1080 175.5158 108 V 4.2496 8.9363 125.1963 61.9492 33.4586 174.7076 109 D 4.4629 9.7201 128.5546 55.5652 38.1678 175.0745 110 G 3.9453 8.7164 104.1356 44.7805 0.0000 173.8906 111 V 4.5806 7.7866 120.0251 60.8966 34.4780 174.5560 112 K 4.9582 9.7742 126.8795 55.2254 33.9422 175.5249 113 V 4.9078 9.0319 126.0407 60.9536 33.9929 174.1872 114 K 4.6030 9.2663 130.3169 55.5887 33.6784 175.0817 115 L 5.0215 9.1741 127.8316 53.2800 43.9955 175.4850 116 Q 4.6083 9.2435 127.2731 55.3888 29.7628 173.7998 117 M 5.2000 9.2120 127.7271 53.7094 34.2032 175.2751 118 W 5.2078 9.6317 124.5290 55.1573 31.4625 175.3308 119 D 5.2308 9.0390 125.2313 54.1123 42.4290 174.9695 120 T 5.1782 8.2385 111.6102 59.9284 72.3988 172.8380 121 A 4.4624 8.1777 124.4580 51.2989 18.5501 178.0852 122 G 3.9907 8.9852 111.3125 47.4507 0.0000 174.6610 123 Q 4.1239 8.1372 116.4841 57.4693 28.9225 176.4762 *132 A 4.2568 7.9211 122.5352 52.6382 20.7662 178.3898 *133 Y 3.9792 7.7340 114.3846 60.0530 37.7829 182.5932 134 Y 4.3723 8.5796 121.1842 61.8508 37.9314 179.9349 135 R 4.1634 8.1598 115.2498 58.4738 29.5992 178.6405 136 D 4.6134 8.0617 114.4843 55.8821 41.7462 177.2374 137 A 4.1429 7.5332 121.2118 52.6199 19.0440 176.8224 138 H 4.8515 9.0459 117.3960 57.4105 30.5754 175.2281 139 A 5.1501 7.7849 117.8335 50.4460 22.9743 175.0249 140 L 5.0756 8.6453 119.1217 52.9093 45.7959 175.6502 141 L 4.6890 8.7147 124.0975 53.3520 43.5350 175.1474 142 L 4.8585 8.9359 127.0798 53.3504 43.8361 174.9002 143 L 5.3393 8.3444 126.5924 53.1393 44.0243 175.1423 144 Y 4.9771 8.5925 120.0359 55.2788 42.3724 173.2599 145 D 5.0329 9.2897 119.1192 52.4277 42.9575 177.4795 146 V 3.8825 8.8135 120.2364 63.8721 31.7399 177.5730 147 T 4.4826 8.2576 108.0108 60.6086 69.5872 174.1105 148 N 4.8398 8.1588 121.8266 51.2124 40.1334 174.3779 149 K 4.1414 8.7208 127.7043 59.4241 32.3106 178.2116 150 A 4.0648 8.1009 121.0378 55.0836 18.1138 179.5233 151 S 4.9323 8.5589 113.7365 61.2399 63.4475 176.3118 152 F 4.0963 8.0662 123.1725 61.0557 38.8976 177.0307 153 D 4.2675 8.2677 117.6816 56.9601 41.0342 177.6300 154 N 4.6326 8.1982 115.2710 53.8458 38.7203 177.0798 155 I 3.8508 7.3435 122.4516 64.6067 37.2128 177.7545 156 Q 3.6471 7.9845 119.4795 59.1138 28.7681 178.2420 157 A 3.9255 7.8332 121.1895 54.9200 18.4326 179.4370 158 W 4.1687 7.9900 117.1210 59.8922 29.0888 178.7908 159 L 3.8600 8.1389 119.0816 57.9783 40.9381 179.5672 160 T 3.9003 8.2431 116.1089 66.5842 68.3477 176.1056 161 E 4.1177 8.3335 120.9943 59.4743 29.7164 178.7695 162 I 3.7702 8.1020 119.7858 65.0228 37.0060 178.0217 163 H 4.2865 8.2422 115.7664 59.0476 28.5625 177.1630 164 E 3.9356 8.3253 120.4090 58.5544 29.5799 176.8720 165 Y 4.5987 8.2678 113.6931 57.7741 39.8601 175.6866 166 A 4.7506 8.2758 122.6478 50.2277 20.2490 176.8082 167 Q 4.1365 8.5168 118.1155 56.6874 29.2668 178.3831 168 H 4.2326 8.8481 120.2245 58.5194 30.1736 175.5046 169 D 4.8741 7.9083 117.3510 53.1050 39.5888 176.5401 170 V 4.0794 7.1997 112.3638 61.9088 32.2440 176.1513 171 A 4.2924 8.8076 126.7971 51.9370 19.5339 176.4658 172 L 5.4450 8.1670 119.1002 52.3435 46.1654 175.6931 173 M 4.8810 8.2209 119.0170 54.3842 36.1108 172.7556 174 L 5.1752 9.2081 128.3103 53.5723 44.4725 174.8410 175 L 5.4368 8.6188 126.2076 51.9485 45.1073 175.8003 176 G 3.1675 8.2225 111.6056 44.5630 0.0000 172.4520 177 N 5.1119 8.3885 126.5677 50.9521 41.6274 174.4216 178 K 4.1445 8.2287 116.1848 57.3599 28.9913 177.7181 179 V 3.8879 7.6297 120.6999 61.3688 29.5892 173.9915 180 D 4.5026 7.6483 124.1726 51.9517 41.8452 177.2077 181 S 4.1125 8.6455 114.6980 61.4626 63.0144 176.0836 182 A 4.0115 7.9226 122.4537 54.8747 18.0328 176.8901 183 H 4.9763 7.7022 111.2405 54.3406 33.1143 173.3088 184 E 4.2843 8.4944 116.6906 54.9424 30.3066 176.0976 185 R 4.1898 8.5535 124.5653 55.7704 30.7482 176.3438 186 V 4.2099 8.8548 117.0879 61.2874 34.0350 176.0302 187 V 3.9875 7.5440 119.2253 60.6385 32.1977 175.5227 188 K 4.1787 8.2145 126.9764 55.9695 32.8831 177.9929 