NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 14 K 4.3183 8.2993 120.1383 55.3717 33.4776 175.5843 15 P 4.2883 0.0000 0.0000 62.0147 31.8970 174.2844 16 N 4.5673 9.2710 118.6427 52.8244 40.0234 174.7542 17 P 4.4854 0.0000 0.0000 62.8498 33.2790 175.2200 18 T 5.1121 8.8182 118.8568 61.9099 71.3828 173.5939 19 I 5.5700 8.7332 119.9833 58.9111 41.2534 174.7100 20 T 5.0607 8.2986 118.4044 62.0895 71.7224 173.5893 21 V 4.5988 8.4829 119.0336 59.4510 35.7168 175.3190 22 F 5.4014 8.2904 120.8728 55.7955 40.8921 175.3537 23 E 4.6245 8.6944 116.5724 56.4895 29.7161 176.8213 24 R 4.6026 8.0667 118.0476 54.8259 32.9452 174.3307 25 S 4.3282 8.2054 121.2617 57.7168 64.6365 174.5046 *32 L 4.2428 8.4921 117.9749 54.4611 43.5823 176.7091 33 A 4.3754 7.6069 121.8529 51.5367 19.0471 178.3886 34 R 4.2287 8.4102 117.8786 57.9641 30.4701 178.5475 35 D 4.5130 7.9815 118.5170 55.7572 39.5961 177.8682 36 M 3.9404 7.9577 120.1310 58.4549 32.2072 176.4710 37 P 4.4451 0.0000 0.0000 65.4328 31.5098 178.8533 38 V 3.5325 7.7193 116.7626 65.9793 31.5873 178.0726 39 R 3.6252 8.5227 118.1482 59.0240 29.8336 178.9129 40 W 4.3313 8.5825 128.1269 60.3941 30.8310 177.9516 41 A 3.9011 8.2187 120.8428 55.1052 17.8380 179.6279 42 L 3.9666 7.8959 117.5404 57.8943 41.4141 179.6504 43 E 4.0729 8.1520 117.5459 59.4798 29.5461 178.5638 44 E 4.1641 8.4726 118.6448 58.9706 29.7786 178.5188 45 V 4.0955 7.7384 116.6248 61.7741 32.1746 177.1038 46 G 3.9000 8.0270 107.5412 45.1696 0.0000 172.9190 47 Q 4.1599 7.7724 121.2330 54.6304 29.5335 173.8409 48 P 4.8115 0.0000 0.0000 63.3402 32.3833 175.0636 49 Y 4.9730 7.8914 117.4300 56.4531 40.7128 173.4884 50 H 4.8840 9.0631 118.6640 54.4522 31.6953 174.1869 51 V 4.8031 8.2469 120.3931 61.4238 33.7250 174.7791 52 R 4.6027 8.9641 127.7785 55.1443 31.8513 175.9822 53 R 5.1389 8.5054 121.7246 55.1278 32.1073 175.3936 54 L 4.8938 8.5456 120.1097 54.1337 46.8033 175.2153 55 S 4.6364 8.3523 115.1524 57.5363 67.9968 174.2718 56 F 4.4681 7.6086 122.3505 57.4137 39.0507 178.5878 *68 Q 3.6607 8.6629 132.2704 55.8978 27.9898 173.5119 69 P 3.9584 0.0000 0.0000 63.9689 31.4479 177.4814 70 F 4.7325 7.5472 115.0438 56.2091 39.7617 175.1547 71 G 3.9422 7.7211 108.5063 47.1079 0.0000 174.0020 72 Q 4.7803 7.9915 116.2383 53.4190 31.8961 175.9235 73 I 4.1119 7.9874 115.1154 60.0488 38.7738 173.2932 74 P 5.3020 0.0000 0.0000 60.8085 33.5395 174.8748 75 S 4.7657 8.4576 115.7603 58.1950 64.4311 171.9885 76 Y 5.1940 8.9790 125.9662 55.9226 41.7492 173.7664 77 E 5.1190 8.9655 126.4938 54.6128 33.0931 175.3425 78 Q 4.3899 9.1507 126.3165 54.5564 31.5324 175.1809 79 G 3.9427 8.7565 119.6287 47.1863 0.0000 173.5689 80 D 4.5576 8.8723 124.6104 54.0561 41.2617 175.4000 81 L 4.4406 7.7330 123.2017 53.8551 42.7184 174.8459 82 I 5.0995 8.3114 126.5678 59.5959 39.7379 175.0302 83 L 5.1156 9.4714 125.9512 52.9368 45.7524 175.4711 84 F 5.1709 8.2874 116.1215 55.6727 41.8618 170.1131 85 E 3.7879 9.0595 125.5386 56.1286 28.0153 175.4679 86 S 4.1487 8.8649 120.9412 61.8314 62.8596 177.0845 87 G 3.3733 7.9168 107.3254 47.6916 0.0000 175.4685 88 A 3.8846 7.5466 122.6716 54.5731 18.5266 179.6345 89 I 3.2391 7.7631 118.5726 64.4624 37.2229 178.6781 90 V 3.4471 7.7050 119.0723 66.1870 31.2526 177.7983 91 M 3.8965 7.8454 118.2053 58.7397 31.5708 178.1377 92 H 4.1073 8.0725 118.0714 59.3618 30.1247 177.2368 93 I 3.4987 7.6108 121.2331 64.4237 36.7196 178.3540 94 A 4.0854 7.8345 120.6040 54.6213 18.3024 179.0054 95 Q 4.0842 7.9121 114.4056 57.8487 29.2221 176.8064 96 H 4.7677 7.3399 115.7548 55.7269 30.1647 172.7708 97 H 5.0891 7.5589 115.6815 53.9224 32.3206 172.0762 98 S 4.6860 8.4283 113.8273 58.0372 64.0613 173.9418 99 G 4.1201 8.9188 113.8119 45.5101 