NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 P 4.6756 0.0000 0.0000 62.7295 33.1318 175.2048 8 T 4.1348 8.8816 112.0234 57.2387 71.6432 174.1572 9 F 3.4029 7.4283 119.4026 59.1624 38.8552 178.0540 10 E 3.4844 7.0070 120.6632 58.6625 29.2569 177.2781 11 N 4.6817 7.0753 112.4263 52.6087 38.3536 174.8465 12 S 4.8498 7.6841 114.9087 55.7984 66.3909 172.1440 13 P 4.5845 0.0000 0.0000 62.1227 31.9900 175.6754 14 S 4.3528 8.4853 114.4194 60.0801 62.6050 174.4692 15 G 4.3031 9.0834 116.4149 44.6827 0.0000 173.4341 16 T 3.8404 7.4529 117.4367 63.7760 69.3609 173.8008 17 V 3.8046 8.3581 127.4129 63.0725 31.6019 175.4208 18 L 4.4964 8.9975 127.8713 55.9340 43.3908 177.0101 19 T 4.2705 7.6098 107.8377 60.5843 70.7314 174.4458 20 S 4.5706 8.0813 117.7216 55.8595 62.5925 172.4262 21 P 4.4253 0.0000 0.0000 61.3881 31.9188 175.2074 22 P 4.5261 0.0000 0.0000 63.3002 31.7372 175.1907 23 D 4.9962 8.5176 120.1152 52.4869 43.5908 176.5639 24 G 3.8179 8.5523 107.1099 46.3662 0.0000 174.0329 25 S 4.6992 7.7147 115.3532 56.9904 66.6630 173.9056 26 A 4.3741 8.0753 121.4987 53.8894 20.2069 179.2520 27 V 3.5749 7.6517 117.1097 65.1290 31.3772 178.1954 28 D 4.3991 8.0031 119.0370 57.0877 40.7642 178.7591 29 R 3.9147 8.3164 118.6865 59.0884 29.9712 178.8820 30 A 4.0255 8.3400 120.9670 55.4351 18.2192 179.9170 31 T 3.8287 8.0588 114.2920 66.7228 68.6063 176.3856 32 D 4.3435 8.3453 119.9192 57.5110 41.1819 178.3648 33 A 4.0180 8.2469 120.9282 54.9637 18.2682 179.4523 34 A 3.9648 8.2870 119.7283 55.3911 18.4473 180.0325 35 R 3.8725 8.3895 116.9812 59.3429 30.1207 179.2832 36 R 3.8888 7.9020 118.4531 59.2730 30.0169 178.7258 37 V 3.5482 7.7524 118.0404 66.0030 31.3463 177.8256 38 V 3.5525 7.6926 116.7684 66.3148 31.4592 177.1744 39 D 4.4398 8.1085 117.1367 57.3153 41.1047 178.0255 40 A 4.0105 8.0235 121.3073 55.1707 18.1592 179.4306 41 L 3.9511 8.0736 116.9085 57.9916 41.7568 179.3176 42 L 4.2305 7.6842 116.8373 56.1603 41.8193 177.6650 43 R 4.4367 7.7441 115.9105 56.1369 31.5635 176.1914 44 T 4.1722 7.5592 112.1185 60.6062 68.5450 173.2496 45 D 4.4476 8.3922 123.9057 53.9853 41.0065 177.1428 46 R 3.9963 8.6726 126.9220 58.7960 30.2440 177.9855 47 G 3.7570 8.8101 105.2646 45.6599 0.0000 173.2460 48 N 4.2805 8.1082 120.1655 53.3597 39.0832 175.3909 49 A 4.0731 8.7068 128.5097 55.2123 18.4121 178.5568 50 N 4.4165 8.4528 114.6983 55.7842 38.5168 177.2124 51 L 3.9627 7.9508 120.8596 57.2882 41.5742 178.9053 52 E 3.9005 7.9373 119.4318 59.4397 29.5401 178.9425 53 R 3.9066 7.8901 118.1614 59.1672 30.1930 178.1360 54 V 3.5459 8.0727 118.2103 66.1503 31.4012 177.9052 55 A 3.9807 8.1337 120.2412 55.1601 18.1667 179.3322 56 E 3.9042 8.0311 116.6386 59.6423 29.5573 179.5571 57 E 3.9538 8.4247 118.6059 59.4405 29.4836 179.3798 58 L 4.0287 8.0949 119.0813 57.9326 41.5895 179.3566 59 N 4.3234 8.4116 116.5646 56.2613 38.4277 177.4437 60 S 4.0830 8.2072 114.5980 61.4202 62.4439 176.1775 61 I 3.6900 8.3291 122.6209 64.3734 36.8397 178.2741 62 A 4.0862 8.4073 121.9389 55.0325 18.1638 179.6900 63 G 3.6892 8.3827 104.6470 46.1340 0.0000 175.0969 64 H 4.1229 8.3543 120.8481 59.0908 29.6934 177.1458 65 L 4.0417 8.0149 119.4017 57.9911 41.8811 179.1462 66 E 4.1239 8.6737 118.8022 59.5349 29.2250 179.1869 67 E 4.1577 8.3562 117.0843 57.9703 30.8710 177.8796 68 H 4.7034 7.7239 117.5558 53.7385 26.2501 174.0288 69 A 4.7857 6.9238 122.8188 49.1578 22.4619 174.7045 70 P 4.4199 0.0000 0.0000 62.2790 32.1444 176.4684 71 A 4.0709 8.6025 122.3895 54.9879 18.4380 178.0968 72 V 4.1465 7.4223 113.6336 59.8625 33.0352 175.9684 73 A 4.2002 8.3081 126.0785 51.7436 19.0114 177.1028 74 E 4.1310 8.4468 120.0861 55.8901 30.2364 177.4224 75 R 4.0323 8.4490 122.6631 