NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 L 4.3282 8.1693 120.6288 53.6000 43.0989 176.3333 20 P 4.1203 0.0000 0.0000 61.1152 31.7270 175.0398 21 S 4.5244 8.6725 118.7701 56.4228 66.0840 174.3760 22 A 4.2424 8.4333 123.0819 52.6946 18.4764 178.3595 23 S 4.4251 9.2836 118.2714 57.5787 65.3405 175.1348 24 E 3.8586 8.7156 122.4177 59.6914 29.1812 178.6314 25 E 3.9493 8.0916 118.5103 59.3330 29.7513 178.5345 26 Q 4.0291 8.2911 118.2294 59.0642 28.6809 179.0058 27 V 3.8095 8.1455 119.1292 66.0767 31.3165 177.9389 28 A 4.1473 7.9522 119.5737 55.2652 18.2384 179.3749 29 Q 4.1493 8.2312 116.6220 59.2772 28.8598 178.5979 30 D 4.4480 8.6317 119.9735 57.5334 40.7054 178.8558 31 T 3.8848 8.0094 116.7487 66.4632 68.3893 175.7953 32 E 3.9808 7.9567 121.0353 59.5807 29.6561 178.7205 33 E 3.9294 8.0940 118.6412 59.0395 29.7313 178.6034 34 V 3.3778 7.6591 118.4096 65.9046 31.4051 177.8863 35 F 4.3117 8.5496 120.7151 61.3495 39.2307 177.3033 36 R 3.8253 8.2653 117.8076 59.3728 29.9495 179.3279 37 S 4.1278 8.2718 114.9297 61.5972 62.8207 175.7652 38 Y 4.2641 8.3859 122.7481 60.9317 38.3929 178.5549 39 V 3.6772 7.9826 119.1915 65.8687 31.5395 177.5902 40 F 3.8501 8.1291 120.2416 61.7126 39.1554 176.8055 41 Y 3.9837 8.0512 116.3697 60.7037 37.6186 178.1815 42 R 3.5485 8.1487 120.2764 59.4428 30.0413 178.0848 43 H 4.4030 8.2398 119.6367 58.6732 29.8527 176.9766 44 Q 3.7095 7.8328 121.4737 59.2963 28.8618 178.3672 45 Q 3.9752 8.2635 119.3356 58.9812 28.6058 178.6797 46 E 3.9605 8.2750 119.7349 59.4524 29.3952 179.3983 47 Q 3.9165 8.0806 118.1441 58.9625 28.4890 178.7061 48 E 3.9224 7.9266 118.6789 59.0477 29.5729 178.6774 49 A 4.2272 7.9857 119.8963 53.9004 19.2997 178.4404 50 E 4.4668 8.6048 115.7661 55.0623 31.3436 177.5518 51 G 3.7561 8.7255 108.2731 46.7961 0.0000 177.0138 52 V 3.7312 8.4855 116.9477 62.7625 31.4834 176.5785 53 A 4.1466 7.8816 122.0595 53.2691 18.6452 177.8667 54 A 4.7993 8.1218 119.5156 50.4811 18.9653 175.8178 55 P 4.3385 0.0000 0.0000 62.5505 32.0450 175.9240 56 A 4.3014 8.4681 125.0035 51.9091 19.2070 177.4619 57 D 4.0241 8.1667 121.8041 52.2872 42.0330 172.7225 58 P 4.3118 0.0000 0.0000 64.9878 31.5296 179.3651 59 E 3.9778 7.4666 118.9595 55.8987 28.4803 179.1804 *61 V 3.9418 7.8957 120.3020 62.7110 33.1646 175.7148 62 T 4.3846 7.4690 107.2491 60.9848 69.1951 174.7129 63 L 4.1794 7.1273 122.6234 54.7264 41.1149 175.1075 64 P 4.2726 0.0000 0.0000 62.7234 31.7257 176.0025 65 L 4.5428 7.9796 123.1861 53.5825 45.3414 175.6353 66 Q 4.3925 8.1720 125.2599 52.9466 29.2107 173.2294 67 P 4.3847 0.0000 0.0000 64.6165 31.7222 177.5755 68 S 4.5084 7.8512 110.1990 58.3295 63.9510 174.4414 69 S 4.3872 7.7390 116.6796 58.3463 63.5362 175.6795 70 T 4.1712 8.3821 114.2605 64.4482 67.7711 176.6774 *72 G 4.2043 8.1910 113.0039 45.7029 0.0000 176.0164 73 Q 3.9168 8.3240 119.4648 58.4865 28.5426 179.0033 74 V 3.6737 8.0835 119.5742 66.0354 31.6171 178.3931 75 G 3.6644 8.0178 105.0367 47.6262 0.0000 175.3183 76 R 3.8603 8.0541 121.0390 59.5240 29.9613 178.6690 77 Q 4.0079 8.1596 117.6921 58.9941 28.5932 178.8892 78 L 4.1152 8.3950 119.9986 57.6657 41.4227 179.3663 79 A 3.9678 8.1816 120.2577 55.0675 18.4295 179.5873 80 I 3.8246 7.8043 118.5411 64.6024 37.2746 178.8117 81 I 3.9217 8.2560 