0.0000 174.1205 100 L 4.4209 7.9750 118.0083 54.4574 43.1348 175.8689 101 L 4.9810 7.4709 117.8044 51.8080 44.7600 174.6271 102 P 4.4175 0.0000 0.0000 62.4106 32.0660 176.3079 103 E 4.0088 8.7351 122.7628 58.9855 30.0898 177.7575 104 D 4.3900 8.0703 118.2041 54.7677 42.3416 177.0273 105 Q 4.0617 8.7372 125.7395 58.9562 28.3401 178.7280 106 L 4.0792 7.8337 119.7718 57.6135 41.9239 179.4708 107 R 4.0364 7.8662 116.8696 59.1139 30.0370 179.0090 108 R 3.8835 8.4590 118.8079 59.2783 30.1932 178.4340 109 A 3.9706 8.0032 120.6005 55.3681 18.5418 179.8906 110 R 3.8903 7.7244 115.3843 59.5124 30.0603 179.5211 111 T 4.0090 7.8095 115.3650 66.6991 68.4880 176.7969 112 V 3.6454 7.8509 119.9090 65.8581 31.4737 177.8480 113 A 3.9315 7.8286 120.2603 55.1037 18.1851 179.7296 114 W 4.2549 7.9776 117.0224 60.0828 28.7356 178.7346 115 M 4.0544 8.2749 118.8579 58.2496 31.3137 178.9046 116 F 3.8018 8.4244 117.7204 60.4904 39.1490 177.4812 117 A 3.9509 8.5258 120.5921 55.1978 18.0516 179.4883 118 A 4.0079 8.3698 119.1677 55.1369 18.3112 179.3461 119 L 4.3766 7.3867 114.9425 55.1759 42.4415 177.1457 120 N 4.9660 8.2868 113.5463 52.6277 38.9646 174.9415 121 T 4.3925 8.0100 113.7681 65.4353 70.7976 176.1106 122 I 4.0205 8.0240 121.8482 64.0886 37.4460 177.9806 123 E 4.0097 8.1670 120.1155 58.8791 29.4277 177.1407 124 P 4.3541 0.0000 0.0000 65.5205 31.4039 178.5766 125 S 4.2320 8.1412 113.6296 61.7011 62.6641 176.7755 126 I 3.8070 7.6831 121.8282 64.4878 37.0216 178.4184 127 L 4.1448 8.3346 121.5290 57.4906 39.8819 179.4815 128 N 4.5095 8.8508 116.7156 55.8411 38.3384 177.4739 129 F 4.4589 8.4963 123.6216 60.9718 39.1880 177.6082 130 T 3.8052 8.3564 109.7962 64.8416 68.1035 176.3310 131 T 4.2983 7.9920 111.9975 63.9958 68.6930 177.1027 132 V 3.7157 7.1034 119.4513 65.6624 31.8390 177.3323 133 W 4.1967 8.0269 126.8961 59.5583 30.3439 176.3087 134 L 4.4005 7.7057 115.2346 56.3436 43.1348 178.4895 135 F 4.3100 8.3441 114.8773 58.5358 40.1423 175.6818 136 E 4.7516 7.6364 115.9194 55.5620 29.7679 176.8222 137 R 3.7884 7.7851 119.5247 59.2661 30.8271 178.6163 138 N 4.4050 7.7714 112.4335 54.5658 39.2032 175.1925 139 E 3.7095 7.4847 119.4934 54.9825 29.8722 175.6272 140 P 4.5175 0.0000 0.0000 63.8252 31.8053 176.4664 141 W 4.8586 7.1301 115.4523 56.9694 28.2457 177.7986 142 H 4.0010 7.8824 119.1438 60.1324 29.3245 176.5718 143 E 4.0451 8.1622 118.7931 58.8587 29.7561 178.9706 144 A 4.0651 7.9823 121.9187 55.2843 18.7426 179.4129 145 R 4.0890 8.0222 116.9196 59.3268 30.3222 178.3343 146 L 4.0802 8.4058 120.4882 58.2377 42.1189 178.9127 147 A 4.1714 7.8163 119.9866 54.8488 18.4087 179.7266 148 R 3.9138 7.8085 116.5619 59.8466 30.0763 178.8520 149 T 4.0241 8.0307 109.6006 64.6614 68.6865 176.4504 150 K 3.8149 8.2331 122.1886 59.1969 32.1548 178.4870 151 E 3.9747 8.1330 119.2542 59.3953 29.1586 178.8535 152 Q 4.0556 8.0977 117.8188 58.4646 28.6563 178.3991 153 L 3.9044 8.0645 121.5495 58.2339 42.1419 178.7854 154 L 4.0003 8.1597 119.3051 58.0385 41.5700 179.8398 155 K 3.9947 7.9256 117.8723 59.4883 31.9545 179.6744 156 R 3.9327 7.6172 117.8887 59.2854 29.9532 179.1600 157 L 3.7672 8.0344 118.8591 57.3882 41.4433 179.2508 158 D 4.4853 8.2485 119.3224 57.5050 40.7045 178.7017 159 E 4.0563 8.0427 118.6210 59.1573 29.3899 179.1525 160 L 4.0583 8.0643 120.4517 58.2484 42.1264 178.8555 161 S 4.0347 8.3866 113.2748 61.3915 62.0797 176.0043 162 A 3.9887 7.9320 122.2267 54.8142 18.2147 179.1255 163 W 4.2612 8.3172 125.9383 60.5764 31.2028 177.5912 164 L 3.8256 8.3365 120.5838 56.1143 41.6785 178.4021 165 G 3.6278 8.4333 106.0958 47.0377 0.0000 173.7814 166 D 4.7235 8.5672 123.1672 52.4263 39.5714 176.5281 167 R 3.9601 7.4710 119.1275 56.4589 30.6913 176.6341 168 