NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 G 3.8925 8.2085 109.7303 45.7004 0.0000 175.8873 16 A 3.7846 7.8400 120.0919 53.3554 19.0054 177.8758 17 R 3.4535 8.2026 117.9482 59.6255 30.4511 176.4760 18 D 4.3734 7.9657 118.0337 57.4825 40.7674 178.5937 19 L 3.9748 8.1276 120.7160 58.0332 41.9852 178.9803 20 L 4.0510 8.2907 119.2864 57.7589 41.5127 179.5161 21 L 3.8293 7.8813 118.5809 57.8208 41.6024 179.3818 22 Q 3.9715 8.3024 119.6259 59.3587 28.9805 178.3508 23 T 3.8566 8.3351 117.0014 66.4567 68.2822 176.3336 24 A 3.8733 7.9131 121.6053 55.2948 18.4925 179.0106 25 S 4.0144 7.8801 110.2445 61.8735 62.6028 176.0223 26 N 4.6430 8.3048 118.8316 56.2336 38.2972 177.9839 27 I 3.9842 7.5492 117.4749 62.2590 36.6379 177.7609 *29 R 4.4554 7.9448 122.7571 56.4277 31.6083 177.2222 30 E 4.1063 8.5428 116.3992 57.8967 28.4293 177.4561 31 G 3.9159 8.1009 105.8423 44.4823 0.0000 173.5540 32 D 4.7739 7.5900 120.2647 54.6029 39.0223 173.7953 33 V 4.6595 7.1969 115.4284 60.2838 34.4950 174.9146 34 V 3.5388 8.3820 121.7370 65.6689 31.6646 175.7947 35 D 4.4939 7.9619 119.9606 53.6895 39.8322 175.5269 36 I 4.3385 7.8145 117.4839 59.0334 40.0847 175.6441 37 S 4.4502 8.1790 115.3217 57.3541 63.7823 174.5681 38 L 3.9755 8.4931 130.7724 58.2750 41.9815 179.1543 39 S 4.1193 8.0233 113.8519 61.3501 62.8843 175.9429 40 E 3.9025 8.2059 122.9635 58.8930 29.4527 178.4383 41 L 3.9302 8.0556 120.4533 58.2529 42.2354 178.9992 42 S 4.3126 8.2549 114.4304 60.6809 62.1450 175.7725 43 L 3.9477 8.0435 122.2298 58.4679 41.9653 178.9707 44 R 4.1180 8.1456 117.1609 59.0444 30.0989 178.8258 45 S 4.3654 8.0476 113.2335 59.0529 63.2230 175.4591 46 G 3.9253 7.8174 108.9118 45.6667 0.0000 172.8389 47 L 4.7689 7.5231 119.3264 52.0634 44.1951 175.8009 48 N 4.4687 8.5543 120.9877 53.4318 39.8503 176.0499 49 S 4.2395 8.7733 119.2776 61.3014 62.8617 176.3725 50 A 4.0407 8.6854 125.1127 55.3429 17.9357 179.5533 51 L 3.9627 8.1875 117.4115 57.5774 41.5920 179.8271 52 V 3.9215 7.7873 117.9820 66.1112 31.5441 178.0803 53 K 4.0263 8.0615 117.9803 59.4907 31.6480 178.6518 54 Y 4.0189 7.8935 118.8815 61.1692 38.8327 177.6671 55 Y 3.8317 7.8525 116.2814 59.6779 38.2334 176.4335 56 F 4.8748 8.2102 116.0178 56.0221 41.3073 176.6344 57 G 4.1486 9.7661 114.7343 45.8653 0.0000 173.7415 58 N 4.7897 7.5382 115.5561 50.0129 41.0703 174.6437 59 K 3.7530 8.7281 120.2513 59.9887 31.9749 178.0804 60 A 4.0657 8.0609 120.3127 55.1391 18.3555 179.7195 61 G 3.9339 8.6312 105.8100 47.1111 0.0000 175.8391 62 L 3.2267 7.9561 122.6254 57.7445 42.0251 178.8794 63 L 3.8190 7.9353 119.1407 57.8058 41.5626 179.5436 64 K 3.9253 8.1165 119.1040 59.4933 32.1093 178.7607 65 A 4.0625 8.1007 121.1230 54.8642 18.2052 179.4122 66 L 3.7439 8.0334 119.2453 58.0217 41.9394 178.7500 67 L 3.8050 7.8325 119.4560 58.3267 42.0552 178.1844 68 D 4.4844 7.7191 117.7095 56.6411 41.2349 177.7844 69 R 4.2056 7.8163 118.1765 59.3978 30.4102 179.2707 70 D 4.3316 7.8782 117.9392 54.3001 41.2873 177.6767 *72 E 4.4633 8.1518 119.8827 56.6725 31.8514 178.5113 73 N 4.4275 7.9530 115.2813 55.8108 38.3097 177.5716 74 I 3.5989 7.5618 120.4413 64.4791 37.5186 178.1107 75 V 3.7721 7.7406 118.5221 65.8849 30.9108 177.9319 76 K 3.9947 8.5255 119.0475 59.4393 31.8324 179.3647 77 S 4.2458 7.9583 113.8826 61.0285 62.8491 176.7369 78 V 3.4641 7.5806 122.4766 65.9238 31.3461 177.5862 79 D 4.2970 7.8013 117.4144 57.3599 40.4824 178.4565 80 A 3.9979 7.9832 119.3210 55.3068 18.4039 178.8883 81 L 3.9090 7.7808 117.4845 57.8256 42.2342 178.4073 82 L 4.4124 7.6184 115.8897 54.0009 42.5326 176.9528 83 A 3.9920 7.3918 124.4032 53.3663 19.2719 179.1575 84 K 4.4046 8.4089 124.8635 