114.3654 63.7597 37.4627 178.3320 82 G 3.8279 8.5309 107.8937 47.7410 0.0000 174.9021 83 D 4.3691 7.7269 119.6638 57.1436 41.2128 177.3111 84 D 4.6201 7.9349 116.6239 55.2202 41.7572 177.2867 85 I 4.3532 7.7785 110.6701 60.9217 38.9158 175.8374 86 N 5.0325 8.0161 118.0438 53.6319 39.2969 175.8972 87 R 4.0020 8.0074 119.4716 60.0836 30.1143 178.6420 88 R 3.7411 7.8001 115.2561 59.6376 29.6861 178.2458 89 Y 3.7181 7.6304 117.9636 60.0857 37.8139 178.3509 90 D 4.4136 8.4583 119.1389 57.5257 41.3550 177.9617 91 S 4.1526 7.9792 113.6625 61.6855 62.0458 176.1624 92 E 3.9966 7.4577 119.3212 59.3501 29.2888 178.7151 93 F 4.8149 7.6353 116.5967 61.0894 39.1259 177.4874 94 Q 4.3798 8.2183 116.0029 59.2730 28.4523 179.0220 95 T 4.1772 7.6127 114.7414 64.1353 67.9301 176.3213 *97 L 4.3216 7.9364 123.3988 54.6394 43.6024 178.9344 98 Q 3.9944 7.6110 115.8962 59.1133 28.6676 177.3567 99 H 4.6457 8.0652 114.3023 56.1540 30.3529 174.4439 100 L 3.6972 7.5540 121.6037 55.0841 42.4453 176.1314 101 Q 4.2273 8.2105 124.9618 54.7048 30.1851 175.0355 102 P 4.4643 0.0000 0.0000 62.6140 30.2352 175.7195 103 T 4.5922 7.0446 109.9720 59.8075 73.5910 174.5789 104 A 4.0779 8.3708 123.4045 55.3624 18.4485 179.7750 105 E 4.0341 8.1788 117.2868 59.6127 29.8596 178.6032 106 N 4.6492 8.2138 116.0424 56.3063 38.5163 177.1626 107 A 4.1208 8.2762 122.2283 55.4546 18.4889 179.1040 108 Y 3.4177 8.5047 117.9986 60.6900 38.9058 178.0270 109 E 3.8514 8.5612 119.5543 59.5687 29.6239 178.9264 110 Y 3.8053 8.4064 116.7785 60.9771 37.9373 178.3211 111 F 4.4279 8.6196 121.7912 61.9570 39.4770 177.3903 112 T 3.6728 7.8380 115.4608 66.0843 68.1519 177.0422 113 K 3.8486 7.8777 120.8164 60.0331 32.5871 179.4541 114 I 3.4288 7.7585 122.3482 63.0962 36.7218 178.1624 115 A 3.4337 7.1421 120.5645 55.2493 18.0822 179.4650 116 T 4.2023 7.7017 114.3304 66.8767 68.0341 177.0474 117 S 4.0826 7.8467 116.1798 61.4289 62.7617 176.5110 118 L 3.8364 7.7443 121.6974 56.4474 41.4881 177.9128 119 F 4.9087 7.5277 114.7203 56.1058 39.6924 176.7489 120 E 3.9710 7.8694 122.9073 58.8481 29.3562 177.8423 121 S 4.5911 7.7180 110.8241 58.3580 63.1235 172.6386 122 G 3.6868 7.7297 107.4226 45.2675 0.0000 172.8739 123 I 4.4602 7.7395 118.8771 59.2089 39.3171 175.4803 124 N 4.6297 7.6468 120.8008 50.0718 41.6683 175.5785 125 W 4.4437 8.9333 120.4071 59.8624 29.1022 179.0353 126 G 3.7613 8.4101 105.4174 47.8882 0.0000 175.8833 127 R 3.5712 8.4031 120.3918 58.6565 30.0211 179.0679 128 V 3.8320 7.9329 118.1951 66.2857 31.4705 178.3105 129 V 3.6581 8.3271 117.8089 65.9070 31.2874 177.6227 130 A 4.4177 8.0214 121.9881 54.4231 17.9088 179.4508 131 L 3.9217 8.0470 118.6981 58.3308 42.2376 179.0133 132 L 4.3152 8.1406 119.1033 58.0619 41.5228 179.9109 133 G 4.0360 8.5778 105.8869 48.6430 0.0000 175.6025 134 F 3.8661 8.8346 123.4961 60.8116 39.2766 177.2500 135 G 3.8321 8.5195 105.7719 48.1385 0.0000 174.6234 136 Y 4.1639 8.6555 122.2915 60.7516 38.7873 178.7181 137 R 4.0404 8.4593 118.7911 58.9682 30.1411 178.8587 138 L 3.8052 8.0973 120.3589 58.0572 42.1047 178.7383 139 A 4.0582 8.1583 120.9155 55.2026 18.2178 179.3647 140 L 3.9410 7.8288 118.6662 58.4520 42.2299 178.5579 141 H 4.1404 8.5444 118.5387 59.6112 29.7524 177.7184 142 V 3.5835 8.0329 114.1680 64.2248 