E 3.6757 8.6670 122.0885 58.3701 29.7579 176.3696 169 W 5.5554 7.4783 114.7093 54.3713 33.2270 175.2094 170 L 3.8836 9.0771 119.2750 57.7878 40.7789 178.5013 171 E 4.7016 7.8042 120.0310 55.4170 31.0862 176.3503 172 G 3.9730 8.3827 118.0644 45.8014 0.0000 173.0295 173 S 4.5361 8.6521 119.4398 57.3342 63.6605 173.7801 174 F 3.2887 8.3546 123.3704 58.9796 39.2591 174.9103 175 S 4.3111 7.2542 120.2616 55.9169 67.4128 174.8576 176 A 3.5748 8.3303 122.3110 54.7225 17.7345 179.6896 177 A 3.8659 7.5787 119.4022 55.4730 18.3801 179.5438 178 D 4.6772 7.4066 118.1344 56.8522 40.8708 178.8463 179 I 2.6175 6.5269 120.2824 64.0563 37.0489 178.5057 180 L 3.9556 7.6181 119.6129 57.8917 41.4631 179.3347 181 M 4.1190 8.4089 118.4831 58.7971 32.3886 178.2591 182 I 3.8470 8.2232 120.3484 64.7677 37.0960 178.2373 183 C 4.4066 8.1759 116.3186 62.7734 28.1155 176.0400 184 V 3.8210 8.0325 119.8042 66.2018 31.2831 178.2199 185 L 4.1226 8.6413 118.6405 57.4652 41.3694 179.3617 186 R 4.2074 8.1164 117.4595 58.3496 29.8044 178.5050 187 R 4.2611 7.7073 117.1413 57.9092 30.2521 177.5153 188 L 4.4926 7.7690 118.4348 54.8360 41.3244 178.3275 189 E 4.0002 8.0375 120.7647 59.7129 29.3207 178.9211 190 S 3.9756 8.2786 111.3828 61.3557 62.2813 175.6439 191 S 4.2027 7.5963 115.6255 58.4135 63.2509 175.3092 192 G 3.9286 7.6535 108.7084 46.0331 0.0000 174.5869 193 I 3.8544 7.5269 122.7197 63.6130 37.4573 178.0655 194 L 4.4938 7.8665 118.9793 56.2823 41.6538 178.8637 195 K 4.1079 7.5639 116.9454 58.7442 32.0364 177.5051 196 D 4.4826 7.9048 116.2578 54.5509 41.4818 176.3277 197 Y 4.5685 7.4558 118.6352 55.3846 38.0504 176.2790 198 G 3.6888 8.4747 111.7803 47.6803 0.0000 172.2053 199 N 4.4849 8.1703 118.7557 55.2240 37.5278 177.1228 200 L 4.1971 7.9182 121.1698 57.2565 41.8747 178.6631 201 L 3.9977 8.2021 120.2287 58.1557 42.0118 178.9206 202 A 4.0140 8.1019 120.6291 54.8182 18.1846 178.9160 203 Y 4.0519 7.8599 117.9522 60.9990 38.9015 178.5571 204 V 3.4907 7.8452 119.0046 66.1593 31.6398 177.8953 205 E 3.8791 7.9501 118.4064 59.0783 29.0075 179.2182 206 R 3.9349 7.9675 118.5270 59.3848 30.4461 178.5596 207 G 4.0773 8.0446 105.3932 47.7748 0.0000 175.9684 208 K 2.4800 7.5151 119.6549 58.3987 32.0210 178.6902 209 A 4.0958 7.6466 118.9650 52.4881 18.9140 177.8792 210 R 4.0768 7.3848 117.8826 55.1077 31.1006 175.8668 211 P 4.2507 0.0000 0.0000 65.8853 31.3420 178.7528 212 A 4.1144 8.0739 118.9200 54.8917 18.3256 179.2858 213 F 3.1157 8.0041 118.9066 61.2082 39.4242 177.4475 214 K 4.0163 8.1286 117.5467 59.7023 31.7944 179.4072 215 R 3.9659 8.1773 118.0258 59.1620 29.8360 178.9635 216 A 4.1129 8.0107 120.6317 54.6886 18.3613 179.5157 217 F 3.6653 8.3373 119.8788 61.4890 39.5736 177.2016 218 D 4.4399 8.4209 118.4021 57.2575 40.3891 178.6354 219 A 4.0454 7.9052 121.1425 55.0603 18.5026 179.4880 220 Q 4.0156 7.8620 118.4252 58.9679 28.5694 177.7683 221 L 4.0834 7.6158 120.2059 57.0727 42.0488 178.5327 222 A 4.0988 7.8025 120.6873 54.9540 17.0183 179.3815 223 V 3.8484 7.4706 116.5131 65.2414 31.4333 178.0248 224 F 4.3368 7.6993 119.3549 60.9851 39.2679 176.4175 225 T 4.2968 7.5977 106.9733 63.5722 69.2864 176.6133 226 A 4.0932 7.5622 121.4212 54.6458 18.4136 177.0805 227 A 4.0816 7.2942 124.3513 52.5402 18.4781 177.0891 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 14 K 8.30 4.32 0.00 1.80 1.86 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.46 7.81 15 P 0.00 4.29 0.00 2.26 2.07 0.00 3.79 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 16 N 9.27 4.57 0.00 2.66 2.86 0.00 0.00 6.99 8.02 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 17 P 0.00 4.49 0.00 1.93 1.12 0.00 3.78 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 2.21 2.13 0.00 