NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 39 S 5.3127 8.4181 116.4939 58.6479 64.8609 175.7981 40 T 3.8361 8.0908 110.3844 64.3177 68.8101 174.4525 41 D 4.4732 7.9986 120.3145 55.5468 41.2287 179.7306 42 E 4.3383 7.7657 116.5507 55.7799 30.5589 175.3695 43 T 4.8176 7.9725 109.8556 59.0129 70.5802 172.8961 44 P 4.2618 0.0000 0.0000 62.0725 32.0323 176.0439 45 A 3.9834 8.2774 125.1171 52.3838 18.8350 176.8969 46 S 4.4041 7.8386 115.4283 57.7266 65.4210 173.2555 47 Y 4.7449 8.1701 120.5301 57.7303 38.5225 177.4957 48 N 4.3552 8.4589 122.2597 56.4797 38.8502 176.3451 49 L 3.9118 8.0709 121.3182 58.4118 42.2200 178.8711 50 A 4.0536 7.9369 119.9376 54.9516 18.1938 179.8347 51 V 3.5584 7.6428 116.4820 66.3252 31.5172 178.3917 52 R 3.9839 8.1128 116.9702 59.2751 29.9448 178.9363 53 R 4.1137 7.8538 116.3176 57.9240 30.4146 177.6961 54 A 4.5307 7.8012 119.0107 53.3061 20.7632 178.2596 55 A 3.9710 8.3523 119.5887 54.9944 18.1719 178.0095 56 P 4.2338 0.0000 0.0000 65.3649 31.6217 177.8332 57 A 4.4000 8.1092 118.4016 52.2531 18.9026 176.7377 58 V 4.3672 7.0889 117.7278 62.3358 32.7377 175.6805 59 V 4.6397 8.6755 119.8771 59.4321 36.3459 174.5886 60 N 4.9302 8.7043 119.0222 52.9481 40.4148 174.8187 61 V 4.6880 7.8958 119.8250 61.5781 35.0648 173.9338 62 Y 5.3855 9.3115 124.4752 56.2623 42.4971 173.6761 63 N 6.0294 9.1392 118.6197 51.1684 42.3269 173.1495 64 R 4.7049 8.3277 123.7035 54.5376 32.8220 174.5003 *76 I 4.1647 8.5411 128.8679 62.1145 38.2143 175.8074 77 R 4.7506 8.7123 127.6894 55.2122 32.6027 171.7168 78 T 4.7141 8.4926 116.4436 61.5884 67.5505 174.4216 79 L 4.2923 8.8677 130.0112 55.5822 43.1367 177.5610 80 G 3.9900 6.6621 107.4365 46.5802 0.0000 170.7578 81 S 5.0221 7.8260 120.4232 57.1704 66.2830 173.1444 82 G 4.1309 8.2283 106.0717 45.8958 0.0000 172.5492 83 V 4.8986 8.5237 119.4012 60.9277 35.0809 174.3526 84 I 4.4609 8.7070 129.1261 61.6074 37.5375 176.3614 85 M 4.4514 8.8727 126.9651 56.6172 33.6616 175.9046 86 D 4.7350 7.7088 115.6733 51.8919 42.3428 176.0710 87 Q 4.0546 8.5843 118.6137 58.8350 28.8660 178.4629 88 R 3.8817 7.9444 116.2158 57.9055 30.4094 177.2652 89 G 3.9922 8.1819 106.2651 46.3728 0.0000 172.3046 90 Y 5.1268 8.5887 117.1858 56.8197 40.0415 175.0262 91 I 5.1175 8.8865 122.9248 59.8848 41.7781 174.2385 92 I 4.7505 8.5547 127.7762 60.6690 39.0228 174.8730 93 T 4.9828 8.9399 120.1876 60.5739 71.9334 172.4078 94 N 5.5126 8.4619 120.0827 52.0665 39.3626 176.6272 95 K 3.9531 8.6214 123.1823 59.7040 32.5431 178.7081 96 H 4.2747 8.2938 113.5729 58.0718 28.7872 176.9265 97 V 3.6403 7.2460 119.7308 65.1651 31.3314 176.5282 98 I 4.3398 7.1705 110.2032 60.3855 37.7860 175.7315 99 N 4.4243 8.2733 121.0426 56.6453 39.1254 174.7208 100 D 4.7809 7.7905 115.2265 52.0473 41.1323 173.6631 101 A 4.8856 7.6737 121.1897 50.1069 21.1507 176.5707 102 D 4.5278 9.1860 124.1313 57.3180 41.4255 176.9722 103 Q 4.6430 7.9363 118.4233 54.4403 33.0962 173.0938 104 I 5.0631 8.4217 125.2312 59.6750 40.1076 174.4912 105 I 5.0800 8.6959 126.9378 59.4800 41.0474 174.6409 106 V 4.9781 8.9353 124.5847 61.0727 35.0611 174.0983 107 A 5.1268 8.6524 128.0154 50.1837 21.6418 176.0190 108 L 4.5559 8.7698 122.7105 54.6211 42.6241 178.5687 109 Q 4.0836 8.5165 118.8227 58.4262 28.8048 177.1044 110 D 4.5566 7.9479 115.3973 53.1832 39.9419 176.9097 111 G 4.0699 7.7689 108.1249 45.3918 0.0000 174.5227 112 R 4.1539 8.4358 119.3249 55.9714 31.7149 