NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 31 A 4.3478 8.2649 123.5887 51.3525 19.8845 176.3116 32 P 4.2802 0.0000 0.0000 59.7931 32.2015 174.1172 33 W 5.0244 8.3820 119.9883 54.4525 32.1439 174.2070 34 F 4.5517 8.7556 117.6112 55.6019 41.8966 173.9577 35 L 4.8703 9.2982 127.6386 53.2949 44.9633 174.5142 36 E 5.1924 9.2181 127.9054 54.9920 30.9767 174.2096 37 Y 5.3638 9.2928 128.6064 55.9885 42.2555 174.1389 38 S 5.0297 8.9058 119.6268 56.4742 66.7336 173.1993 39 K 4.5488 8.8339 120.7281 54.7793 35.5783 175.3672 40 S 4.9460 8.8312 120.8434 57.0222 64.4758 172.9571 41 E 4.5500 9.1115 125.7594 55.0337 31.2843 174.7519 42 C 4.9803 8.8253 122.0977 55.6644 37.6782 172.7476 43 H 4.7044 8.7770 122.1859 53.9792 30.4640 174.1260 44 F 5.0662 8.4370 121.2333 55.7153 42.0651 174.3600 45 Y 4.5124 8.3062 120.0333 56.6609 40.8450 174.2913 46 N 4.2698 9.6547 123.2592 54.2716 35.8690 175.2405 47 G 3.8781 7.8186 108.2050 45.8536 0.0000 172.0553 48 T 4.4274 8.0406 114.1615 61.9510 69.3034 175.9431 49 Q 3.9813 7.8773 125.2544 59.3238 29.2110 176.2837 50 R 4.5473 7.8650 119.0785 54.6844 32.5932 173.9520 51 V 4.6036 8.4361 126.1741 61.3667 34.0756 175.0462 52 R 4.5376 8.3128 125.7266 54.9202 33.6312 173.1846 53 L 4.9331 8.9770 129.3449 53.6893 44.2893 174.9953 54 L 5.1355 9.1413 127.7680 53.6043 45.1399 174.7565 55 V 4.6896 8.8963 127.7414 61.5495 33.3812 174.7001 56 R 5.0146 9.1251 126.8983 54.5664 33.4582 174.0116 57 Y 5.0346 8.8409 121.3303 56.2865 40.7125 174.8742 58 F 5.4756 9.8967 121.9664 55.8831 43.8130 173.5600 59 Y 5.0222 9.1068 123.2009 57.0327 41.1187 177.1335 60 N 3.9436 9.0028 128.3101 54.6105 37.5770 175.7287 61 L 4.6968 9.0810 125.7262 55.2930 42.9099 175.4314 62 E 4.7008 8.1708 120.1650 54.4064 31.1157 174.7022 63 E 4.4062 9.0047 125.1432 55.6120 29.9797 175.2040 64 N 4.9399 8.8261 123.9081 53.2609 39.7014 174.0982 65 L 5.1058 7.6791 120.1063 54.5067 45.7771 173.5633 66 R 5.3425 8.6961 117.9173 55.2968 33.5357 173.6437 67 F 4.4691 9.3508 122.4994 56.4853 42.3092 173.0599 68 D 5.0170 7.7922 127.1366 52.2973 42.3089 177.0562 69 S 4.1302 9.1266 122.5696 61.4904 63.0342 175.9594 70 D 4.4511 8.0816 118.8065 55.4903 40.7058 176.8173 71 V 3.8906 8.0664 118.8309 62.2173 32.7298 176.7877 72 G 3.9138 9.0023 106.3602 44.9502 0.0000 172.2922 73 E 4.8200 6.7104 114.8447 54.8260 32.1087 174.7475 74 F 4.6158 9.1064 118.7469 58.0214 40.1119 175.6085 75 R 4.6985 9.1888 120.2507 54.2872 33.9931 174.6823 76 A 4.2074 8.9084 126.2369 52.6207 18.5601 176.9098 77 V 4.2287 9.0331 121.3827 64.1302 33.1992 175.8264 78 T 4.7735 7.5308 108.1915 58.6141 72.2768 174.0708 79 E 3.8834 8.9867 121.0882 59.8305 29.1507 179.4463 80 L 4.0348 7.3856 117.9932 56.9980 41.9200 178.0480 81 G 3.9167 7.9669 104.1772 44.5051 0.0000 175.1275 82 R 3.8202 7.9797 122.2388 58.9945 30.0996 176.3407 83 P 4.0574 0.0000 0.0000 66.0509 31.2730 178.2460 84 D 3.3700 7.5518 116.5175 56.5978 40.5205 178.5307 85 A 3.9034 7.3140 120.7425 55.1116 18.2202 179.3567 86 E 3.8604 7.9172 115.8365 59.6860 29.7304 178.8733 87 N 4.3453 8.1227 117.0178 56.7261 39.1802 176.9585 88 W 4.4838 8.2694 120.4996 59.8952 28.9323 178.3931 89 N 4.7450 8.6176 116.1308 55.6180 37.9094 175.7596 90 S 4.7368 7.5526 114.0242 58.2394 