31.2546 177.9633 143 Y 4.2396 7.9607 120.7889 60.3913 38.4846 178.3090 144 Q 3.9369 8.2692 117.5465 58.4796 28.7179 177.4778 145 H 4.6363 7.6230 115.3680 55.2506 29.1059 175.9940 146 G 3.6595 7.8756 109.2383 45.0139 0.0000 174.4580 147 L 4.1819 7.9373 123.3512 53.8224 40.5537 175.9958 148 T 4.4763 8.0702 115.9064 61.3893 70.2706 175.2907 149 G 3.9369 9.3135 109.1379 47.1431 0.0000 174.8619 150 F 4.5680 7.5191 116.9275 57.5479 40.1970 176.5112 151 L 4.0613 7.8966 119.7484 58.7761 41.8892 178.5883 152 G 3.5406 7.9503 105.3066 47.7392 0.0000 175.2254 153 Q 3.3182 7.2749 121.2191 58.7000 28.9187 178.3908 154 V 2.8775 7.0532 119.1140 65.7974 31.4383 178.0081 155 T 3.5431 7.8116 115.5795 66.7647 68.2698 176.7390 156 R 3.8970 7.9458 120.0206 59.0434 30.0210 178.9114 157 F 4.2696 7.9061 118.0388 60.6679 38.5539 178.0018 158 V 3.7324 7.2687 116.1230 65.9887 31.4208 177.7562 159 V 3.8245 7.7917 116.9711 66.3478 31.6249 177.2209 160 D 4.5821 8.5078 117.8440 56.9063 40.9872 178.2909 161 F 4.4431 8.4201 118.9868 58.5291 39.2115 176.5078 *163 L 4.1359 7.8545 118.9715 54.9535 43.3607 178.3468 164 H 4.3859 8.1259 113.3454 57.8790 28.7333 175.9385 165 H 4.3057 8.0603 116.2803 55.2409 28.6117 175.5143 166 C 4.2245 7.8301 115.3039 61.1097 26.1927 175.5018 167 I 3.5409 7.1212 123.2765 64.2363 36.4686 178.0431 168 A 3.8465 7.8364 121.1998 55.0109 18.2097 179.5281 169 R 3.7499 7.8129 116.6896 59.2549 30.3525 178.2593 170 W 4.1858 8.0654 128.1603 60.6623 30.5695 177.9701 171 I 3.3386 8.0415 119.5559 64.1517 36.5135 178.1375 172 A 3.9240 8.1029 121.8318 55.4600 17.9404 179.7752 173 Q 3.8976 7.7204 115.3483 58.7020 28.8202 178.3390 174 R 4.0246 7.0806 116.8077 56.2482 30.2867 177.1028 175 G 3.9474 7.8057 107.1852 44.9898 0.0000 174.4624 176 G 4.0145 8.6139 106.8191 44.1342 0.0000 174.7421 177 W 4.7450 8.8499 117.2563 59.9600 29.3724 179.3520 178 V 3.6317 8.2212 111.0926 64.1907 31.1276 177.9539 179 A 4.0288 8.0322 121.6417 54.5113 18.2615 178.3104 180 A 3.3776 7.7374 118.0079 53.7134 18.8893 177.5505 181 L 4.1233 7.5644 120.3573 55.1201 41.5600 176.8990 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 19 L 8.17 4.33 0.00 1.66 1.68 0.93 0.74 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 20 P 0.00 4.12 0.00 2.26 2.06 0.00 3.76 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.02 0.00 21 S 8.67 4.52 0.00 4.01 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 22 A 8.43 4.24 1.33 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 0.00 0.00 0.00 23 S 9.28 4.43 0.00 4.04 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 24 E 8.72 3.86 0.00 2.03 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 2.37 2.36 0.00 25 E 8.09 3.95 0.00 2.13 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 2.39 2.48 0.00 26 Q 8.29 4.03 0.00 2.32 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.57 0.00 0.00 0.00 0.00 0.00 2.42 2.40 0.00 27 V 8.15 3.81 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 0.81 0.00 0.00 1.01 0.00 0.00 28 A 7.95 4.15 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 29 Q 8.23 4.15 0.00 2.36 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.73 0.00 0.00 0.00 0.00 0.00 2.42 2.58 0.00 30 D 8.63 4.45 0.00 3.25 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 