176.1207 113 V 4.7005 7.6267 120.7776 61.6643 34.1725 174.3390 114 F 4.9274 9.1661 126.3437 55.7237 42.5144 174.0818 115 E 5.0783 8.8349 120.5911 55.0003 30.9662 174.7816 116 A 5.1171 8.8220 127.1701 50.1432 22.1232 175.4502 117 L 4.7427 8.5016 120.0660 52.5427 45.0199 175.8238 118 L 4.3629 8.4894 125.2833 55.0767 41.8853 176.6317 119 V 3.7648 9.1667 128.4528 64.3917 32.3144 176.0394 120 G 4.1765 7.4570 105.4775 46.8892 0.0000 170.9278 121 S 5.1630 8.2299 112.6936 57.1855 66.0899 173.2987 122 D 4.8894 8.5755 120.6917 52.3724 43.1582 177.1619 123 S 4.1591 8.7562 123.1594 61.5579 63.2871 176.3488 124 L 3.9877 8.1836 121.1935 57.7654 41.8624 177.4045 125 T 4.3165 8.1004 105.5602 60.5350 69.6853 173.5558 126 D 4.3430 7.6690 121.0129 55.8516 40.4193 172.2956 127 L 5.3094 7.4456 115.3525 53.1003 45.7203 176.3835 128 A 4.9812 8.8673 121.7790 50.9488 23.1560 175.3116 129 V 4.7974 8.6854 122.6301 61.2408 33.7705 174.7872 130 L 5.3478 9.3096 127.3555 52.8737 45.6359 175.1544 131 K 5.0267 8.8466 121.2351 54.7616 35.4360 175.0469 132 I 4.9181 8.2774 118.9351 58.9236 41.6042 174.2065 133 N 4.3768 8.6913 121.2200 53.0294 38.7754 174.8130 134 A 4.0568 8.3919 126.8733 51.6634 18.9410 178.0402 135 T 3.8685 8.6262 120.9137 66.1305 68.7169 174.5531 136 G 4.0004 7.7915 110.6684 48.3385 0.0000 172.7001 137 G 3.7991 8.7248 114.7402 45.4145 0.0000 170.0668 138 L 4.6777 7.9927 122.0810 52.3329 44.0603 174.8836 139 P 4.4846 0.0000 0.0000 62.5716 32.0724 175.5057 140 T 4.8113 8.0894 112.8224 59.2664 71.6326 173.6152 141 I 3.8413 8.4914 124.9197 60.3382 38.7087 173.9829 142 P 4.3805 0.0000 0.0000 63.0276 32.2728 175.4974 143 I 4.5052 8.2708 124.0984 59.2685 40.5044 174.5014 144 N 4.7413 8.0743 121.8423 51.5212 40.1045 174.5869 145 A 4.4202 8.6363 129.3807 54.6092 18.8385 178.3579 146 R 4.2119 8.1096 113.9829 57.7446 30.6248 177.1257 147 R 3.9523 7.7337 119.3106 55.9152 30.4463 175.6232 148 V 4.2198 8.1232 125.0792 60.2743 32.1454 173.4684 149 P 4.3672 0.0000 0.0000 62.9063 32.0097 175.7216 150 H 5.0841 8.6851 119.5159 53.4511 31.5639 173.7122 151 I 4.0518 8.2124 123.4580 62.9133 37.1790 176.6176 152 G 4.0542 8.8750 114.0651 44.8894 0.0000 173.5350 153 D 4.4760 7.9806 120.8201 54.3446 42.0561 176.2613 154 V 4.0743 8.4130 123.3119 63.1827 32.9800 175.0457 155 V 4.8479 8.6502 119.8314 59.6714 36.3250 174.0635 156 L 5.0577 9.2372 124.5230 53.0236 44.2053 175.3008 157 A 4.8470 8.8646 126.4183 50.8819 20.4820 175.8378 158 I 4.5857 8.8851 124.8514 60.0359 39.3422 175.5588 159 G 4.3144 9.0114 113.6361 44.3377 0.0000 170.8341 160 N 5.5943 8.5273 118.7113 51.0019 38.3171 172.1232 161 P 4.7588 0.0000 0.0000 60.5790 30.7967 175.4951 162 A 4.7959 8.2843 129.3596 50.8230 22.6846 176.8683 *165 G 3.8353 8.1556 106.9430 45.6298 0.0000 171.0719 166 Q 4.6200 8.5918 121.3709 55.1753 30.5653 176.3542 167 T 4.7120 8.6637 123.0235 61.8630 71.1742 173.3838 168 I 5.2459 8.4094 126.2790 59.6820 40.4379 174.7960 169 T 4.7818 8.7424 115.9229 59.8339 72.3650 172.4339 170 Q 4.8535 8.3748 122.6587 54.8990 32.0448 175.2772 171 G 4.1515 8.3510 110.9116 46.0277 0.0000 171.2480 172 I 5.3063 8.6889 114.3943 59.1846 42.3241 174.7414 173 I 4.2823 8.5008 123.2716 61.2433 37.0120 177.5865 174 S 4.1900 8.8496 124.5349 61.0068 63.4332 175.2351 175 A 4.6485 7.6132 120.5650 50.1928 22.2201 175.2276 176 T 4.2204 8.7354 118.0764 61.5439 68.1891 174.4562 177 G 4.2384 8.6811 116.9950 45.6701 