56.5039 30.8333 175.6776 76 L 4.7380 8.1668 123.3468 52.9654 43.9945 176.1482 77 I 4.1223 8.2519 122.6982 60.5233 37.7687 175.4951 78 D 4.8146 9.3172 125.9100 53.1303 42.2537 176.9510 *80 W 4.7659 8.2408 121.3081 56.2505 30.8502 175.7075 81 N 4.8886 8.3332 116.2841 53.0867 38.4455 174.3454 82 G 3.8663 8.1770 102.3209 46.3643 0.0000 174.8112 83 E 4.1966 8.1154 117.7339 55.2776 30.1283 174.6803 84 G 3.6310 7.8480 103.5746 43.7062 0.0000 173.2430 85 V 3.6742 8.0410 118.9920 62.0830 32.0743 176.2312 86 T 4.0540 8.1500 116.9626 62.1123 69.2075 174.1403 87 R 4.5648 8.5914 120.1773 56.2638 31.3468 176.4154 88 H 4.9285 7.8668 112.1827 55.0145 29.9699 174.0539 89 D 4.6844 7.6126 120.6582 52.4975 40.4122 174.5909 90 P 4.5355 0.0000 0.0000 63.2175 31.6471 177.4483 91 V 4.0272 8.0574 119.9025 64.3468 32.9468 176.8802 92 T 4.6103 8.7576 106.4504 60.8513 70.2523 174.2051 93 G 3.7995 8.1472 113.7041 44.6488 0.0000 172.9460 94 P 4.2617 0.0000 0.0000 65.2868 31.4416 176.9489 95 E 4.4637 8.0661 115.1210 55.1157 29.9180 174.9896 96 N 4.6878 7.9640 119.5068 51.6679 38.7552 175.2394 97 A 4.2511 8.4705 129.0765 53.9664 18.7515 178.1825 98 L 4.1437 8.2304 115.4185 56.7591 42.0396 177.6839 99 A 4.7167 7.6988 121.0991 50.4355 19.0827 175.3277 100 P 4.4160 0.0000 0.0000 64.9286 31.4979 175.3330 101 P 4.6854 0.0000 0.0000 61.6091 32.7938 174.8116 102 V 4.0635 8.3295 120.2362 61.9972 32.6847 175.1866 103 V 4.3033 8.2577 127.3170 61.3597 33.5206 174.1445 104 L 5.2304 8.4565 127.1813 52.7812 45.0417 175.2831 105 E 4.8259 9.0608 120.5988 54.3387 33.2058 174.9604 106 G 2.3810 8.2279 108.8231 44.5990 0.0000 172.7227 107 L 5.2203 8.7381 123.1688 52.5382 44.8439 177.7713 108 S 4.3303 9.2138 117.8031 62.1844 62.8395 175.7004 109 D 4.4698 8.0722 115.8713 54.0118 39.1448 176.9837 110 G 3.1600 8.4293 109.9401 44.8467 0.0000 174.1336 111 S 4.6655 8.3706 114.9199 58.0913 64.8897 173.4232 112 V 4.7072 8.6514 120.7115 61.5013 34.7896 174.2070 113 R 5.1392 8.5221 123.8994 55.5617 34.0200 173.8110 114 G 4.7471 8.9482 110.9315 45.6204 0.0000 171.4040 115 T 5.3668 8.3612 116.5504 61.4597 71.3519 174.2678 116 V 4.4714 9.1586 125.1763 60.2424 35.5719 174.3317 117 T 4.9441 8.3461 119.7023 61.3084 70.5502 173.5896 118 L 4.6766 8.3783 126.6814 53.8382 44.3186 175.7638 119 T 5.0744 8.3042 111.2126 59.5174 72.2728 174.6646 120 I 3.8622 8.1823 113.4714 63.3495 37.5989 176.5577 121 P 4.1743 0.0000 0.0000 64.9027 31.3281 176.3146 122 Y 4.4326 7.8869 115.0312 57.5370 38.1308 175.1016 123 Q 4.6743 7.8483 122.2544 55.9454 31.1717 173.1365 124 G 3.7202 9.1621 112.1360 44.9859 0.0000 173.6823 125 P 4.3122 0.0000 0.0000 61.5482 32.7550 173.9818 126 P 4.2652 0.0000 0.0000 64.5696 31.6681 177.0036 127 G 4.0064 9.1425 109.6540 46.0866 0.0000 172.1312 128 H 5.2773 8.1221 116.1033 53.4575 33.4389 172.8349 129 V 4.1655 9.0011 121.5848 62.6908 32.2740 175.4763 130 H 4.0109 9.4459 128.6333 56.5866 30.3010 176.1553 131 G 3.8756 9.0991 112.3614 48.2217 0.0000 175.8572 132 G 3.7439 8.4287 107.1877 47.3111 0.0000 176.0148 133 V 3.6633 7.7664 120.0984 66.0575 31.6241 177.7963 134 S 4.1475 8.2069 114.7731 61.8394 62.6632 176.6827 135 A 4.0107 8.1634 123.0462 55.0545 18.1292 179.2671 136 L 3.9395 8.1070 118.7213 58.4091 42.1512 179.1406 137 L 4.0030 8.2013 118.9679 57.9258 41.6170 179.6181 138 L 3.9926 8.2075 119.0359 57.6954 41.6371 178.8786 139 D 4.4823 8.4658 118.3485 57.8694 41.1266 178.0264 140 H 4.2975 8.3911 118.5189 59.3536 29.8342 177.1065 141 V 3.5685 8.0865 120.1842 66.2676 31.2124 178.0471 142 L 4.0940 8.3174 118.7237 57.6040 41.4761 179.6221 143 G 3.3459 8.0244 105.2886 47.6593 0.0000 175.9251 144 V 3.3982 7.7766 120.5714 65.5173 31.5352 177.7856 145 A 4.0417 8.1522 