NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 33 L 4.2641 8.1731 122.4910 54.9263 43.1118 176.6171 34 G 3.5977 7.5013 109.9037 44.2389 0.0000 169.9626 35 S 4.6670 8.9599 118.0528 56.8542 65.9169 171.6447 36 T 4.4146 7.8453 118.5582 63.8361 69.6309 173.6088 37 A 5.0419 8.8447 126.4970 50.8051 23.2972 175.1259 38 I 5.0719 9.5605 123.1173 59.4067 41.3968 174.7918 39 G 4.9813 9.1481 113.3417 45.3434 0.0000 171.7031 40 I 5.0958 8.1933 122.9689 59.3147 40.8665 174.5628 41 A 4.8587 8.7867 130.0369 51.8766 19.6746 176.5517 42 T 4.7238 7.9342 108.9174 60.5025 71.8184 173.7180 43 K 4.4220 8.5396 119.0137 57.5062 33.6806 176.1884 44 E 4.3800 8.5258 117.1780 54.5170 29.0391 176.0960 45 G 4.2609 5.3800 107.2460 44.5755 0.0000 171.6122 46 V 4.4632 8.3895 121.3261 61.1806 34.3119 174.5600 47 V 4.7955 8.5355 125.9999 61.1931 34.1701 173.9409 48 L 5.1863 8.7770 128.4594 53.1470 43.8909 175.9823 49 G 4.4511 9.2628 110.2353 44.7332 0.0000 171.7285 50 V 4.9690 8.7397 114.7890 59.3095 37.0462 174.1374 51 E 4.5872 8.4417 123.2947 55.4178 29.0655 175.9828 52 K 4.0378 9.1149 130.5269 58.7403 32.8304 177.1606 53 R 3.6769 7.7693 121.1820 56.0638 30.1962 176.9445 *65 E 4.0625 7.8859 117.4373 56.3512 29.8490 174.3990 66 K 4.6544 8.4187 123.8695 55.7569 34.8155 175.6171 67 I 5.1380 7.8418 121.1295 59.3358 39.9687 175.2440 68 V 4.5729 8.7171 125.9602 59.7523 35.2526 174.3872 69 E 3.9199 8.6174 123.2664 55.4710 30.6428 176.8092 70 I 3.8496 7.8494 126.7848 63.0759 38.2567 174.9135 71 D 4.6267 7.1746 116.9973 52.8488 44.0319 175.3570 72 R 4.8293 10.0015 121.3150 58.3885 30.1911 177.1530 73 H 5.0585 8.2096 112.1778 54.7148 29.0481 173.8039 74 I 4.4450 7.9069 120.3898 61.5370 41.5957 174.2106 75 G 3.5103 8.4948 115.9459 44.6292 0.0000 170.9922 76 C 5.3523 8.3556 112.1586 57.0173 33.2030 172.9902 77 A 5.4170 8.9951 122.3112 50.4487 21.7903 175.1069 78 M 5.1363 8.6929 117.1711 53.5945 34.5387 175.6762 79 S 4.2280 8.3611 114.0236 61.3054 63.5946 176.1507 *82 T 4.2391 7.7151 113.0170 63.0191 69.5367 174.0212 83 A 4.6723 7.8279 121.7644 51.6589 20.4926 177.6213 84 D 4.5198 8.1411 114.0362 55.4615 41.4694 177.8286 85 A 4.1811 7.8807 121.6450 54.7105 18.5633 179.2562 86 R 3.8336 8.1481 116.2550 59.9921 30.0500 179.0750 87 S 4.1781 7.9632 114.1236 61.5712 62.8960 176.4635 88 M 4.0394 7.8065 120.9295 58.3575 31.7679 178.4629 89 I 3.6399 7.9569 120.2838 64.5445 37.2533 178.0574 90 E 3.8933 8.4891 120.2785 59.5353 29.3429 178.0963 91 H 4.0053 8.6276 118.0133 59.8717 30.0016 177.1981 92 A 3.7639 8.3554 121.6483 55.1426 18.4453 179.4550 93 R 3.8354 8.5082 115.7070 59.6907 30.2608 179.4367 94 T 3.8348 8.1136 115.2018 66.5999 68.3773 176.4939 95 A 3.9039 8.1736 122.5652 55.0110 18.3914 179.2598 96 A 3.9502 8.4002 119.6535 55.6018 18.4864 180.0904 97 V 3.5604 8.2979 116.7781 66.2886 31.5199 178.2552 98 T 3.9774 8.2311 115.7605 67.0293 68.3351 175.8517 99 H 4.2754 8.4989 120.1055 59.3999 29.8099 176.6805 100 N 4.6155 8.4135 120.0488 56.1110 38.6340 176.2131 101 L 3.8236 8.0645 120.6196 58.7592 42.2164 178.5721 102 Y 3.7685 8.1483 114.5866 59.9578 37.8262 176.7376 103 Y 4.5523 7.7421 115.1917 56.1637 40.1429 174.7874 104 D 4.4370 8.8685 118.9396 54.2741 40.1682 172.2045 105 E 4.7372 7.6097 113.4823 54.7635 33.0127 174.1394 106 D 4.3215 8.3011 119.2852 54.1389 41.4113 176.4239 107 I 3.8162 8.0059 122.2359 60.0212 38.9707 175.4528 108 N 4.3745 8.5586 124.1240 54.1761 39.5504 175.7594 109 V 3.5433 8.4952 128.1923 65.9317 31.4282 177.6705 110 E 3.3423 8.1939 118.7233 58.9725 29.5972 178.1835 111 S 3.9307 8.0645 113.2136 61.4025 62.3576 175.8806 112 L 3.7868 8.0366 123.1518 58.5864 41.6678 179.1280 113 T 3.5913 7.2967 115.2664 65.7228 68.0979 176.8570 114 Q 3.5161 7.5695 122.1907 59.1225 28.6781 177.8995 115 S 4.0410 8.0104 114.3777 61.5693 62.4677 176.2274 116 