63.4443 174.8112 91 Q 4.6048 7.9399 121.7840 52.5602 29.0139 173.7346 92 P 4.3048 0.0000 0.0000 66.1242 30.9978 178.0746 93 E 3.9875 8.2449 117.4298 59.2765 29.6133 179.0625 94 F 4.4035 8.2439 120.0156 61.3051 39.7187 176.9358 95 L 3.8459 8.1394 118.7039 57.7634 41.3098 179.1033 96 E 3.9485 8.3468 119.2441 59.2784 29.3150 178.6829 97 Q 3.9300 7.4504 118.8231 58.9234 29.3553 178.1819 98 K 3.9133 7.4621 119.0116 59.5471 31.6824 179.4205 99 R 4.0911 7.7547 117.6439 59.4671 29.9660 178.7774 100 A 4.1866 7.8875 119.6071 54.4187 18.4376 179.2777 101 E 4.6158 8.3481 119.1857 58.7773 29.3954 179.3909 102 V 3.7929 7.5503 117.2280 65.3012 31.3543 177.0339 103 D 4.6309 7.7566 117.3197 56.2430 42.1035 178.6727 104 T 3.9583 8.6106 110.3980 64.1695 68.6107 174.5873 105 V 4.1944 8.2524 118.6090 64.9199 33.3950 176.2592 106 C 4.2890 8.2903 114.6637 61.1070 37.3318 176.2983 107 R 4.0570 8.6398 119.0093 59.7342 30.0243 178.7145 108 H 4.0638 8.1315 117.6141 59.6171 29.8306 177.1586 109 N 3.9684 8.6608 118.5144 55.9995 38.2176 176.8632 110 Y 3.6939 8.2016 121.2411 60.5074 38.5994 177.5736 111 E 4.0010 8.0050 119.2701 59.4121 30.0477 178.7975 112 I 3.8428 6.9482 118.8847 64.5639 37.1908 178.5721 113 F 4.2124 7.8120 118.4142 60.0476 38.4205 176.8973 114 D 4.1987 8.0119 116.9489 56.1343 41.0418 176.8778 115 N 4.7766 7.9109 114.8935 54.7589 39.0191 175.0065 116 F 5.0012 7.6949 110.8857 57.2452 43.5722 175.3750 117 L 3.8560 7.5524 121.8399 56.7022 42.1617 178.9139 118 V 3.5466 7.6373 116.7174 65.3917 31.3228 174.7472 119 P 4.6007 0.0000 0.0000 62.5926 31.6245 175.9019 120 R 3.9922 7.5495 120.1352 57.1227 30.3115 175.8065 121 R 5.1412 8.4756 123.0131 54.6723 34.4676 174.6861 122 V 4.4795 9.2754 123.1811 61.0040 34.6555 174.3973 123 E 4.9458 9.2752 128.1586 55.2048 29.9729 175.3594 124 P 4.8688 0.0000 0.0000 63.2577 32.9435 175.4330 125 T 4.5851 8.8621 118.1574 62.0519 70.4979 173.6795 126 V 5.0021 8.4665 126.6698 61.2777 33.6308 174.7045 127 T 4.8799 8.8081 117.0033 60.0886 72.4566 172.8752 128 V 5.1105 8.1814 122.4342 61.7066 34.6968 174.0649 129 Y 4.8176 7.9353 120.5689 55.8780 41.2852 171.9437 130 P 4.9432 0.0000 0.0000 62.5943 32.9760 174.6061 131 T 4.3271 8.4253 112.7036 62.5557 71.9432 173.7523 *132 K 4.1622 8.9872 123.1520 55.8642 33.4468 173.7970 *133 T 3.9029 8.0529 117.9400 62.1617 67.8987 175.6468 *134 Q 4.7190 7.4501 130.5436 54.6535 26.3101 177.7052 *135 P 4.3995 0.0000 0.0000 63.4322 31.2989 177.4547 *136 L 4.3944 8.1533 120.9771 55.3889 44.1882 172.0444 *137 E 3.6151 8.7041 120.6244 61.5250 25.8188 169.9201 *138 H 4.6227 7.9064 130.7365 51.1691 26.5257 170.8466 *139 H 4.5994 6.9624 112.2553 52.8278 29.4683 176.7478 140 N 5.8534 8.4034 119.1300 50.0773 39.7119 173.6742 141 L 4.8884 7.6243 119.9400 52.8017 45.6288 174.7853 142 L 4.2494 8.4618 126.7992 53.1104 43.9661 174.9222 143 V 4.4099 8.1997 127.2172 61.2606 33.7088 173.4339 144 C 4.7939 9.3042 128.8818 55.1404 41.4286 172.1754 145 S 4.9081 9.0187 123.3045 57.0234 63.6705 172.9106 146 V 4.6830 8.9343 128.3304 61.3030 33.6469 174.3217 147 S 5.1718 8.6781 122.0588 55.8499 67.0629 172.8883 148 D 4.4261 8.5632 116.7201 55.6913 39.0900 171.5400 149 F 5.4890 7.5140 113.7072 55.7754 42.5052 174.6286 150 Y 5.1388 8.7178 