189 R 4.2134 8.8714 124.4318 60.3866 29.8194 179.2956 190 E 3.9695 8.1940 117.5381 61.4321 29.6918 181.1030 191 D 4.6262 7.9420 119.8370 57.0244 40.8217 179.2215 192 G 3.4433 7.6248 107.2004 46.8973 0.0000 175.4329 193 E 3.5721 7.9009 121.2481 58.9353 29.5307 179.4265 194 K 3.8595 8.0994 119.6642 59.2978 32.1494 178.5141 195 L 3.9461 7.9398 120.3255 58.1117 42.1320 178.5022 196 A 4.0789 7.8694 120.6471 55.3151 18.3431 179.3470 197 K 3.8213 8.2370 118.1107 59.8579 32.0077 178.5311 198 E 3.8913 8.0669 118.1193 58.3664 29.4950 176.8068 199 Y 4.4928 7.4911 113.9172 57.1631 38.5578 176.5570 200 G 3.9645 8.0079 107.1770 45.6468 0.0000 173.9860 201 L 4.4537 7.6733 119.4528 53.2979 42.6624 175.4210 202 P 4.5924 0.0000 0.0000 62.9455 32.7186 175.0103 203 F 5.5424 8.5154 122.9981 57.3036 42.8257 173.4735 204 M 4.3137 7.8638 122.8983 53.8353 36.7016 173.8580 205 E 4.7165 8.1249 121.4259 55.8435 30.8984 175.3351 206 T 4.8528 8.5094 112.0253 60.6775 73.5208 172.7047 207 S 4.6939 8.5610 115.5820 57.1740 64.9837 174.7714 208 A 4.0062 8.3246 131.2191 55.0864 18.6271 178.6454 209 K 2.4824 7.5831 116.2482 59.0902 32.1743 177.8604 210 T 4.0677 7.7088 106.5217 61.7762 69.5999 175.8082 211 G 3.8537 8.4751 111.1570 44.4703 0.0000 172.5466 212 L 3.8067 7.5575 121.6451 56.6644 42.2393 176.5129 213 N 4.0521 9.0233 120.9555 54.2221 36.5995 176.4323 214 V 3.6039 7.6436 118.3948 66.1050 31.5551 177.5190 215 D 4.6657 8.3151 117.9801 57.9338 40.7815 179.2285 216 L 3.9867 7.9211 118.3434 57.4168 41.7986 179.2656 217 A 3.7917 8.0617 120.9442 55.2201 18.3499 179.7862 218 F 3.7822 7.6390 115.8192 60.6978 38.7033 178.0998 219 T 3.9209 8.1960 115.4429 66.5738 68.1628 176.5521 220 A 3.9490 8.0423 122.6806 55.0587 18.3117 179.5797 221 I 3.4825 7.5694 116.5730 64.0320 38.0025 177.8952 222 A 3.8981 8.0242 121.6733 54.9961 18.2179 179.4447 223 K 3.8347 8.3672 118.4708 59.6796 32.0610 178.6425 224 E 3.8761 8.0759 118.3967 59.0849 29.6187 178.4282 225 L 3.7189 7.6453 118.2154 57.4612 41.6108 178.8379 226 K 4.1785 7.8029 118.3515 59.7202 32.2031 177.0635 227 R 4.3147 7.8812 120.8746 56.3724 30.3128 176.1828 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 58 D 8.36 4.38 0.00 2.58 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 59 F 8.33 4.53 0.00 3.12 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 60 Y 8.39 4.89 0.00 3.22 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 61 D 9.20 4.84 0.00 2.72 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 62 V 7.78 4.66 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 0.87 0.00 0.00 0.50 0.00 0.00 63 A 8.15 5.08 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 64 F 9.04 4.96 0.00 2.99 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 65 K 9.21 5.16 0.00 1.78 1.89 0.00 1.61 0.00 0.00 1.76 0.00 0.00 2.83 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.79 1.55 7.81 66 V 8.98 4.97 2.26 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 1.03 0.00 0.00 1.05 0.00 0.00 67 M 9.05 5.44 0.00 2.06 1.90 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.61 0.00 68 L 8.91 5.01 0.00 1.54 1.57 1.10 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 69 V 9.34 4.22 1.50 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 0.78 0.00 0.00 0.71 0.00 0.00 70 G 6.78 3.60 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 0.00 0.00 0.00 0.00 0.00 0.00 71 D 8.30 4.89 0.00 2.97 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 72 S 8.62 4.33 0.00 3.99 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 73 G 9.17 3.86 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 0.00 0.00 0.00 74 V 7.25 3.70 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 0.81 0.00 0.00 0.96 0.00 0.00 75 G 7.76 4.21 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 0.00 76 K 8.61 3.89 0.00 1.86 2.02 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.22 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.51 7.81 77 T 7.94 4.02 4.34 0.00 0.00 0.00 0.00 0.00 