V 3.4205 7.5045 119.9207 65.4060 31.2116 177.8255 117 C 4.1907 7.5804 116.8849 62.3910 28.1746 175.0153 118 D 4.3579 8.3837 120.1802 57.4396 40.4260 178.3644 119 L 3.8511 7.1557 118.9421 58.2003 42.4800 178.5880 120 A 4.1628 7.5822 119.5806 55.1224 18.0848 179.3508 121 L 4.1465 8.0789 117.0643 56.9962 42.8984 178.9829 122 R 4.4305 7.4810 118.6306 52.9408 28.4269 175.3772 123 F 4.9236 8.1662 115.6695 56.3680 38.8478 176.5629 *140 V 4.0337 8.3431 122.2032 61.1728 33.4083 175.4538 141 A 4.8281 7.6844 122.4303 50.2599 20.6010 176.0860 142 L 5.0017 9.6155 123.3533 52.9136 45.8830 176.0020 143 L 5.0462 8.9227 123.3072 53.3037 43.1918 174.8906 144 I 4.6992 8.3538 125.3437 60.0349 39.1830 174.9615 145 A 5.1489 8.8933 128.0096 50.3092 22.1104 175.1762 146 G 4.4231 8.9631 108.3953 45.6172 0.0000 170.8618 147 H 5.1209 8.5981 120.4237 54.2982 31.5812 173.0977 148 D 4.9627 8.1155 122.9970 51.7295 43.3367 175.7531 149 A 4.7024 8.5321 118.9580 52.3123 19.3846 176.8838 150 D 4.7767 9.3847 119.2816 56.7213 41.9538 178.3420 151 D 4.8316 7.9676 116.1318 54.2124 42.8416 177.7938 152 G 3.5556 8.1545 108.8213 46.1679 0.0000 173.0108 153 Y 4.5250 8.2304 120.3240 58.7213 38.5390 175.9012 154 Q 4.6528 8.7974 121.0095 54.6731 34.2120 173.3568 155 L 5.0814 7.9578 122.5293 53.6677 45.8213 174.9028 156 F 5.5867 9.5511 123.3228 56.0856 44.0630 172.9561 157 H 5.3416 9.8292 120.5553 54.4440 32.6385 172.2570 158 A 5.1388 9.4041 127.6980 50.2570 21.2687 175.3669 159 E 4.3889 8.9610 122.8172 55.0015 30.7761 176.2385 160 P 3.9990 0.0000 0.0000 65.6712 31.5765 178.0129 161 S 3.9552 8.0097 111.9094 59.7453 62.6298 175.4679 162 G 3.9324 8.9305 108.8805 44.8755 0.0000 173.0130 163 T 4.4181 7.8372 110.9902 60.7223 70.4289 173.9164 164 F 5.3445 8.0320 117.9888 55.4207 41.1711 173.4064 165 Y 4.9881 8.9330 117.1520 56.2519 42.3090 175.1615 166 R 4.4749 8.6842 120.5375 56.9592 31.2244 175.1647 167 Y 4.6194 8.1736 118.4081 57.5191 42.3925 174.0643 168 N 4.7670 8.5534 113.3377 52.7862 41.2507 174.4055 169 A 4.9062 7.3777 118.2716 50.7806 22.3333 175.5093 170 K 4.6052 8.8640 118.5954 56.2910 36.3292 173.9025 171 A 5.2240 8.6152 127.6923 50.1152 22.0668 175.1773 172 I 4.3821 8.7482 114.5003 60.1443 41.3396 175.2763 173 G 4.3263 9.0091 107.6076 45.8757 0.0000 173.7062 174 S 4.2263 8.7347 113.2542 60.8340 64.0418 175.7277 175 G 4.1044 7.8380 110.8040 44.8754 0.0000 174.8111 176 S 4.4870 7.7454 114.7045 59.1789 64.3075 175.2603 177 E 4.0671 8.1170 121.6423 59.3975 29.2564 178.4242 178 G 3.7965 8.2559 105.7528 48.0974 0.0000 175.0851 179 A 4.0065 8.3459 123.0703 54.4867 18.4316 179.4836 180 Q 4.0001 7.9515 117.9203 59.0889 29.0081 178.3081 181 A 3.9507 7.6448 120.5353 55.2324 18.1803 178.9400 182 E 3.8917 7.7232 117.1999 59.4769 29.6060 179.1290 183 L 4.0043 8.3908 119.1624 57.7776 41.5379 179.0098 184 L 4.0839 7.8960 119.0812 58.0102 42.0051 178.0131 185 N 4.9459 7.7853 113.7882 52.9237 37.8816 175.2987 186 E 4.6307 7.6106 120.1781 56.2171 31.9940 176.2561 187 W 4.1664 8.3407 129.3565 57.2605 31.4589 174.6258 188 H 4.0742 6.6188 118.9109 54.2972 30.6157 172.7478 189 S 4.3288 7.7346 112.1498 58.6272 63.2752 175.0375 190 S 4.5191 7.5314 114.8078 58.4920 65.5316 174.4980 191 L 3.8040 7.1284 119.4680 55.0592 41.9508 177.7072 192 T 4.3655 8.8070 114.0951 60.3640 71.5656 175.9465 193 L 3.8950 9.4484 123.6590 58.2831 42.0710 178.9958 194 K 4.4292 7.9041 120.3417 58.8938 32.0479 178.3646 195 E 3.8966 8.4145 118.7966 59.3346 29.4077 178.8831 196 A 4.0401 8.0138 120.5757 55.4449 18.4302 179.0591 197 E 3.9469 8.7827 117.2171 60.0616 29.5623 179.9738 198 L 4.0186 8.0170 118.3910 57.5848 41.6885 179.2680 199 L 3.9302 8.5016 120.9035 58.1504 41.9659 179.1115 200 V 3.5613 8.1552 118.3782 66.1461 31.4527 177.6192 201 L 3.9564 7.8230 118.6077 57.8965 41.4961 179.4852 202 K 3.8973 