T 8.01 3.88 4.57 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 1.47 0.00 0.00 32 E 7.96 3.98 0.00 2.06 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 2.34 2.37 0.00 33 E 8.09 3.93 0.00 2.06 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 2.34 2.34 0.00 34 V 7.66 3.38 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 0.29 0.00 0.00 0.03 0.00 0.00 35 F 8.55 4.31 0.00 3.14 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 36 R 8.27 3.83 0.00 1.89 1.93 0.00 3.18 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.91 0.00 37 S 8.27 4.13 0.00 4.10 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 38 Y 8.39 4.26 0.00 3.14 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 39 V 7.98 3.68 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 0.95 0.00 0.00 0.33 0.00 0.00 40 F 8.13 3.85 0.00 2.95 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 41 Y 8.05 3.98 0.00 3.15 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 R 8.15 3.55 0.00 0.83 1.14 0.00 2.57 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 1.11 0.00 43 H 8.24 4.40 0.00 3.47 3.24 0.00 5.89 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 Q 7.83 3.71 0.00 1.71 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.57 0.00 0.00 0.00 0.00 0.00 2.48 2.25 0.00 45 Q 8.26 3.98 0.00 2.17 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.48 0.00 46 E 8.27 3.96 0.00 2.19 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 2.34 2.30 0.00 47 Q 8.08 3.92 0.00 2.14 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.23 2.32 0.00 48 E 7.93 3.92 0.00 2.08 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 2.32 2.44 0.00 49 A 7.99 4.23 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 50 E 8.60 4.47 0.00 2.09 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 51 G 8.73 3.76 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 0.00 0.00 0.00 52 V 8.49 3.73 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 0.93 0.00 0.00 53 A 7.88 4.15 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 54 A 8.12 4.80 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 55 P 0.00 4.34 0.00 2.25 2.13 0.00 3.85 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.05 0.00 56 A 8.47 4.30 1.32 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 0.00 0.00 57 D 8.17 4.02 0.00 2.37 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 0.00 0.00 0.00 0.00 58 P 0.00 4.31 0.00 2.15 2.06 0.00 3.34 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 2.15 2.10 0.00 59 E 7.47 3.98 0.00 1.89 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 1.90 0.00 *61 V 7.90 3.94 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 0.88 0.00 0.00 0.90 0.00 0.00 62 T 7.47 4.38 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 1.24 0.00 0.00 63 L 7.13 4.18 0.00 1.56 1.85 0.94 0.94 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 64 P 0.00 4.27 0.00 2.02 1.99 0.00 3.61 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.04 0.00 65 L 7.98 4.54 0.00 1.14 1.14 0.57 -0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 66 Q 8.17 4.39 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.63 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 67 P 0.00 4.38 0.00 2.10 2.22 0.00 3.68 