117.1963 56.3731 42.6540 172.7361 151 P 3.1246 0.0000 0.0000 61.7104 32.8891 175.9294 152 G 2.7350 8.1334 107.5096 47.7661 0.0000 173.8351 153 N 4.3887 7.7681 118.0475 52.5660 37.7815 173.9378 154 I 4.6415 7.7991 121.8175 59.6793 41.5765 173.1592 155 E 4.6958 9.0793 125.3565 54.4120 32.9690 175.2333 156 V 4.6728 8.3547 123.0487 61.2757 34.1231 174.5806 157 R 4.7196 9.1212 126.9160 54.0993 34.0812 174.6944 158 W 5.3451 8.4039 120.4844 55.1307 32.4077 174.7913 159 F 5.4205 9.8030 121.4946 55.7893 43.0986 173.9721 160 R 4.4050 9.3000 123.4536 54.4199 32.0190 175.2827 161 N 4.1982 10.1026 126.7839 54.2132 36.8258 175.9234 162 G 3.9837 8.7702 106.0758 44.8635 0.0000 174.0102 163 K 4.6294 8.0978 120.2817 54.1190 33.6593 175.3183 164 E 3.5885 8.9517 125.3377 55.9231 29.7832 175.8845 165 E 4.2081 8.7043 127.5450 56.0267 29.4209 176.6070 166 K 4.1950 8.6441 124.3503 57.5517 33.0760 177.3240 167 T 4.4494 7.7765 106.9173 60.7699 71.1306 174.5176 168 G 3.8428 8.7799 109.8274 45.3218 0.0000 172.4759 169 I 4.7881 7.2925 119.9574 60.0826 38.5249 175.3981 170 V 4.4835 8.9066 126.4057 61.1490 34.5559 174.1579 171 S 5.3511 8.6145 121.1742 56.8330 65.3257 173.6219 172 T 4.1163 8.6422 114.2231 62.2120 69.4527 175.5069 173 G 3.7865 8.4921 109.3535 44.5081 0.0000 172.7711 174 L 4.2494 8.0765 120.5519 54.5068 42.2004 176.2279 175 V 4.1399 8.6153 128.3847 61.6611 32.6275 174.7260 176 R 4.2673 8.5944 129.3110 55.8723 30.2694 175.9829 177 N 4.4068 8.5069 123.4808 53.6963 39.1172 176.4360 178 G 3.8789 8.1588 106.4258 44.9952 0.0000 173.5247 179 D 4.9433 7.4685 117.8579 52.8966 39.6918 175.8846 180 W 3.2918 8.3259 116.5118 58.3889 26.0328 173.9570 181 T 5.0145 7.3765 105.8833 60.2908 72.2107 172.2382 182 F 5.2912 8.7468 121.0603 55.8999 43.3899 173.8615 183 Q 5.1357 8.6082 116.8506 55.9123 32.2731 173.2739 184 T 4.7783 8.8893 112.8758 61.5515 71.9026 171.7578 185 L 5.2206 8.7424 125.4682 52.8780 45.4673 175.7887 186 V 4.6460 8.8565 122.7764 61.5897 34.2996 173.9295 187 M 5.1455 9.5310 128.2427 53.4830 35.0849 174.6974 188 L 4.7031 8.2735 124.5177 53.0020 44.7507 174.6259 189 E 4.6705 8.4901 127.9506 55.7748 30.2597 175.3824 190 T 4.5186 8.7132 122.7953 62.6524 73.9044 173.4652 191 V 4.5785 8.1553 123.6760 60.0074 31.0079 172.4250 192 P 4.5293 0.0000 0.0000 62.4142 32.0578 176.0934 193 Q 4.5532 9.0959 122.6299 53.9263 29.8029 175.0311 194 S 4.1786 8.5558 116.9139 59.3547 63.1568 174.4045 195 G 4.0680 8.9497 112.4131 45.6765 0.0000 173.7263 196 E 4.3450 7.9130 119.4442 55.6104 30.4438 175.8083 197 V 4.5841 9.3240 123.3562 61.4224 34.0827 173.7037 198 Y 5.4826 9.6271 126.0360 56.9276 40.5756 174.8606 199 T 5.2812 9.5211 119.6975 62.0561 72.6947 171.9014 200 C 4.3108 9.1859 127.0672 54.8550 42.6829 171.8125 201 Q 5.1706 9.1251 127.8335 54.2167 31.5468 173.9938 202 V 4.8342 9.0741 126.4720 61.1037 34.3305 173.7644 203 E 5.0042 8.9449 127.6122 54.9607 32.2844 174.5392 204 H 4.8215 8.5198 121.4283 54.4893 32.8316 172.4286 205 P 4.1942 0.0000 0.0000 65.7450 31.6042 177.6566 206 S 4.4171 8.1404 110.8053 59.2261 63.5361 173.2434 207 L 5.0126 7.8389 122.3546 53.1350 43.5992 176.7705 208 T 4.1550 8.5351 113.0266 63.5944 69.4311 174.5849 209 D 4.9540 7.6175 119.3902 51.1127 44.5286 173.4007 210 P 