8.2748 119.2371 59.7866 32.2072 178.7211 203 I 3.7820 7.7881 119.9229 64.5500 36.7863 178.4816 204 L 4.0053 7.9475 119.0070 57.4633 41.8415 179.2078 205 K 4.0597 8.2846 119.7031 59.5990 31.9990 178.3194 206 Q 3.9501 8.1203 118.8810 59.2085 28.9498 178.5609 207 V 4.1385 7.4926 110.0878 60.8628 32.9348 176.2246 208 M 4.1848 7.1987 118.5348 55.1016 32.4659 175.4458 209 E 3.9586 8.6873 125.3555 59.0790 29.9664 178.1936 210 E 4.4598 7.5269 115.7470 54.3414 32.1586 174.8167 211 K 4.0365 8.3448 120.1311 56.6289 32.7534 175.9103 212 L 4.5274 8.2459 122.9288 53.2026 42.2851 174.5165 213 D 5.0312 8.6896 125.3447 50.7929 42.3935 176.6608 214 E 4.1054 8.8260 114.9045 57.8899 29.1878 177.0912 215 N 4.8077 8.7329 117.4142 53.7254 40.1420 174.9758 216 N 5.1238 7.8145 109.8438 52.0520 39.1290 173.8605 217 A 5.2831 7.9531 119.9189 50.5587 22.8078 175.0149 218 Q 4.5758 9.3242 119.5536 54.7297 33.0521 173.6564 219 L 5.1900 8.3940 124.5980 53.4113 45.4115 175.1831 220 S 4.0797 8.2649 114.3377 57.7273 66.7187 172.8529 221 C 5.0983 7.9859 114.3645 57.2565 33.6340 172.3360 222 I 5.2009 8.7914 119.3854 59.5497 41.2084 174.1243 223 T 5.2332 8.5542 117.7297 59.6706 71.9460 174.5730 224 K 3.6481 9.2555 124.9010 59.2169 32.3330 177.3358 225 Q 4.3644 7.7207 116.6579 57.0207 29.9627 175.5950 226 D 4.7917 8.3740 115.4424 52.8111 41.5195 178.3397 227 G 3.7784 7.9564 108.6763 46.7141 0.0000 172.6938 228 F 4.6412 9.4274 123.7120 58.6072 40.7405 176.3528 229 K 4.4536 6.7334 120.3647 55.1484 37.0253 174.8046 230 I 4.4743 8.0003 124.5048 59.3894 39.3192 175.0551 231 Y 4.6259 8.4661 126.1942 57.8849 38.5126 175.9875 232 D 4.7002 8.7771 123.2019 52.4625 40.6900 176.8087 233 N 4.3195 8.7796 117.0966 56.5770 38.4456 176.9367 234 E 4.0734 7.8894 118.2885 58.3473 29.6363 178.5362 235 K 3.9961 8.0093 120.1212 59.6642 32.2611 178.9822 236 T 4.0151 7.8993 114.7346 66.2271 68.3937 176.7258 237 A 3.9956 8.0885 123.2477 55.1994 18.2766 179.1328 238 E 3.8742 8.1872 116.4775 59.8277 29.5052 179.3913 239 L 4.0050 7.8387 118.0606 58.1140 41.6327 179.8780 240 I 3.7144 7.8441 119.6420 64.1846 36.9834 178.4541 241 K 3.9602 7.9808 120.1678 59.4346 32.0155 178.5567 242 E 3.9746 8.8134 119.9408 58.8241 29.6158 178.3598 243 L 4.0279 8.3115 120.7619 57.2503 41.8544 178.8564 244 K 3.9070 7.4939 119.3437 59.5044 32.5405 178.2277 245 E 4.1015 8.2222 118.8186 59.4765 29.2454 179.5317 246 K 3.9500 8.0682 118.4798 58.8730 32.4123 176.8277 247 E 4.3815 8.0140 117.0464 55.9371 29.2817 175.6860 248 A 4.6317 7.6264 117.8333 51.7928 19.5133 178.1755 249 A 4.1441 8.1006 121.9899 55.7252 18.7092 178.2204 250 E 4.4126 7.8407 118.1873 57.2034 30.4942 175.4928 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 33 L 8.17 4.26 0.00 1.62 1.69 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 34 G 7.50 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 35 S 8.96 4.67 0.00 3.91 3.72 0.00 0.00 0.00 0.00 0.00 0.00 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 7.85 4.41 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 1.20 0.00 0.00 37 A 8.84 5.04 1.18 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 38 I 9.56 5.07 1.86 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 1.14 0.71 0.91 0.00 0.00 39 G 9.15 4.98 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 40 I 8.19 5.10 1.94 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.04 1.16 0.00 0.00 41 A 8.79 4.86 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 42 T 7.93 4.72 4.40 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 1.34 0.00 0.00 43 K 8.54 4.42 0.00 1.98 2.02 0.00 1.50 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.38 7.81 44 E 8.53 4.38 0.00 1.93 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 2.09 2.14 0.00 45 G 5.38 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 