53.5465 30.4546 175.5529 85 D 4.7561 7.8635 116.8490 53.0499 40.7055 176.3818 86 D 4.2554 7.9334 116.7856 55.2086 38.0334 173.9373 *88 S 4.2869 7.3451 116.0476 57.3041 66.0741 172.7806 89 P 4.4359 0.0000 0.0000 65.9823 30.9865 178.4660 90 E 4.1667 8.2157 117.1033 59.3861 29.5651 178.6152 91 A 4.0288 8.1283 120.6543 55.0924 18.5334 179.5049 92 K 3.8751 8.4133 117.3723 59.7936 32.1499 179.3064 93 L 3.9546 8.3019 120.3356 58.1451 42.0518 178.9347 94 R 3.9595 8.4983 119.1455 59.3384 30.1235 178.3711 95 R 3.8893 8.2842 118.7681 59.6823 30.0008 178.0849 96 H 4.1962 8.1392 117.8665 59.3761 29.9030 177.3648 97 I 3.6573 8.2149 122.0850 64.3290 36.7968 178.5987 98 S 4.1131 8.2494 116.1513 61.4030 62.6644 176.6537 99 K 3.8500 7.8826 121.9020 59.6076 31.9738 178.4591 100 C 3.6616 7.9962 116.9614 62.9071 28.0570 176.1571 101 I 4.0132 8.0948 121.5307 64.7174 36.7493 178.1270 102 D 4.3720 8.3083 119.7371 57.6947 40.5705 179.1913 103 T 3.6865 7.7328 116.0320 66.9293 68.0271 176.5679 104 Y 4.3717 8.1636 118.9305 61.0743 37.5751 177.9297 105 Y 3.8078 8.4835 120.5635 60.6636 38.9160 177.3869 106 D 4.2668 7.9095 118.8406 55.9860 42.4288 176.5054 107 Y 4.5262 7.4219 116.5196 55.4861 37.6782 174.5576 108 P 4.6590 0.0000 0.0000 64.1198 32.3653 177.7011 109 Y 4.4328 7.2469 116.7399 57.7345 38.8030 176.9955 110 L 4.1005 7.7998 123.6006 58.3697 41.8602 178.1956 111 N 4.2775 7.9054 115.8367 56.4765 39.0760 176.6090 112 R 3.9497 7.7595 118.2649 58.9570 30.4311 178.2804 113 L 4.1383 8.4392 120.4515 58.0352 42.0458 179.5087 114 L 3.6835 7.9317 118.0386 55.9409 42.3155 178.4225 *116 R 4.2043 7.9002 117.9373 55.9332 31.6444 177.5971 117 L 4.0519 7.8522 116.1674 57.6952 42.1077 178.8684 118 V 3.7596 8.3321 118.8260 65.9546 31.6449 178.1089 119 R 3.9377 7.9753 118.2098 59.2614 30.0320 176.7262 120 D 4.6142 8.0380 115.5898 54.9642 41.2923 176.9817 121 S 4.2571 7.4480 114.5692 57.9716 63.6481 174.5950 122 D 4.7068 8.3112 122.8189 52.4552 42.1585 176.8255 123 E 3.8838 8.6072 118.4275 59.4919 29.5150 178.4360 124 A 3.9857 7.9705 120.3656 55.0851 18.4621 179.0754 125 E 3.9039 8.7105 117.7062 59.0315 29.7099 178.6679 126 A 3.9792 8.3161 121.3416 55.1011 18.3935 179.5125 127 K 3.8325 7.9966 118.0386 59.5508 32.1877 178.9464 128 R 3.7706 7.9086 118.9349 59.5104 29.9494 178.4929 129 I 3.4744 7.9044 119.4284 64.1816 37.1036 178.3076 130 A 3.9408 8.0670 121.4897 55.4466 18.0661 179.5421 131 D 4.3502 8.1376 116.3567 57.1886 40.8862 178.5737 132 Q 4.0473 7.8990 117.8613 57.9664 29.3112 176.9341 133 Y 4.9085 8.0999 116.4291 58.1871 39.7927 176.9946 134 L 4.5871 7.5572 119.5744 55.9126 42.9907 178.5415 135 L 3.8912 8.3255 118.9473 57.3261 41.6495 177.8257 136 P 4.2343 0.0000 0.0000 65.5493 31.1960 178.6071 137 L 3.5840 7.7139 117.0325 57.9096 41.6549 178.4895 138 H 4.0411 7.8704 118.0729 59.7026 29.8051 177.4159 139 R 3.8602 8.4490 119.6635 58.9852 29.7404 178.9818 140 A 4.0054 7.7362 120.2241 55.4158 18.3301 179.3079 141 Y 4.4368 8.1486 115.7429 61.2675 37.8086 178.3139 142 N 4.3183 8.4916 118.2977 56.7198 39.1017 176.9919 143 R 3.9313 7.9981 119.8891 59.3771 30.2244 178.2900 144 F 4.1517 8.6817 120.7472 61.2060 39.4427 177.2694 145 I 3.8698 8.4237 120.0840 64.2941 36.9145 178.5068 146 G 3.6616 7.8626 106.3036 48.0613 0.0000 175.5840 147 E 4.0405 8.1645 121.5936 58.9294 29.4296 179.7845 148 G 3.0193 8.0640 105.7250 47.2293 0.0000 176.0715 149 V 3.8913 8.3616 122.3156 65.4676 31.3481 178.3600 150 K 3.9849 7.8615 117.0172 59.1236 31.9922 178.6150 151 A 4.1705 7.9225 119.0424 52.4601 18.4478 178.2802 152 G 3.8092 7.5938 105.2661 45.6815 0.0000 174.8417 153 V 3.9259 7.6493 114.6311 61.8589 32.6668 175.9834 