4.4673 0.0000 0.0000 63.3456 32.2741 175.6741 211 V 4.4074 8.8280 123.6698 61.6500 33.2853 174.7329 212 T 5.1957 8.4080 116.8191 59.9635 72.0220 173.3595 213 V 4.4533 8.5165 122.6912 61.6005 34.8142 174.2796 214 E 5.3266 8.9533 126.8641 55.1643 32.2425 175.8211 215 W 4.7281 9.3834 130.7847 58.0543 31.2995 174.2614 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 8.38 5.02 0.00 3.44 2.87 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 34 F 8.76 4.55 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 9.30 4.87 0.00 2.07 1.82 1.01 0.87 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 5.19 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 9.29 5.36 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 8.91 5.03 0.00 3.27 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 K 8.83 4.55 0.00 1.69 1.71 0.00 1.66 0.00 0.00 1.73 0.00 0.00 2.69 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.27 0.92 7.81 40 S 8.83 4.95 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 9.11 4.55 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 2.42 0.00 42 C 8.83 4.98 0.00 2.96 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 43 H 8.78 4.70 0.00 3.01 2.78 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 8.44 5.07 0.00 2.86 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 45 Y 8.31 4.51 0.00 2.84 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 46 N 9.65 4.27 0.00 2.97 2.88 0.00 0.00 6.99 7.75 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 47 G 7.82 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 48 T 8.04 4.43 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 0.82 0.00 0.00 49 Q 7.88 3.98 0.00 2.14 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.32 0.00 50 R 7.86 4.55 0.00 1.99 1.92 0.00 2.96 0.00 0.00 2.82 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.54 0.00 51 V 8.44 4.60 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 0.56 0.00 0.00 0.95 0.00 0.00 52 R 8.31 4.54 0.00 2.01 1.83 0.00 3.23 0.00 0.00 3.11 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.65 0.00 53 L 8.98 4.93 0.00 1.80 1.57 0.98 0.53 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 54 L 9.14 5.14 0.00 1.73 1.53 0.95 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 55 V 8.90 4.69 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.94 0.00 0.00 56 R 9.13 5.01 0.00 1.71 1.48 0.00 3.21 0.00 0.00 3.41 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 8.84 5.03 0.00 3.00 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 58 F 9.90 5.48 0.00 3.12 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 5.02 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 60 N 9.00 3.94 0.00 2.26 1.50 0.00 0.00 6.95 7.18 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 61 L 9.08 4.70 0.00 1.71 1.80 1.08 1.00 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 8.17 4.70 0.00 2.19 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 2.33 2.30 0.00 63 E 9.00 4.41 0.00 1.93 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 1.79 0.00 64 N 8.83 4.94 0.00 2.87 3.09 0.00 0.00 5.97 6.48 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 65 L 7.68 5.11 0.00 1.73 1.52 1.