0.00 0.00 0.00 46 V 8.39 4.46 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 1.07 0.00 0.00 1.17 0.00 0.00 47 V 8.54 4.80 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 0.95 0.00 0.00 0.96 0.00 0.00 48 L 8.78 5.19 0.00 1.73 1.57 0.97 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 49 G 9.26 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 50 V 8.74 4.97 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 0.65 0.00 0.00 0.93 0.00 0.00 51 E 8.44 4.59 0.00 1.99 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.25 0.00 52 K 9.11 4.04 0.00 1.74 1.84 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.59 1.45 7.81 53 R 7.77 3.68 0.00 1.81 2.05 0.00 3.49 0.00 0.00 3.15 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.82 0.00 *65 E 7.89 4.06 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 2.20 2.36 0.00 66 K 8.42 4.65 0.00 1.71 1.77 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.53 1.43 7.81 67 I 7.84 5.14 1.95 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 1.44 0.64 1.16 0.00 0.00 68 V 8.72 4.57 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 0.71 0.00 0.00 0.88 0.00 0.00 69 E 8.62 3.92 0.00 1.86 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 2.29 2.37 0.00 70 I 7.85 3.85 1.84 0.00 0.00 0.72 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 0.48 0.83 0.00 0.00 71 D 7.17 4.63 0.00 2.63 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 R 10.00 4.83 0.00 1.88 1.99 0.00 3.22 0.00 0.00 3.36 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.60 0.00 73 H 8.21 5.06 0.00 3.52 3.57 0.00 5.55 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 I 7.91 4.44 1.68 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 -0.36 0.79 0.00 0.00 75 G 8.49 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 C 8.36 5.35 0.00 3.10 2.90 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 77 A 9.00 5.42 1.24 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 78 M 8.69 5.14 0.00 1.97 1.99 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 2.48 2.61 0.00 79 S 8.36 4.23 0.00 4.03 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 *82 T 7.72 4.24 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 83 A 7.83 4.67 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 84 D 8.14 4.52 0.00 2.66 2.73 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 1.04 0.00 0.00 1.05 0.00 0.00 110 E 8.19 3.34 0.00 2.24 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 0.00 2.42 2.85 0.00 111 S 8.06 3.93 0.00 3.85 3.78 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 0.00 112 L 8.04 3.79 0.00 1.56 1.63 0.77 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 113 T 7.30 3.59 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 0.58 0.00 0.00 114 Q 7.57 3.52 0.00 2.14 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 115 S 8.01 4.04 0.00 3.99 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 0.00 116 V 7.50 3.42 1.93 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 0.91 0.00 0.00 0.91 0.00 0.00 117 C 7.58 4.19 0.00 3.08 3.20 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 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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 0.00 151 D 7.97 4.83 0.00 2.79 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 0.00 152 G 8.15 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 0.00 0.00 0.00 153 Y 8.23 4.52 0.00 3.10 3.02 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 0.00 154 Q 8.80 4.65 0.00 2.01 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.77 0.00 0.00 0.00 0.00 0.00 2.22 2.54 0.00 155 L 7.96 5.08 0.00 1.70 1.58 1.00 0.84 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 0.00 156 F 9.55 5.59 0.00 2.97 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 0.00 157 H 