0.0000 171.7831 *188 N 3.9913 8.1853 117.1371 53.1811 39.8906 173.3862 189 F 5.1423 7.7713 120.2266 56.2807 42.0064 174.1858 190 L 4.9918 8.9027 121.9381 54.8243 43.2638 175.4710 191 Q 4.7696 9.0039 125.1846 54.7884 31.5102 174.4822 192 T 5.3174 8.3893 115.2750 61.1036 71.1673 173.4911 193 D 4.7594 8.6618 124.7965 53.2732 40.4213 176.3248 194 A 4.1078 7.7745 122.4591 52.1108 19.0447 177.9634 195 S 4.1349 7.9388 118.6583 58.9946 63.5416 174.2236 196 I 4.5782 8.4699 125.6005 59.4822 38.9825 174.3701 197 N 5.1580 9.1118 122.3099 49.9554 40.6565 173.7168 198 P 4.2524 0.0000 0.0000 65.8759 31.5553 179.0639 199 G 3.6576 7.7538 105.4838 47.7417 0.0000 173.7299 200 N 4.9021 8.7361 115.2065 52.0066 38.0443 173.7216 201 S 4.3128 7.7409 115.8018 60.0176 62.5876 174.9114 202 G 3.9257 8.9826 117.4910 45.1706 0.0000 173.6650 203 G 3.8458 7.7947 108.4129 44.8055 0.0000 172.1724 204 A 5.1017 7.9237 119.9678 50.3707 21.6769 176.2637 205 L 5.1379 8.7456 122.1626 53.4286 44.7202 175.9017 206 V 5.0008 8.6663 118.4305 59.6622 36.4710 175.1773 207 N 5.2247 8.6719 119.9986 50.8941 38.8842 176.1390 208 S 4.0309 8.4310 111.9065 61.0292 63.1597 175.5756 209 L 4.0605 7.5030 120.9084 57.0026 41.4679 177.7547 210 G 4.0618 8.5056 104.2468 45.1351 0.0000 173.7469 211 E 4.0818 8.2574 120.7598 55.4279 30.1158 176.0055 212 L 4.3000 8.2092 126.2707 55.8307 42.7954 176.0596 213 M 4.4982 9.4101 126.3264 57.0308 34.3153 175.9214 214 G 4.9031 7.7001 103.0482 46.8269 0.0000 172.0461 215 I 4.8822 8.0141 120.4667 59.1793 39.1422 175.5151 216 N 4.7912 8.8216 125.5428 54.1525 39.4264 174.2254 217 T 4.9726 8.9163 116.7671 60.5911 71.2073 172.6722 218 L 4.6796 8.3836 124.6103 54.0169 43.9629 175.3674 219 S 3.4947 8.5526 121.4445 58.7014 58.9779 171.5453 *231 G 3.9158 8.1180 110.9545 44.4306 0.0000 170.1714 232 I 4.4810 7.7354 120.4000 59.4733 39.4756 175.4987 233 G 4.2223 8.8554 113.8365 44.7316 0.0000 172.1037 234 F 5.5075 8.6644 117.0695 55.4949 43.0488 174.2635 235 A 5.1629 9.0917 123.3096 50.2168 23.1714 174.9012 236 I 4.2323 8.3141 121.5652 59.5184 38.7512 173.9541 237 P 4.8468 0.0000 0.0000 63.0386 31.9028 177.6589 238 F 4.2678 9.3179 119.3093 59.9266 37.7981 178.1165 239 Q 3.5712 6.7847 118.2812 58.6605 28.4689 178.2099 240 L 3.9080 7.6662 120.6016 57.9916 42.1879 178.6109 241 A 3.9531 8.1164 120.7999 55.3073 18.2982 179.5514 242 T 3.8110 8.0484 114.2832 66.8546 68.6153 176.8461 243 K 3.9314 7.8042 119.5341 59.6482 32.2065 179.5093 244 I 3.6997 8.0173 120.3334 64.3764 36.9606 178.1622 245 M 3.9142 8.1356 119.0286 58.7012 32.1020 177.7422 246 D 4.2581 8.0240 118.8932 57.6420 41.1638 179.3495 247 K 4.0163 8.0628 118.2875 59.1194 31.8291 179.2110 248 L 4.9146 7.6046 120.3899 56.6422 41.4353 179.2471 249 I 3.6684 7.4585 119.4273 63.8324 37.0016 178.1541 250 R 4.0277 7.7213 118.8127 59.3076 30.2023 177.5292 251 D 4.6020 7.5202 116.1976 57.7776 42.2210 175.3855 252 G 3.8414 8.2500 106.5597 44.4535 0.0000 174.6540 253 R 4.2009 8.6241 118.2441 56.7379 29.3047 172.6944 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 39 S 8.42 5.31 0.00 3.67 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 40 T 8.09 3.84 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 41 D 8.00 4.47 0.00 2.72 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 E 7.77 4.34 0.00 2.19 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 2.40 2.23 0.00 43 T 7.97 4.82 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 