154 F 5.6660 7.5730 118.2809 55.2867 42.0097 175.6224 155 R 4.1369 8.8482 121.8063 55.3835 30.8955 175.3238 156 P 4.3100 0.0000 0.0000 63.1548 30.4982 175.4923 157 I 4.5170 7.8597 116.3893 58.5620 40.5903 175.0593 158 N 4.7142 8.4395 119.1665 52.1502 40.0226 173.7356 159 P 4.3928 0.0000 0.0000 65.7948 31.6061 178.3746 160 Q 4.1814 8.3446 117.7699 59.4368 29.1741 178.1938 161 L 4.2822 8.7390 120.2592 57.8358 41.6183 179.2980 162 F 4.0678 8.7060 120.8620 61.1806 39.2454 176.3298 163 Y 4.2495 8.8290 119.6818 61.1411 38.6102 178.5372 164 F 4.3033 8.1186 119.3472 59.8320 38.6985 178.0093 165 T 3.7069 7.6040 115.0361 66.6050 68.4666 176.3850 166 V 3.4314 7.2565 120.2430 66.2529 31.6377 178.2075 167 T 3.3447 7.1039 110.6840 63.5947 68.5420 175.9609 168 G 3.4816 7.8011 107.5165 45.9362 0.0000 175.0642 169 A 3.3940 8.1011 124.0605 54.9348 18.1108 179.5167 170 A 3.8525 6.5073 118.3309 55.5617 18.3832 179.6467 171 D 4.3913 7.7248 116.7783 57.4738 40.8498 179.1708 172 R 3.9914 7.6952 118.6204 59.2734 29.9562 179.1272 173 F 4.7472 8.2066 117.9858 60.3980 38.8570 177.4589 174 F 4.0524 8.8405 120.8533 61.4390 39.1127 177.2471 175 S 4.1665 8.7133 114.7269 61.6810 62.6325 176.5215 176 A 3.8589 8.2390 123.2714 55.2319 18.1455 179.6114 177 R 3.6920 8.1852 117.3543 59.3692 30.1118 178.5612 178 L 3.7779 7.7415 120.1213 58.0353 42.0214 179.1154 179 V 3.5777 7.9740 118.5523 66.0437 31.3798 177.9434 180 L 3.5200 7.9136 119.0282 57.3603 41.1140 179.4261 181 K 3.8652 7.7619 118.6726 59.8609 32.2855 178.0706 182 H 4.5623 8.0552 114.1546 56.9659 29.1450 175.7777 183 C 4.8314 8.4820 115.4499 59.1029 29.9802 173.5288 184 F 4.8792 7.7754 117.7421 54.9164 41.4245 174.9614 185 D 4.4991 8.5556 122.0910 55.1059 41.2225 177.9111 186 Q 4.3801 8.3795 123.9683 54.4369 27.5854 173.8781 187 D 4.9143 7.4790 120.0612 51.0107 43.4286 177.1378 188 T 3.8506 8.5743 114.2731 67.0116 68.2677 176.5366 189 L 3.9934 7.9705 120.3240 58.1807 41.6798 179.5748 190 T 3.8718 8.5508 115.8240 66.5575 68.3675 176.2251 191 E 3.9154 8.0987 121.0510 59.5644 29.5876 178.9876 192 Q 3.9784 8.4096 118.3178 58.6085 28.5725 178.5185 193 L 3.9730 8.0297 122.8774 57.5759 41.9592 178.9263 194 R 3.8781 7.7805 117.3008 59.5787 30.2665 177.6139 195 D 4.1841 8.2896 118.0890 57.2292 40.8220 178.3006 196 S 4.2152 8.4754 114.7948 61.0884 62.9203 175.6773 197 Y 4.5714 7.8920 123.3461 60.5565 38.3969 178.0645 198 R 3.9302 7.6896 119.0476 59.4011 30.1157 178.7410 199 E 4.0059 8.0488 117.7192 59.5624 29.4454 178.6990 200 H 4.1795 8.3437 118.3639 59.8104 30.0670 177.4955 201 T 3.8916 8.2760 117.5548 66.4561 68.0144 176.9722 202 V 3.6033 7.7106 119.1376 66.2276 31.6949 177.4414 203 D 4.5142 8.1428 117.4446 57.3303 40.8652 178.3806 204 F 3.9467 8.5510 121.3625 61.1047 38.8889 177.8571 205 I 3.8029 7.5953 115.2252 62.3322 36.5245 177.5558 *207 A 4.2220 8.0038 124.9300 52.1320 20.1961 179.3405 208 G 3.6339 8.2338 104.3828 47.7814 0.0000 174.1530 209 I 4.1114 7.3753 118.5014 61.6301 39.3666 175.7646 210 L 4.6142 7.8211 119.4032 54.7076 42.1167 176.6819 211 A 4.2883 8.7859 125.0913 52.4049 18.8334 177.0437 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 15 G 8.21 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 16 A 7.84 3.78 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.20 3.45 0.00 0.67 1.53 0.00 2.83 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 1.63 1.14 0.00 18 D 7.97 4.37 0.00 2.87 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.13 3.97 0.00 1.84 1.90 0.94 0.60 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 20 L 8.29 4.05 0.00 2.13 1.89 1.23 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 21 L 7.88 