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 78 C 8.18 4.21 0.00 3.12 3.26 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 79 L 8.49 4.07 0.00 1.97 1.91 0.94 0.46 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 80 L 8.07 4.11 0.00 2.03 1.75 1.02 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.17 3.56 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 1.07 0.00 0.00 0.99 0.00 0.00 82 R 8.39 4.31 0.00 2.08 2.29 0.00 3.31 0.00 0.00 3.26 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.66 0.00 83 F 8.06 4.28 0.00 2.74 2.82 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 84 K 8.08 3.64 0.00 1.57 1.81 0.00 1.47 0.00 0.00 1.51 0.00 0.00 3.01 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.33 1.38 7.81 85 D 8.48 4.78 0.00 2.77 2.60 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 0.00 0.00 0.00 86 G 8.05 4.29 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 A 7.50 4.76 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 88 F 8.90 4.85 0.00 3.11 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 89 L 7.96 4.16 0.00 1.70 1.46 0.92 0.83 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 90 A 8.07 3.99 1.32 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 0.00 0.00 91 G 6.98 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 92 T 8.32 3.98 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 93 F 8.87 4.48 0.00 2.87 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 94 I 8.03 4.00 1.82 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.89 0.83 0.00 0.00 95 S 7.54 4.00 0.00 3.51 3.71 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 96 T 8.53 4.06 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 1.31 0.00 0.00 97 V 8.54 3.92 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 0.80 0.00 0.00 0.97 0.00 0.00 98 G 7.59 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 I 8.67 5.09 2.31 0.00 0.00 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 1.23 2.29 1.01 0.00 0.00 100 D 8.66 4.97 0.00 2.68 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 0.00 101 F 7.83 5.19 0.00 1.78 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 0.00 102 R 8.80 4.60 0.00 1.74 1.86 0.00 2.70 0.00 0.00 3.16 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.56 0.00 103 N 8.70 5.50 0.00 2.60 2.71 0.00 0.00 6.67 7.61 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 0.00 104 K 8.96 4.49 0.00 1.50 1.44 0.00 1.06 0.00 0.00 0.61 0.00 0.00 2.19 0.00 0.00 2.52 0.00 0.00 0.00 0.00 1.02 1.13 7.81 105 V 8.29 4.75 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 0.99 0.00 0.00 0.92 0.00 0.00 106 L 9.13 4.98 0.00 1.67 1.61 1.16 0.98 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 0.00 107 D 8.60 5.22 0.00 2.76 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 0.00 108 V 8.94 4.25 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 1.07 0.00 0.00 1.00 0.00 0.00 109 D 9.72 4.46 0.00 2.89 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 0.00 110 G 8.72 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 0.00 111 V 7.79 4.58 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 1.09 0.00 0.00 0.98 0.00 0.00 112 K 9.77 4.96 0.00 1.81 1.85 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.60 7.81 113 V 9.03 4.91 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 1.09 0.00 0.00 114 K 9.27 4.60 0.00 0.79 0.85 0.00 1.43 0.00 0.00 0.88 0.00 0.00 2.27 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.13 1.11 7.81 115 L 9.17 5.02 0.00 1.73 1.72 1.14 1.14 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 0.00 116 Q 9.24 4.61 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.80 0.00 0.00 0.00 0.00 0.00 1.70 1.96 0.00 117 M 9.21 5.20 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.73 0.00 118 W 9.63 5.21 0.00 3.34 3.29 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 0.00 0.00 0.00 0.00 119 D 9.04 5.23 0.00 2.83 2.62 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 0.00 120 T 8.24 