1.19 0.00 0.00 44 P 0.00 4.26 0.00 2.03 2.00 0.00 3.66 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 2.01 2.06 0.00 45 A 8.28 3.98 1.13 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 46 S 7.84 4.40 0.00 3.72 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 47 Y 8.17 4.74 0.00 3.13 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 48 N 8.46 4.36 0.00 2.75 2.81 0.00 0.00 6.85 7.33 0.00 0.00 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 L 8.07 3.91 0.00 1.79 1.69 0.92 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 50 A 7.94 4.05 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 51 V 7.64 3.56 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 1.13 0.00 0.00 1.02 0.00 0.00 52 R 8.11 3.98 0.00 1.95 1.98 0.00 3.22 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.99 0.00 53 R 7.85 4.11 0.00 1.79 1.97 0.00 3.33 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.00 54 A 7.80 4.53 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.35 3.97 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 P 0.00 4.23 0.00 2.03 2.15 0.00 3.63 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.17 0.00 57 A 8.11 4.40 1.37 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 0.00 0.00 58 V 7.09 4.37 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 0.86 0.00 0.00 0.98 0.00 0.00 59 V 8.68 4.64 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.92 0.00 0.00 60 N 8.70 4.93 0.00 2.77 2.01 0.00 0.00 6.96 7.14 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 61 V 7.90 4.69 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 0.92 0.00 0.00 0.85 0.00 0.00 62 Y 9.31 5.39 0.00 2.95 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 63 N 9.14 6.03 0.00 2.85 2.67 0.00 0.00 6.53 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 R 8.33 4.70 0.00 1.83 1.92 0.00 3.47 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.61 0.00 *76 I 8.54 4.16 1.79 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.62 0.73 0.00 0.00 77 R 8.71 4.75 0.00 1.49 1.77 0.00 3.25 0.00 0.00 3.09 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.41 0.00 78 T 8.49 4.71 4.49 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 1.28 0.00 0.00 79 L 8.87 4.29 0.00 1.79 1.80 1.01 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 80 G 6.66 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 81 S 7.83 5.02 0.00 3.76 3.75 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 82 G 8.23 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 83 V 8.52 4.90 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 0.96 0.00 0.00 0.97 0.00 0.00 84 I 8.71 4.46 1.98 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.72 0.90 0.00 0.00 85 M 8.87 4.45 0.00 1.92 2.16 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.79 0.00 86 D 7.71 4.73 0.00 2.86 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 87 Q 8.58 4.05 0.00 2.06 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.24 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 88 R 7.94 3.88 0.00 2.05 1.94 0.00 3.32 0.00 0.00 3.32 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 89 G 8.18 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 90 Y 8.59 5.13 0.00 3.27 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 I 8.89 5.12 1.87 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.96 0.95 0.00 0.00 92 I 8.55 4.75 