3.83 0.00 1.86 1.64 0.97 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 22 Q 8.30 3.97 0.00 2.18 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 23 T 8.34 3.86 4.37 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 1.22 0.00 0.00 24 A 7.91 3.87 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 25 S 7.88 4.01 0.00 3.96 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 26 N 8.30 4.64 0.00 2.97 3.02 0.00 0.00 7.06 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 I 7.55 3.98 1.96 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.05 0.89 0.00 0.00 *29 R 7.94 4.46 0.00 2.24 2.26 0.00 3.25 0.00 0.00 3.35 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 30 E 8.54 4.11 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 2.33 2.35 0.00 31 G 8.10 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 D 7.59 4.77 0.00 2.89 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 33 V 7.20 4.66 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 0.70 0.00 0.00 0.97 0.00 0.00 34 V 8.38 3.54 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 0.76 0.00 0.00 0.92 0.00 0.00 35 D 7.96 4.49 0.00 2.70 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.81 4.34 1.83 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.55 0.83 0.00 0.00 37 S 8.18 4.45 0.00 3.90 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 38 L 8.49 3.98 0.00 1.80 1.66 0.97 0.93 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 39 S 8.02 4.12 0.00 4.09 4.12 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 0.00 0.00 0.00 40 E 8.21 3.90 0.00 2.08 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 41 L 8.06 3.93 0.00 1.86 1.87 0.97 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 42 S 8.25 4.31 0.00 3.96 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 43 L 8.04 3.95 0.00 1.85 1.77 0.93 0.89 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 44 R 8.15 4.12 0.00 1.81 1.98 0.00 3.22 0.00 0.00 3.28 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.82 0.00 45 S 8.05 4.37 0.00 4.09 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 46 G 7.82 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 47 L 7.52 4.77 0.00 1.79 1.63 1.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 48 N 8.55 4.47 0.00 2.73 2.70 0.00 0.00 6.91 7.63 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 49 S 8.77 4.24 0.00 4.12 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 A 8.69 4.04 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 51 L 8.19 3.96 0.00 2.05 1.95 0.97 0.72 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 52 V 7.79 3.92 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 1.34 0.00 0.00 1.07 0.00 0.00 53 K 8.06 4.03 0.00 2.04 1.89 0.00 1.96 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.69 1.63 7.81 54 Y 7.89 4.02 0.00 2.77 2.83 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 55 Y 7.85 3.83 0.00 2.23 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 0.00 0.00 0.00 56 F 8.21 4.87 0.00 3.21 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 57 G 9.77 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 N 7.54 4.79 0.00 2.99 2.94 0.00 0.00 5.75 6.73 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 59 K 8.73 3.75 0.00 1.83 1.86 0.00 1.69 0.00 0.00 1.80 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.49 7.81 60 A 8.06 4.07 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 61 G 8.63 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 62 L 7.96 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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 0.00 132 Q 7.90 4.05 0.00 0.93 