18 T 8.82 5.11 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 1.28 0.00 0.00 19 I 8.73 5.57 1.94 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.75 0.97 0.00 0.00 20 T 8.30 5.06 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 1.30 0.00 0.00 21 V 8.48 4.60 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 1.00 0.00 0.00 0.99 0.00 0.00 22 F 8.29 5.40 0.00 3.00 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 E 8.69 4.62 0.00 1.96 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 0.00 2.26 2.37 0.00 24 R 8.07 4.60 0.00 1.84 1.88 0.00 3.05 0.00 0.00 3.20 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 25 S 8.21 4.33 0.00 4.07 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 *32 L 8.49 4.24 0.00 1.75 1.89 1.01 0.86 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 33 A 7.61 4.38 1.36 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 0.00 0.00 0.00 0.00 0.00 0.00 34 R 8.41 4.23 0.00 1.92 2.01 0.00 3.24 0.00 0.00 3.30 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 35 D 7.98 4.51 0.00 2.91 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 M 7.96 3.94 0.00 2.23 2.09 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.58 0.00 37 P 0.00 4.45 0.00 2.20 2.12 0.00 3.75 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 2.15 2.24 0.00 38 V 7.72 3.53 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 1.05 0.00 0.00 0.89 0.00 0.00 39 R 8.52 3.63 0.00 2.07 1.99 0.00 3.18 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 40 W 8.58 4.33 0.00 3.43 3.30 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 41 A 8.22 3.90 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 L 7.90 3.97 0.00 1.57 1.79 0.30 1.05 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 43 E 8.15 4.07 0.00 2.28 2.14 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 2.67 2.66 0.00 44 E 8.47 4.16 0.00 2.31 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 0.00 2.49 2.45 0.00 45 V 7.74 4.10 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 0.89 0.00 0.00 1.00 0.00 0.00 46 G 8.03 3.90 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 47 Q 7.77 4.16 0.00 1.94 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.97 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 48 P 0.00 4.81 0.00 2.07 2.03 0.00 3.86 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.97 0.00 49 Y 7.89 4.97 0.00 3.01 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 50 H 9.06 4.88 0.00 3.10 3.21 0.00 5.55 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.25 4.80 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 0.89 0.00 0.00 1.03 0.00 0.00 52 R 8.96 4.60 0.00 1.83 1.84 0.00 3.17 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 53 R 8.51 5.14 0.00 1.70 1.96 0.00 3.26 0.00 0.00 3.24 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.73 0.00 54 L 8.55 4.89 0.00 1.75 1.93 1.11 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 55 S 8.35 4.64 0.00 3.71 3.61 0.00 0.00 0.00 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2.04 0.00 141 W 7.13 4.86 0.00 3.57 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 H 7.88 4.00 0.00 3.29 3.23 0.00 5.87 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 E 8.16 4.05 0.00 2.26 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 2.42 2.37 0.00 144 A 7.98 4.07 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 0.00 145 R 8.02 4.09 0.00 2.35 2.14 0.00 3.26 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.83 0.00 146 L 8.41 4.08 0.00 1.83 1.75 1.19 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 147 A 7.82 4.17 1.51 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 0.00 148 R 7.81 3.91 0.00 2.16 2.00 0.00 3.31 