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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2.19 1.93 0.00 3.55 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.14 0.00 143 I 8.27 4.51 1.85 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 1.24 0.82 0.90 0.00 0.00 144 N 8.07 4.74 0.00 2.58 2.52 0.00 0.00 7.10 8.30 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 0.00 145 A 8.64 4.42 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 0.00 146 R 8.11 4.21 0.00 1.99 2.02 0.00 3.35 0.00 0.00 3.18 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 147 R 7.73 3.95 0.00 1.69 1.95 0.00 3.28 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.62 0.00 148 V 8.12 4.22 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 1.00 0.00 0.00 149 P 0.00 4.37 0.00 2.12 2.05 0.00 3.71 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.37 0.00 150 H 8.69 5.08 0.00 3.41 3.15 0.00 5.64 0.00 0.00 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0.00 0.00 169 T 8.74 4.78 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 170 Q 8.37 4.85 0.00 1.98 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.55 0.00 0.00 0.00 0.00 0.00 1.97 2.01 0.00 171 G 8.35 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 I 8.69 5.31 1.90 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.70 0.88 0.00 0.00 173 I 8.50 4.28 2.01 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.69 0.91 0.00 0.00 174 S 8.85 4.19 0.00 3.67 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 0.00 175 A 7.61 4.65 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 0.00 176 T 8.74 4.22 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 177 G 8.68 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 0.00 0.00 0.00 0.00 *188 N 8.19 3.99 0.00 2.60 2.74 0.00 0.00 7.01 7.03 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 0.00 189 F 7.77 5.14 0.00 3.32 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 0.00 190 L 8.90 4.99 0.00 1.81 1.80 0.98 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 191 Q 9.00 4.77 0.00 1.97 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.58 0.00 0.00 0.00 0.00 0.00 1.63 2.19 0.00 192 T 8.39 5.32 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 1.15 0.00 0.00 193 D 8.66 4.76 0.00 2.68 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 0.00 194 A 7.77 4.11 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 0.00 195 S 7.94 4.13 0.00 3.79 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 0.00 196 I 8.47 4.58 1.91 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 1.66 0.90 1.04 0.00 0.00 197 N 9.11 5.16 0.00 2.88 2.88 0.00 0.00 6.55 8.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 4.25 0.00 2.21 2.19 0.00 3.61 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.14 0.00 199 G 7.75 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 0.00 0.00 0.00 200 N 8.74 4.90 0.00 2.85 2.98 0.00 0.00 6.68 7.40 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 0.00 201 S 7.74 4.31 0.00 4.01 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 G 8.98 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 0.00 0.00 0.00 203 G 7.79 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 0.00 204 A 7.92 5.10 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 0.00 205 L 8.75 5.14 0.00 1.97 1.68 0.92 1.11 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 0.00 206 V 8.67 5.00 