120.7879 55.3896 18.1051 179.3326 146 N 4.1481 8.1055 114.5197 56.3241 38.6038 177.4358 147 A 3.9204 7.8058 122.0913 55.0441 18.5008 179.5652 148 W 4.7948 8.1875 128.6291 59.6831 30.5343 177.4315 149 G 4.0232 8.1045 103.3109 44.3009 0.0000 174.2453 150 G 3.8851 7.9278 108.5052 45.6141 0.0000 173.5807 151 K 4.6574 8.0897 117.6524 54.3631 35.2064 175.5623 152 A 4.7166 8.1958 122.0272 51.4189 23.0432 174.4645 153 G 4.0180 7.8888 114.3517 45.5375 0.0000 175.8192 *155 T 3.7830 8.5664 120.4739 63.1430 69.3849 172.1565 156 A 4.5567 8.6799 127.2233 53.1821 20.8562 176.6304 157 Q 4.4807 7.3520 114.7353 54.6433 32.9867 172.8151 158 L 5.0153 8.3473 126.0317 53.4810 45.1036 175.4436 159 S 4.7225 9.1975 123.3307 57.2347 65.2078 173.1874 160 T 4.9329 8.5340 121.7422 61.6422 70.6809 174.0048 161 R 4.5513 8.8172 125.6602 54.4570 33.2681 174.4613 162 Y 4.6504 8.6153 121.2460 57.2147 38.7491 174.8877 163 H 4.7093 9.5622 122.6602 57.4247 29.9196 176.1949 164 R 4.7557 7.7775 113.4731 53.4949 34.1787 173.0716 165 P 4.3116 0.0000 0.0000 63.2276 31.9771 176.2954 166 T 4.6451 8.3712 118.6270 61.3555 70.0291 172.1779 167 P 4.7767 0.0000 0.0000 62.2240 32.2756 176.2801 168 L 3.8107 8.3804 122.3222 54.6379 43.0533 177.2408 169 F 4.6114 8.7453 116.4515 58.1908 36.5745 174.9844 170 E 4.8470 7.5576 117.2540 53.9334 33.3453 172.6781 171 P 4.8070 0.0000 0.0000 62.5540 32.0233 175.6304 172 L 4.9083 9.2368 125.2236 53.2189 44.8134 175.5441 173 T 4.9031 8.8153 120.1599 62.1111 70.5973 173.4977 174 L 5.1234 9.0207 126.9660 53.3773 44.3696 175.7996 175 T 5.0865 8.7069 119.2879 61.9751 73.1215 173.2279 176 G 4.5783 8.9009 111.0729 44.9356 0.0000 171.4113 177 K 4.8959 9.0358 122.4313 54.5392 36.0731 175.3738 178 L 4.4261 8.4553 129.4964 55.0765 43.2786 175.5463 *180 S 4.3703 8.3659 115.2777 58.1988 64.8706 172.9536 181 V 4.6570 8.1994 119.1356 61.2324 33.9412 174.5613 182 D 4.6096 8.7847 126.4116 52.9107 43.1912 176.1731 183 G 3.8412 8.1840 119.0407 47.0225 0.0000 175.0099 184 R 4.1066 8.6230 125.4214 56.9170 30.4555 175.0747 185 K 4.8330 8.0865 121.4387 55.4988 33.5279 175.1969 186 I 4.8787 9.0948 129.0926 60.0863 39.4294 174.7131 187 T 5.1926 8.7872 123.5261 62.1799 70.8167 173.9016 188 T 5.0088 9.3479 121.9871 61.8412 73.0835 172.8563 189 A 5.1916 8.9176 125.9177 50.7649 23.1941 175.3238 190 G 4.2865 8.6404 105.9635 46.5160 0.0000 171.3075 191 D 5.1949 8.7622 117.9446 52.5951 43.4206 174.2335 192 I 4.9821 8.9551 120.2179 59.6673 39.8378 175.2840 193 R 5.8144 9.1224 125.0266 53.5457 34.5394 175.6864 194 T 4.4503 8.3267 111.7377 60.5028 70.2038 175.3478 195 A 4.1917 8.4136 123.8772 54.5347 18.3260 177.9357 196 D 4.5288 8.0480 113.5804 53.4511 39.9489 177.4140 197 G 3.9537 8.6100 109.3540 45.3412 0.0000 174.0401 198 Q 4.0661 7.9763 119.4945 55.3669 29.3177 175.6165 199 V 4.0688 8.1726 122.4413 63.0952 32.3007 175.2210 200 C 4.4493 9.3347 126.1238 61.9657 29.4368 173.9867 201 V 4.9770 7.6041 117.4841 61.0693 34.9058 173.9501 202 S 5.3068 8.9693 120.7775 56.7308 67.0585 172.9359 203 V 4.9833 8.7616 119.0712 60.2879 35.1781 173.2727 204 E 5.0436 9.2331 122.9843 54.4443 32.7336 174.5151 205 G 4.4421 9.8016 114.2556 44.3240 0.0000 171.5961 206 L 5.3820 8.6039 123.4086 52.7178 44.6750 175.6602 207 F 5.1281 9.3917 121.4416 55.5729 43.3842 173.9906 208 V 4.8477 8.4226 120.8415 61.0348 33.6457 174.7889 209 D 4.7793 9.0819 127.3066 54.6289 40.7175 175.7430 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 7 P 0.00 4.68 0.00 2.61 2.30 0.00 3.60 0.00 0.00 3.82 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 8 T 8.88 4.13 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 9 F 7.43 3.40 0.00 3.03 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 