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.82 0.00 149 T 8.03 4.02 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 150 K 8.23 3.81 0.00 2.24 1.91 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.31 1.08 7.81 151 E 8.13 3.97 0.00 2.23 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 0.00 2.33 2.37 0.00 152 Q 8.10 4.06 0.00 2.36 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.59 0.00 0.00 0.00 0.00 0.00 2.40 2.54 0.00 153 L 8.06 3.90 0.00 1.80 1.67 0.86 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 154 L 8.16 4.00 0.00 1.88 1.78 0.91 0.99 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 0.00 155 K 7.93 3.99 0.00 1.91 1.86 0.00 1.68 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 1.48 1.50 7.81 156 R 7.62 3.93 0.00 1.97 1.95 0.00 3.28 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.81 0.00 157 L 8.03 3.77 0.00 1.00 0.52 0.72 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 158 D 8.25 4.49 0.00 2.92 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 0.00 159 E 8.04 4.06 0.00 2.19 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 2.36 2.34 0.00 160 L 8.06 4.06 0.00 1.89 1.73 0.97 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 161 S 8.39 4.03 0.00 4.01 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 0.00 162 A 7.93 3.99 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 W 8.32 4.26 0.00 3.66 3.43 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 0.00 164 L 8.34 3.83 0.00 1.72 1.52 0.62 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 165 G 8.43 3.63 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 0.00 0.00 0.00 166 D 8.57 4.72 0.00 2.71 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 0.00 167 R 7.47 3.96 0.00 1.75 1.91 0.00 2.88 0.00 0.00 2.93 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.40 0.00 168 E 8.67 3.68 0.00 1.67 1.66 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 1.47 1.65 0.00 169 W 7.48 5.56 0.00 3.50 3.42 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 0.00 170 L 9.08 3.88 0.00 1.40 0.79 0.65 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 171 E 7.80 4.70 0.00 1.97 1.90 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 2.38 2.56 0.00 172 G 8.38 3.97 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 0.00 0.00 0.00 173 S 8.65 4.54 0.00 4.07 3.97 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 0.00 174 F 8.35 3.29 0.00 1.64 2.58 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 0.00 175 S 7.25 4.31 0.00 3.99 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 A 8.33 3.57 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 0.00 177 A 7.58 3.87 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 0.00 178 D 7.41 4.68 0.00 1.73 2.51 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 0.00 179 I 6.53 2.62 1.53 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.03 0.63 0.00 0.00 180 L 7.62 3.96 0.00 1.76 1.67 0.78 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 181 M 8.41 4.12 0.00 2.33 2.22 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 2.81 2.74 0.00 182 I 8.22 3.85 2.33 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 1.18 0.71 1.11 0.00 0.00 183 C 8.18 4.41 0.00 3.36 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 V 8.03 3.82 2.38 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 1.15 0.00 0.00 1.06 0.00 0.00 185 L 8.64 4.12 0.00 1.95 1.80 1.16 1.00 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 R 8.12 4.21 0.00 2.19 2.10 0.00 3.25 0.00 0.00 3.24 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.03 0.00 187 R 7.71 4.26 0.00 2.00 2.09 0.00 3.25 0.00 0.00 3.31 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.76 0.00 188 L 