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 2.00 2.01 0.00 68 S 7.85 4.51 0.00 3.96 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 69 S 7.74 4.39 0.00 4.07 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 70 T 8.38 4.17 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 *72 G 8.19 4.20 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 0.00 73 Q 8.32 3.92 0.00 2.27 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.76 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 0.00 0.00 0.00 150 F 7.52 4.57 0.00 3.13 3.01 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 0.00 151 L 7.90 4.06 0.00 1.77 1.61 0.93 0.94 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 0.00 152 G 7.95 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 7.27 3.32 0.00 1.28 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.85 0.00 0.00 0.00 0.00 0.00 1.60 1.16 0.00 154 V 7.05 2.88 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 0.98 0.00 0.00 0.91 0.00 0.00 155 T 7.81 3.54 4.38 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 1.31 0.00 0.00 156 R 7.95 3.90 0.00 1.75 1.91 0.00 3.08 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 157 F 7.91 4.27 0.00 2.26 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 0.00 158 V 7.27 3.73 1.70 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 0.73 0.00 0.00 0.46 0.00 0.00 159 V 7.79 3.82 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 0.91 0.00 0.00 1.03 0.00 0.00 160 D 8.51 4.58 0.00 3.05 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 0.00 161 F 8.42 4.44 0.00 3.63 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *163 L 7.85 4.14 0.00 1.75 1.71 0.86 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 164 H 8.13 4.39 0.00 3.14 3.24 0.00 5.69 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 H 8.06 4.31 0.00 2.45 2.75 0.00 5.93 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 C 7.83 4.22 0.00 3.05 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 I 7.12 3.54 1.67 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.15 0.60 0.00 0.00 168 A 7.84 3.85 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 0.00 169 R 7.81 3.75 0.00 2.05 2.09 0.00 3.17 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 170 W 8.07 4.19 0.00 3.39 3.10 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 0.00 171 I 8.04 3.34 1.64 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.44 0.52 0.00 0.00 172 A 8.10 3.92 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 0.00 173 Q 7.72 3.90 0.00 1.90 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.30 2.44 0.00 174 R 7.08 4.02 0.00 1.78 1.95 0.00 2.62 0.00 0.00 2.25 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 175 G 7.81 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 0.00 176 G 8.61 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 0.00 177 W 8.85 4.75 0.00 3.52 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 V 8.22 3.63 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 0.89 0.00 0.00 1.00 0.00 0.00 179 A 8.03 4.03 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 0.00 180 A 7.74 3.38 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 L 7.56 4.12 0.00 1.82 1.57 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.