0.00 0.00 0.00 0.00 10 E 7.01 3.48 0.00 1.58 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.76 0.00 11 N 7.08 4.68 0.00 2.80 2.79 0.00 0.00 6.85 7.52 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 12 S 7.68 4.85 0.00 4.33 4.08 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 0.00 0.00 0.00 13 P 0.00 4.58 0.00 2.28 2.23 0.00 3.82 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.00 0.00 14 S 8.49 4.35 0.00 3.95 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 15 G 9.08 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 0.00 0.00 0.00 0.00 16 T 7.45 3.84 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 1.22 0.00 0.00 17 V 8.36 3.80 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 0.75 0.00 0.00 0.92 0.00 0.00 18 L 9.00 4.50 0.00 1.45 1.58 0.48 0.57 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 19 T 7.61 4.27 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 20 S 8.08 4.57 0.00 3.84 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 21 P 0.00 4.43 0.00 2.16 2.03 0.00 3.76 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 22 P 0.00 4.53 0.00 2.06 2.05 0.00 3.62 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 23 D 8.52 5.00 0.00 2.73 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 24 G 8.55 3.82 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 0.00 0.00 0.00 25 S 7.71 4.70 0.00 4.04 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.08 4.37 1.31 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 0.00 0.00 27 V 7.65 3.57 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 0.94 0.00 0.00 0.95 0.00 0.00 28 D 8.00 4.40 0.00 2.98 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 R 8.32 3.91 0.00 1.95 1.98 0.00 3.29 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.87 0.00 30 A 8.34 4.03 1.35 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 0.00 0.00 0.00 31 T 8.06 3.83 4.33 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 0.00 0.00 0.00 1.31 0.00 0.00 32 D 8.35 4.34 0.00 2.86 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 33 A 8.25 4.02 1.39 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 0.00 0.00 34 A 8.29 3.96 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 35 R 8.39 3.87 0.00 2.05 2.04 0.00 3.33 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.82 0.00 36 R 7.90 3.89 0.00 2.04 2.11 0.00 3.11 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 37 V 7.75 3.55 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 1.02 0.00 0.00 1.02 0.00 0.00 38 V 7.69 3.55 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 0.79 0.00 0.00 0.95 0.00 0.00 39 D 8.11 4.44 0.00 2.82 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 40 A 8.02 4.01 1.39 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 0.00 0.00 41 L 8.07 3.95 0.00 1.77 1.76 0.91 0.94 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 1.27 0.00 0.00 118 L 8.38 4.68 0.00 1.46 1.43 0.76 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 119 T 8.30 5.07 4.63 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 1.36 0.00 0.00 120 I 8.18 3.86 1.96 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.70 1.23 0.00 0.00 121 P 0.00 4.17 0.00 1.39 1.89 0.00 3.65 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.04 0.00 122 Y 7.89 4.43 0.00 3.12 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 0.00 123 Q 7.85 4.67 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 124 G 9.16 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 0.00 0.00 0.00 125 P 0.00 4.31 0.00 2.17 1.95 0.00 3.61 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 126 P 0.00 4.27 0.00 2.08 2.07 0.00 3.78 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 