7.77 4.49 0.00 2.06 1.70 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 0.00 189 E 8.04 4.00 0.00 2.16 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 2.37 2.45 0.00 190 S 8.28 3.98 0.00 3.97 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 S 7.60 4.20 0.00 3.38 3.69 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 G 7.65 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 0.00 193 I 7.53 3.85 1.69 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.54 0.83 0.00 0.00 194 L 7.87 4.49 0.00 1.76 1.79 1.00 0.79 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 0.00 195 K 7.56 4.11 0.00 1.95 1.86 0.00 1.86 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.43 7.81 196 D 7.90 4.48 0.00 2.22 2.32 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 0.00 197 Y 7.46 4.57 0.00 3.03 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 0.00 198 G 8.47 3.69 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 0.00 0.00 0.00 199 N 8.17 4.48 0.00 2.95 3.08 0.00 0.00 6.25 6.67 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 0.00 200 L 7.92 4.20 0.00 2.01 1.83 0.85 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 201 L 8.20 4.00 0.00 2.15 1.86 0.95 0.96 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 0.00 202 A 8.10 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 0.00 203 Y 7.86 4.05 0.00 3.19 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 V 7.85 3.49 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 0.95 0.00 0.00 1.09 0.00 0.00 205 E 7.95 3.88 0.00 2.07 1.90 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 2.54 2.41 0.00 206 R 7.97 3.93 0.00 1.91 1.74 0.00 2.93 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.42 0.00 207 G 8.04 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 0.00 0.00 0.00 208 K 7.52 2.48 0.00 1.50 1.37 0.00 1.38 0.00 0.00 1.55 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.30 1.17 7.81 209 A 7.65 4.10 1.28 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 0.00 0.00 0.00 0.00 0.00 0.00 210 R 7.38 4.08 0.00 2.13 1.87 0.00 2.56 0.00 0.00 2.91 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.84 0.00 211 P 0.00 4.25 0.00 2.17 2.12 0.00 3.60 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 212 A 8.07 4.11 1.56 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 0.00 213 F 8.00 3.12 0.00 2.36 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 0.00 214 K 8.13 4.02 0.00 2.00 1.85 0.00 1.71 0.00 0.00 1.79 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.70 7.81 215 R 8.18 3.97 0.00 2.05 2.02 0.00 3.15 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.85 0.00 216 A 8.01 4.11 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 0.00 217 F 8.34 3.67 0.00 2.79 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 0.00 218 D 8.42 4.44 0.00 2.78 2.73 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 0.00 219 A 7.91 4.05 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 0.00 220 Q 7.86 4.02 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.78 0.00 0.00 0.00 0.00 0.00 2.30 2.41 0.00 221 L 7.62 4.08 0.00 1.73 1.81 0.68 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 222 A 7.80 4.10 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 0.00 223 V 7.47 3.85 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.00 0.00 0.00 224 F 7.70 4.34 0.00 3.28 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 0.00 225 T 7.60 4.30 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 1.41 0.00 0.00 226 A 7.56 4.09 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 0.00 227 A 7.29 4.08 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 * Residues marked with a * may have inaccurate shift predictions.