5.18 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 121 A 8.18 4.46 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 0.00 122 G 8.99 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 Q 8.14 4.12 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.60 0.00 0.00 0.00 0.00 0.00 2.48 2.45 0.00 *132 A 7.92 4.26 1.23 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 0.00 0.00 *133 Y 7.73 3.98 0.00 2.25 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 0.00 0.00 0.00 0.00 134 Y 8.58 4.37 0.00 3.00 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 0.00 135 R 8.16 4.16 0.00 1.83 1.86 0.00 3.25 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.23 0.00 136 D 8.06 4.61 0.00 2.65 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 0.00 137 A 7.53 4.14 1.32 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 0.00 0.00 138 H 9.05 4.85 0.00 3.48 3.48 0.00 5.81 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 A 7.78 5.15 1.14 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 0.00 140 L 8.65 5.08 0.00 1.42 1.35 0.65 0.01 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 0.00 141 L 8.71 4.69 0.00 1.43 1.37 0.20 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 142 L 8.94 4.86 0.00 1.59 1.46 0.59 0.52 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 0.00 143 L 8.34 5.34 0.00 1.41 1.44 0.79 0.60 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 0.00 144 Y 8.59 4.98 0.00 3.17 3.22 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 0.00 145 D 9.29 5.03 0.00 2.68 2.62 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 0.00 146 V 8.81 3.88 2.27 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 0.71 0.00 0.00 1.00 0.00 0.00 147 T 8.26 4.48 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 1.23 0.00 0.00 148 N 8.16 4.84 0.00 2.72 2.79 0.00 0.00 6.75 6.31 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 0.00 149 K 8.72 4.14 0.00 1.90 1.84 0.00 1.82 0.00 0.00 1.86 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.75 1.62 7.81 150 A 8.10 4.06 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 0.00 151 S 8.56 4.93 0.00 4.21 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 0.00 152 F 8.07 4.10 0.00 2.89 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 0.00 153 D 8.27 4.27 0.00 2.86 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 0.00 154 N 8.20 4.63 0.00 3.08 2.92 0.00 0.00 6.89 7.30 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 0.00 155 I 7.34 3.85 1.66 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.74 0.80 0.00 0.00 156 Q 7.98 3.65 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 157 A 7.83 3.93 1.20 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 0.00 0.00 158 W 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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 0.00 167 Q 8.52 4.14 0.00 2.12 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.86 0.00 0.00 0.00 0.00 0.00 2.61 2.35 0.00 168 H 8.85 4.23 0.00 3.11 3.37 0.00 5.91 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 D 7.91 4.87 0.00 2.85 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 0.00 170 V 7.20 4.08 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 0.94 0.00 0.00 171 A 8.81 4.29 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 0.00 172 L 8.17 5.45 0.00 1.46 1.48 0.89 0.82 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 0.00 173 M 8.22 4.88 0.00 1.90 1.73 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.41 0.00 174 L 9.21 5.18 0.00 1.92 1.95 1.18 0.69 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 183 H 7.70 4.98 0.00 3.09 3.16 0.00 5.70 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 E 8.49 4.28 0.00 1.89 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 1.86 0.00 185 R 8.55 4.19 0.00 1.76 1.86 0.00 3.14 0.00 0.00 3.33 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.73 0.00 186 V 8.85 4.21 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 0.74 0.00 0.00 