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 66 R 8.70 5.34 0.00 2.03 1.99 0.00 2.75 0.00 0.00 3.07 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 9.35 4.47 0.00 2.19 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 68 D 7.79 5.02 0.00 2.60 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 0.00 0.00 0.00 0.00 69 S 9.13 4.13 0.00 4.03 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 70 D 8.08 4.45 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 8.07 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 0.76 0.00 0.00 0.82 0.00 0.00 147 S 8.68 5.17 0.00 3.98 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 8.56 4.43 0.00 2.82 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 7.51 5.49 0.00 3.05 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 0.00 150 Y 8.72 5.14 0.00 3.37 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 0.00 151 P 0.00 3.12 0.00 1.79 1.59 0.00 3.87 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 152 G 8.13 2.74 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 0.00 0.00 0.00 0.00 0.00 0.00 153 N 7.77 4.39 0.00 2.77 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 4.64 1.59 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 1.08 0.61 0.67 0.00 0.00 155 E 9.08 4.70 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 2.16 2.32 0.00 156 V 8.35 4.67 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 9.12 4.72 0.00 1.78 1.47 0.00 3.29 0.00 0.00 3.38 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 8.40 5.35 0.00 3.23 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 9.80 5.42 0.00 3.09 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 0.00 160 R 9.30 4.40 0.00 1.90 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 1.14 0.00 161 N 10.10 4.20 0.00 2.80 2.82 0.00 0.00 7.31 7.29 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 0.00 162 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 1.87 1.79 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.39 7.81 164 E 8.95 3.59 0.00 1.55 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 2.06 1.82 0.00 165 E 8.70 4.21 0.00 2.01 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 2.50 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 1.33 7.81 167 T 7.78 4.45 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 8.78 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 I 7.29 4.79 1.87 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.92 0.96 0.00 0.00 170 V 8.91 4.48 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 0.92 0.00 0.00 0.89 0.00 0.00 171 S 8.61 5.35 0.00 3.88 3.67 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 0.00 172 T 8.64 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 8.49 3.79 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 0.00 0.00 0.00 174 L 8.08 4.25 0.00 1.62 1.62 0.81 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 175 V 8.62 4.14 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 0.86 0.00 0.00 1.01 0.00 0.00 176 R 8.59 4.27 0.00 1.91 1.76 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 1.09 0.00 177 N 8.51 4.41 0.00 2.86 2.76 0.00 0.00 7.24 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 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 2.79 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 8.33 3.29 0.00 3.30 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 T 7.38 5.01 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 1.24 0.00 0.00 182 F 8.75 5.29 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 8.61 5.14 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.69 0.00 0.00 0.00 0.00 0.00 2.24 2.35 0.00 184 T 8.89 4.78 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 185 L 8.74 5.22 0.00 1.63 1.52 1.