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 0.73 0.00 0.00 0.95 0.00 0.00 207 N 8.67 5.22 0.00 2.96 2.94 0.00 0.00 6.59 7.39 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 0.00 208 S 8.43 4.03 0.00 4.20 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 0.00 209 L 7.50 4.06 0.00 1.84 1.75 1.03 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 210 G 8.51 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 0.00 211 E 8.26 4.08 0.00 1.91 1.67 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 2.31 2.23 0.00 212 L 8.21 4.30 0.00 1.57 1.36 1.03 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 213 M 9.41 4.50 0.00 1.97 2.17 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.72 0.00 214 G 7.70 4.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 I 8.01 4.88 1.82 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 1.35 0.99 0.88 0.00 0.00 216 N 8.82 4.79 0.00 2.80 2.75 0.00 0.00 6.12 6.79 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 0.00 217 T 8.92 4.97 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 218 L 8.38 4.68 0.00 1.59 1.52 0.96 0.95 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 0.00 219 S 8.55 3.49 0.00 3.98 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *231 G 8.12 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 0.00 0.00 0.00 232 I 7.74 4.48 1.80 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.89 0.46 0.00 0.00 233 G 8.86 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 0.00 0.00 0.00 234 F 8.66 5.51 0.00 3.06 3.03 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 0.00 0.00 0.00 0.00 235 A 9.09 5.16 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 0.00 236 I 8.31 4.23 1.73 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 -0.13 0.82 0.00 0.00 237 P 0.00 4.85 0.00 2.01 1.95 0.00 3.67 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.18 0.00 238 F 9.32 4.27 0.00 3.30 3.31 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 0.00 239 Q 6.78 3.57 0.00 1.71 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.85 0.00 0.00 0.00 0.00 0.00 1.16 1.92 0.00 240 L 7.67 3.91 0.00 1.72 1.80 0.93 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 241 A 8.12 3.95 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 0.00 242 T 8.05 3.81 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 1.22 0.00 0.00 243 K 7.80 3.93 0.00 1.95 1.83 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.56 7.81 244 I 8.02 3.70 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.20 0.89 0.00 0.00 245 M 8.14 3.91 0.00 2.17 2.08 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 2.50 2.39 0.00 246 D 8.02 4.26 0.00 2.85 2.66 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 0.00 247 K 8.06 4.02 0.00 1.78 1.84 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.57 7.81 248 L 7.60 4.91 0.00 1.84 1.67 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 249 I 7.46 3.67 1.82 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.19 0.72 0.00 0.00 250 R 7.72 4.03 0.00 1.79 1.91 0.00 3.23 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 251 D 7.52 4.60 0.00 2.77 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 0.00 252 G 8.25 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 0.00 253 R 8.62 4.20 0.00 1.84 1.73 0.00 3.30 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.21 0.00 * Residues marked with a * may have inaccurate shift predictions.