1.02 0.00 0.00 187 V 7.54 3.99 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 -0.15 0.00 0.00 0.69 0.00 0.00 188 K 8.21 4.18 0.00 1.92 1.68 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.83 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.35 7.81 189 R 8.87 4.21 0.00 1.95 2.00 0.00 3.26 0.00 0.00 3.57 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.02 0.00 190 E 8.19 3.97 0.00 2.01 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 0.00 2.32 1.98 0.00 191 D 7.94 4.63 0.00 2.49 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 0.00 192 G 7.62 3.44 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 E 7.90 3.57 0.00 2.14 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 2.45 2.54 0.00 194 K 8.10 3.86 0.00 1.94 1.96 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.42 7.81 195 L 7.94 3.95 0.00 2.02 1.68 1.04 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 196 A 7.87 4.08 1.50 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 0.00 197 K 8.24 3.82 0.00 1.92 1.98 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.45 7.81 198 E 8.07 3.89 0.00 1.94 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 1.47 1.95 0.00 199 Y 7.49 4.49 0.00 2.94 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 0.00 200 G 8.01 3.96 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 0.00 201 L 7.67 4.45 0.00 1.66 1.67 1.03 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 202 P 0.00 4.59 0.00 2.06 1.97 0.00 3.76 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.08 0.00 203 F 8.52 5.54 0.00 2.98 2.92 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 0.00 0.00 0.00 204 M 7.86 4.31 0.00 1.68 1.57 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 205 E 8.12 4.72 0.00 1.70 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 2.22 2.22 0.00 206 T 8.51 4.85 4.19 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 0.00 0.00 0.00 1.02 0.00 0.00 207 S 8.56 4.69 0.00 3.96 3.60 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 0.00 0.00 0.00 208 A 8.32 4.01 1.50 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 0.00 209 K 7.58 2.48 0.00 0.79 1.35 0.00 1.51 0.00 0.00 1.54 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.06 0.59 7.81 210 T 7.71 4.07 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 211 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 0.00 212 L 7.56 3.81 0.00 1.70 1.61 0.87 0.44 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 0.00 213 N 9.02 4.05 0.00 2.97 2.73 0.00 0.00 6.75 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 0.00 214 V 7.64 3.60 2.27 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 1.31 0.00 0.00 1.02 0.00 0.00 215 D 8.32 4.67 0.00 2.81 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 0.00 216 L 7.92 3.99 0.00 1.78 1.67 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 217 A 8.06 3.79 1.05 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 0.00 218 F 7.64 3.78 0.00 2.03 2.39 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.20 3.92 4.39 0.00 0.00 0.00 0.00 0.00 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 0.00 220 A 8.04 3.95 1.29 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 0.00 0.00 0.00 0.00 0.00 0.00 221 I 7.57 3.48 1.70 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.35 0.85 0.00 0.00 222 A 8.02 3.90 1.48 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 0.00 0.00 223 K 8.37 3.83 0.00 1.96 2.01 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.45 7.81 224 E 8.08 3.88 0.00 1.93 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 2.24 2.30 0.00 225 L 7.65 3.72 0.00 0.77 0.13 0.61 0.66 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 0.00 226 K 7.80 4.18 0.00 1.89 2.04 0.00 1.97 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.54 1.62 7.81 227 R 7.88 4.31 0.00 1.82 1.82 0.00 3.24 0.00 0.00 3.27 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 * Residues marked with a * may have inaccurate shift predictions.