127 G 9.14 4.01 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 0.00 128 H 8.12 5.28 0.00 3.22 3.24 0.00 5.81 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 V 9.00 4.17 2.18 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 0.74 0.00 0.00 0.91 0.00 0.00 130 H 9.45 4.01 0.00 3.38 3.20 0.00 5.66 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 0.00 131 G 9.10 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 0.00 132 G 8.43 3.74 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 0.00 133 V 7.77 3.66 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 1.09 0.00 0.00 134 S 8.21 4.15 0.00 4.33 4.01 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 0.00 135 A 8.16 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 0.00 136 L 8.11 3.94 0.00 1.83 1.95 0.99 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 137 L 8.20 4.00 0.00 1.85 1.70 0.82 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 138 L 8.21 3.99 0.00 1.79 1.74 0.87 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 139 D 8.47 4.48 0.00 2.93 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 0.00 140 H 8.39 4.30 0.00 3.44 3.37 0.00 5.85 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 V 8.09 3.57 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 1.05 0.00 0.00 1.00 0.00 0.00 142 L 8.32 4.09 0.00 2.16 1.87 1.19 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 143 G 8.02 3.35 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 0.00 0.00 0.00 0.00 144 V 7.78 3.40 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 0.99 0.00 0.00 0.75 0.00 0.00 145 A 8.15 4.04 1.35 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 0.00 0.00 0.00 146 N 8.11 4.15 0.00 2.61 2.83 0.00 0.00 6.93 7.45 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 0.00 147 A 7.81 3.92 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 0.00 148 W 8.19 4.79 0.00 3.30 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 0.00 149 G 8.10 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 0.00 0.00 0.00 150 G 7.93 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 0.00 0.00 0.00 151 K 8.09 4.66 0.00 1.64 1.67 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.51 1.48 7.81 152 A 8.20 4.72 1.16 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 0.00 0.00 153 G 7.89 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 0.00 0.00 0.00 *155 T 8.57 3.78 4.14 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 0.91 0.00 0.00 156 A 8.68 4.56 1.16 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 0.00 0.00 157 Q 7.35 4.48 0.00 2.03 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 158 L 8.35 5.02 0.00 1.53 1.44 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 159 S 9.20 4.72 0.00 3.74 3.73 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.53 4.93 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 0.77 0.00 0.00 161 R 8.82 4.55 0.00 1.57 1.65 0.00 3.07 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.51 0.00 162 Y 8.62 4.65 0.00 2.86 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 0.00 163 H 9.56 4.71 0.00 3.15 3.37 0.00 5.61 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 R 7.78 4.76 0.00 1.77 1.79 0.00 3.23 0.00 0.00 3.43 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.69 0.00 165 P 0.00 4.31 0.00 2.01 1.82 0.00 3.67 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.06 0.00 166 T 8.37 4.65 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 1.23 0.00 0.00 167 P 0.00 4.78 0.00 2.04 2.02 0.00 3.77 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 168 L 8.38 3.81 0.00 0.42 0.13 0.58 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 169 F 8.75 4.61 0.00 3.20 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 E 7.56 4.85 0.00 1.89 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 0.00 2.19 2.29 0.00 171 P 0.00 4.81 0.00 1.95 2.04 0.00 3.69 0.00 0.