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.78 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 133 Y 8.10 4.91 0.00 3.06 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 0.00 134 L 7.56 4.59 0.00 1.70 1.40 0.95 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.33 3.89 0.00 1.64 1.66 0.91 1.00 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 0.00 136 P 0.00 4.23 0.00 2.14 2.08 0.00 3.58 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 2.29 2.20 0.00 137 L 7.71 3.58 0.00 1.99 1.48 1.03 1.10 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 0.00 138 H 7.87 4.04 0.00 2.76 3.13 0.00 5.59 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 0.00 139 R 8.45 3.86 0.00 1.88 1.95 0.00 3.16 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 140 A 7.74 4.01 1.26 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 0.00 141 Y 8.15 4.44 0.00 3.15 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 0.00 142 N 8.49 4.32 0.00 2.81 2.92 0.00 0.00 6.86 8.51 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 0.00 143 R 8.00 3.93 0.00 2.08 2.16 0.00 3.19 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 1.71 1.68 0.00 144 F 8.68 4.15 0.00 3.39 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 0.00 0.00 0.00 0.00 145 I 8.42 3.87 1.96 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 0.93 0.51 0.85 0.00 0.00 146 G 7.86 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 E 8.16 4.04 0.00 1.89 1.89 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 2.30 2.56 0.00 148 G 8.06 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 0.00 0.00 0.00 149 V 8.36 3.89 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 1.22 0.00 0.00 1.00 0.00 0.00 150 K 7.86 3.98 0.00 1.88 1.81 0.00 1.73 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.61 7.81 151 A 7.92 4.17 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.59 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 0.00 0.00 0.00 153 V 7.65 3.93 1.69 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 0.50 0.00 0.00 -0.05 0.00 0.00 154 F 7.57 5.67 0.00 2.85 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.85 4.14 0.00 1.68 1.88 0.00 3.17 0.00 0.00 3.28 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 156 P 0.00 4.31 0.00 2.18 2.13 0.00 3.72 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 157 I 7.86 4.52 1.89 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.60 0.94 0.00 0.00 158 N 8.44 4.71 0.00 2.84 2.82 0.00 0.00 6.88 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 P 0.00 4.39 0.00 2.29 2.18 0.00 3.74 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.19 0.00 160 Q 8.34 4.18 0.00 2.24 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.90 0.00 0.00 0.00 0.00 0.00 2.79 2.79 0.00 161 L 8.74 4.28 0.00 2.02 1.84 0.99 1.32 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 0.00 162 F 8.71 4.07 0.00 3.17 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 0.00 163 Y 8.83 4.25 0.00 3.36 3.13 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 0.00 164 F 8.12 4.30 0.00 3.23 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 T 7.60 3.71 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 1.07 0.00 0.00 166 V 7.26 3.43 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 1.08 0.00 0.00 0.19 0.00 0.00 167 T 7.10 3.34 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 0.67 0.00 0.00 168 G 7.80 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.10 3.39 0.97 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 0.00 170 A 6.51 3.85 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 D 7.72 4.39 0.00 2.72 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 