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 186 V 8.86 4.65 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 1.19 0.00 0.00 0.93 0.00 0.00 187 M 9.53 5.15 0.00 1.82 1.86 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.39 0.00 188 L 8.27 4.70 0.00 0.27 0.13 0.70 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 189 E 8.49 4.67 0.00 1.91 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.18 0.00 190 T 8.71 4.52 3.92 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 1.34 0.00 0.00 191 V 8.16 4.58 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 0.85 0.00 0.00 0.92 0.00 0.00 192 P 0.00 4.53 0.00 2.31 2.44 0.00 3.78 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 2.07 2.03 0.00 193 Q 9.10 4.55 0.00 2.24 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.78 0.00 0.00 0.00 0.00 0.00 2.51 2.43 0.00 194 S 8.56 4.18 0.00 3.96 3.92 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 0.00 195 G 8.95 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 E 7.91 4.35 0.00 2.06 1.55 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 2.24 2.37 0.00 197 V 9.32 4.58 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 1.13 0.00 0.00 0.92 0.00 0.00 198 Y 9.63 5.48 0.00 3.42 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 T 9.52 5.28 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 1.27 0.00 0.00 200 C 9.19 4.31 0.00 1.66 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 9.13 5.17 0.00 2.14 2.10 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 9.07 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 0.75 0.00 0.00 0.76 0.00 0.00 203 E 8.94 5.00 0.00 1.86 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 4.82 0.00 3.00 3.00 0.00 5.69 0.00 0.00 0.00 0.00 6.77 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 4.19 0.00 1.97 2.07 0.00 3.02 0.00 0.00 3.48 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 4.42 0.00 4.12 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 0.00 207 L 7.84 5.01 0.00 1.71 1.75 0.90 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 0.00 208 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 7.62 4.95 0.00 2.62 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 P 0.00 4.47 0.00 1.90 1.97 0.00 3.64 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 8.83 4.41 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 8.41 5.20 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 1.15 0.00 0.00 213 V 8.52 4.45 2.06 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 1.05 0.00 0.00 0.92 0.00 0.00 214 E 8.95 5.33 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 9.38 4.73 0.00 3.56 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 * Residues marked with a * may have inaccurate shift predictions.