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.97 0.00 172 L 9.24 4.91 0.00 1.55 1.51 0.88 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 173 T 8.82 4.90 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 1.18 0.00 0.00 174 L 9.02 5.12 0.00 1.49 1.53 0.89 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 175 T 8.71 5.09 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 1.22 0.00 0.00 176 G 8.90 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 K 9.04 4.90 0.00 1.75 1.58 0.00 1.58 0.00 0.00 1.53 0.00 0.00 2.71 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.27 1.29 7.81 178 L 8.46 4.43 0.00 1.65 1.51 0.89 0.99 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 *180 S 8.37 4.37 0.00 3.98 4.03 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 0.00 181 V 8.20 4.66 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 0.84 0.00 0.00 0.95 0.00 0.00 182 D 8.78 4.61 0.00 2.74 2.50 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 0.00 183 G 8.18 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 0.00 184 R 8.62 4.11 0.00 1.88 2.01 0.00 3.55 0.00 0.00 3.29 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.57 0.00 185 K 8.09 4.83 0.00 1.89 1.87 0.00 1.62 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.45 7.81 186 I 9.09 4.88 2.07 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.63 0.95 0.00 0.00 187 T 8.79 5.19 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 1.25 0.00 0.00 188 T 9.35 5.01 4.55 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 0.00 0.00 1.28 0.00 0.00 189 A 8.92 5.19 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 0.00 190 G 8.64 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 0.00 191 D 8.76 5.19 0.00 2.84 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 0.00 192 I 8.96 4.98 1.86 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 1.21 0.66 0.90 0.00 0.00 193 R 9.12 5.81 0.00 1.68 1.83 0.00 3.23 0.00 0.00 3.53 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.35 0.00 194 T 8.33 4.45 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 0.00 195 A 8.41 4.19 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 0.00 196 D 8.05 4.53 0.00 2.78 2.79 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 0.00 197 G 8.61 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 0.00 198 Q 7.98 4.07 0.00 2.16 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.95 0.00 0.00 0.00 0.00 0.00 2.37 2.66 0.00 199 V 8.17 4.07 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 0.59 0.00 0.00 0.86 0.00 0.00 200 C 9.33 4.45 0.00 3.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 V 7.60 4.98 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 0.43 0.00 0.00 1.01 0.00 0.00 202 S 8.97 5.31 0.00 3.87 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 0.00 203 V 8.76 4.98 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 0.97 0.00 0.00 204 E 9.23 5.04 0.00 2.03 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 2.20 2.25 0.00 205 G 9.80 4.44 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 0.00 206 L 8.60 5.38 0.00 1.41 1.52 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 207 F 9.39 5.13 0.00 2.94 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 0.00 208 V 8.42 4.85 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 0.82 0.00 0.00 0.96 0.00 0.00 209 D 9.08 4.78 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 * Residues marked with a * may have inaccurate shift predictions.