R 7.70 3.99 0.00 1.58 1.94 0.00 3.07 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 173 F 8.21 4.75 0.00 3.15 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 0.00 174 F 8.84 4.05 0.00 3.37 3.24 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 0.00 175 S 8.71 4.17 0.00 4.16 3.96 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 0.00 0.00 0.00 0.00 176 A 8.24 3.86 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 0.00 177 R 8.19 3.69 0.00 1.86 1.96 0.00 2.96 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 1.47 1.51 0.00 178 L 7.74 3.78 0.00 1.34 1.55 0.86 0.73 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 0.00 179 V 7.97 3.58 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 1.14 0.00 0.00 0.95 0.00 0.00 180 L 7.91 3.52 0.00 1.50 1.45 0.65 -0.70 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 0.00 181 K 7.76 3.87 0.00 1.79 1.96 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.26 1.39 7.81 182 H 8.06 4.56 0.00 3.20 3.36 0.00 5.65 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 C 8.48 4.83 0.00 3.32 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 0.00 184 F 7.78 4.88 0.00 3.00 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 0.00 185 D 8.56 4.50 0.00 2.71 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 0.00 186 Q 8.38 4.38 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.27 0.00 187 D 7.48 4.91 0.00 2.84 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 0.00 188 T 8.57 3.85 4.25 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 1.21 0.00 0.00 189 L 7.97 3.99 0.00 1.88 1.75 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 190 T 8.55 3.87 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 1.16 0.00 0.00 191 E 8.10 3.92 0.00 2.06 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 2.31 2.36 0.00 192 Q 8.41 3.98 0.00 2.26 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 193 L 8.03 3.97 0.00 1.86 1.78 0.88 0.53 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 0.00 194 R 7.78 3.88 0.00 1.80 2.11 0.00 3.25 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.68 0.00 195 D 8.29 4.18 0.00 2.91 2.55 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 0.00 196 S 8.48 4.22 0.00 4.10 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 0.00 197 Y 7.89 4.57 0.00 3.07 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.69 3.93 0.00 1.64 1.78 0.00 2.57 0.00 0.00 2.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.89 0.00 199 E 8.05 4.01 0.00 1.98 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 2.37 2.30 0.00 200 H 8.34 4.18 0.00 3.43 3.76 0.00 5.78 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 0.00 201 T 8.28 3.89 4.48 0.00 0.00 0.00 0.00 0.00 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 0.00 202 V 7.71 3.60 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 0.85 0.00 0.00 0.96 0.00 0.00 203 D 8.14 4.51 0.00 2.92 2.74 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 0.00 204 F 8.55 3.95 0.00 3.25 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 0.00 205 I 7.60 3.80 2.02 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 1.35 0.97 0.87 0.00 0.00 *207 A 8.00 4.22 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 0.00 208 G 8.23 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 0.00 209 I 7.38 4.11 1.73 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 1.28 0.79 0.00 0.00 210 L 7.82 4.61 0.00 1.71 1.65 0.97 0.96 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 0.00 211 A 8.79 4.29 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 * Residues marked with a * may have inaccurate shift predictions.