9.83 5.34 0.00 3.07 3.39 0.00 5.54 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 0.00 158 A 9.40 5.14 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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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 0.00 0.00 0.00 176 S 7.75 4.49 0.00 4.11 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 0.00 177 E 8.12 4.07 0.00 2.21 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 178 G 8.26 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 0.00 0.00 0.00 179 A 8.35 4.01 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 0.00 180 Q 7.95 4.00 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 181 A 7.64 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 0.00 182 E 7.72 3.89 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 2.33 2.62 0.00 183 L 8.39 4.00 0.00 1.92 1.75 0.93 0.50 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 0.00 184 L 7.90 4.08 0.00 1.96 1.92 0.96 1.18 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 0.00 185 N 7.79 4.95 0.00 2.96 2.91 0.00 0.00 6.86 7.69 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 0.00 186 E 7.61 4.63 0.00 2.16 2.01 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 2.26 2.43 0.00 187 W 8.34 4.17 0.00 3.31 3.21 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 0.00 188 H 6.62 4.07 0.00 3.08 3.14 0.00 5.69 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 S 7.73 4.33 0.00 4.05 4.04 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 0.00 190 S 7.53 4.52 0.00 3.81 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 0.00 191 L 7.13 3.80 0.00 1.29 1.47 0.56 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 192 T 8.81 4.37 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 1.18 0.00 0.00 193 L 9.45 3.89 0.00 1.89 1.68 0.99 0.19 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 0.00 194 K 7.90 4.43 0.00 1.85 1.78 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.09 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.50 1.39 7.81 195 E 8.41 3.90 0.00 2.25 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 0.00 2.31 2.31 0.00 196 A 8.01 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 197 E 8.78 3.95 0.00 2.28 2.12 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 2.61 2.52 0.00 198 L 8.02 4.02 0.00 1.98 1.72 0.95 0.39 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 0.00 199 L 8.50 3.93 0.00 1.90 1.76 0.97 0.94 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 0.00 200 V 8.16 3.56 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.00 0.00 0.00 201 L 7.82 3.96 0.00 2.00 1.74 0.94 1.02 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 0.00 202 K 8.27 3.90 0.00 1.82 2.03 0.00 1.78 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.49 7.81 203 I 7.79 3.78 1.88 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 1.86 0.69 0.92 0.00 0.00 204 L 7.95 4.01 0.00 1.89 1.74 0.98 0.83 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 0.00 205 K 8.28 4.06 0.00 1.83 1.95 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.45 7.81 206 Q 8.12 3.95 0.00 2.30 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.53 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 207 V 7.49 4.14 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 0.88 0.00 0.00 0.93 0.00 0.00 208 M 7.20 4.18 0.00 2.24 2.25 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.51 0.00 209 E 8.69 3.96 0.00 2.00 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 2.30 0.00 210 E 7.53 4.46 0.00 2.07 1.99 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 2.21 2.28 0.00 211 K 8.34 4.04 0.00 1.74 1.79 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.43 7.81 212 L 8.25 4.53 0.00 1.60 1.57 0.93 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 213 D 8.69 5.03 0.00 2.91 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.83 4.11 0.00 2.12 2.13 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 2.29 2.43 0.00 215 N 8.73 4.81 0.00 2.81 2.90 0.00 0.00 6.68 7.96 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 0.00 216 N 7.81 5.12 0.00 2.81 2.99 0.00 0.00 6.43 7.25 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 0.00 217 A 7.95 5.28 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 0.00 218 Q 9.32 4.58 0.00 2.05 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.64 0.00 0.00 0.00 0.00 0.00 2.23 2.35 0.00 219 L 8.39 5.19 0.00 1.65 1.01 1.14 0.75 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 0.00 220 S 8.26 4.08 0.00 3.61 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 0.00 221 C 7.99 5.10 0.00 3.21 2.97 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 0.00 0.00 0.00 222 I 8.79 5.20 2.21 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 1.27 0.00 0.00 223 T 8.55 5.23 4.35 0.00 0.00 0.00 0.00 0.00 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 0.00 224 K 9.26 3.65 0.00 1.71 1.93 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.77 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.27 0.80 7.81 225 Q 7.72 4.36 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.97 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 226 D 8.37 4.79 0.00 2.73 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 0.00 227 G 7.96 3.78 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 0.00 0.00 0.00 228 F 9.43 4.64 0.00 2.98 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 0.00 229 K 6.73 4.45 0.00 1.73 1.64 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.40 7.81 230 I 8.00 4.47 1.88 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 1.39 0.57 0.92 0.00 0.00 231 Y 8.47 4.63 0.00 2.88 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 0.00 232 D 8.78 4.70 0.00 2.84 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 0.00 233 N 8.78 4.32 0.00 2.74 2.97 0.00 0.00 6.96 7.66 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 0.00 234 E 7.89 4.07 0.00 2.28 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 2.32 2.34 0.00 235 K 8.01 4.00 0.00 1.63 1.59 0.00 1.25 0.00 0.00 0.61 0.00 0.00 2.58 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.15 1.18 7.81 236 T 7.90 4.02 4.30 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 1.27 0.00 0.00 237 A 8.09 4.00 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 0.00 238 E 8.19 3.87 0.00 2.27 1.99 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 2.37 2.45 0.00 239 L 7.84 4.00 0.00 1.76 1.75 0.97 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 240 I 7.84 3.71 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.28 0.97 0.00 0.00 241 K 7.98 3.96 0.00 1.85 2.10 0.00 1.62 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.44 7.81 242 E 8.81 3.97 0.00 2.12 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 0.00 2.30 2.30 0.00 243 L 8.31 4.03 0.00 1.82 1.87 0.93 0.58 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 0.00 244 K 7.49 3.91 0.00 1.74 1.96 0.00 1.87 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.48 7.81 245 E 8.22 4.10 0.00 2.05 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 2.32 0.00 246 K 8.07 3.95 0.00 1.94 1.84 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.37 7.81 247 E 8.01 4.38 0.00 2.08 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 0.00 2.27 2.24 0.00 248 A 7.63 4.63 1.34 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 0.00 0.00 0.00 249 A 8.10 4.14 1.34 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 0.00 0.00 0.00 250 E 7.84 4.41 0.00 1.91 1.78 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 2.15 2.17 0.00 * Residues marked with a * may have inaccurate shift predictions.