NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.5193 8.1185 122.4866 51.9744 19.3441 176.3533 2 A 4.0146 7.8333 124.9964 50.3263 20.1640 176.8707 3 T 4.5828 8.5026 118.4080 63.0614 68.0950 172.4291 4 S 4.4582 8.8339 121.8929 58.9682 64.2499 174.0768 5 R 4.4212 7.9345 122.1387 54.7170 30.8574 177.0170 6 T 3.7591 8.5981 114.3130 64.8331 68.6566 176.1728 7 E 3.9726 8.0226 119.7150 58.3660 29.7989 177.6184 8 R 4.3121 7.9183 116.8905 56.2608 30.7158 175.9739 9 I 4.2513 7.1470 120.0183 59.7362 38.1675 175.6697 10 W 4.2183 9.0256 125.4389 55.6817 29.2640 174.2780 11 P 4.4663 0.0000 0.0000 64.0372 31.2212 177.3168 12 G 3.8937 9.3923 109.8461 45.5349 0.0000 174.1435 13 G 3.8837 8.4306 107.0444 45.7117 0.0000 172.9664 14 V 4.4951 7.4469 119.5937 61.0054 33.2095 175.3878 15 I 3.6924 8.1159 128.6975 58.5494 39.3297 173.2651 16 P 5.1022 0.0000 0.0000 62.5750 32.7691 175.2540 17 Y 5.6057 8.5918 119.8650 55.6221 42.3132 173.9332 18 V 4.7577 9.2865 119.7459 61.3226 35.1222 174.0348 19 I 4.9561 8.7241 128.1978 59.3510 38.5256 175.6150 20 G 4.2817 8.4074 113.2160 46.0154 0.0000 174.4393 21 G 4.0496 8.9703 110.7104 46.7340 0.0000 174.2107 21A N 4.4661 7.8961 117.1868 54.2236 38.1358 175.3400 22 F 4.3503 7.3830 117.0904 57.0572 39.7679 175.9785 23 T 4.2806 8.4199 114.7103 61.2564 70.8151 175.6156 24 G 3.7255 8.6573 108.3085 48.2337 0.0000 175.8278 25 S 4.0199 7.8832 114.6285 61.2319 62.4676 176.1378 26 Q 3.5561 7.9311 120.6866 58.7980 28.4197 178.8202 27 R 3.4868 8.0163 119.1834 59.1821 30.0178 179.0126 28 A 3.9186 7.8860 120.4018 55.1560 18.2444 179.3940 29 M 3.9312 7.7763 116.7656 58.7715 32.2521 178.3700 30 F 4.3113 7.6731 118.1074 60.6856 38.9550 177.8699 31 K 3.7719 7.9587 117.9720 59.3638 31.7964 179.4066 32 Q 4.0608 8.4343 118.4846 58.9488 28.4692 178.8454 33 A 3.8957 8.3991 121.8752 55.3462 18.4430 179.5087 34 M 3.5673 8.0445 117.3671 58.5140 31.8552 179.0163 35 R 4.0109 8.4579 119.1589 59.6385 29.9701 177.9861 36 H 4.2647 8.3372 117.4568 59.0837 29.6231 177.0508 37 W 4.2555 8.1265 120.7726 59.7356 28.8496 178.3821 38 E 4.4380 8.5064 119.9537 58.9578 28.7523 179.4124 39 K 4.0074 8.3304 118.5425 58.9447 32.3035 177.4742 40 H 4.8741 7.6996 113.0010 56.1228 29.6662 173.8936 41 T 4.7241 7.8520 109.7744 60.8747 71.6369 171.3305 42 C 4.7536 8.7022 115.5487 55.4956 38.2453 173.1900 43 V 4.0107 7.5764 121.1542 63.1979 32.4768 174.9466 44 T 4.7791 8.5334 123.6183 61.7964 72.1411 172.6832 45 F 5.1461 9.6761 125.5116 56.2467 40.5382 175.5085 46 I 4.8273 8.5901 123.5415 59.0286 41.1876 174.8557 47 E 3.4602 8.6069 124.9430 56.1290 29.8373 176.9981 48 R 3.7073 8.1889 125.3454 56.9508 30.2354 174.8682 49 S 4.5143 9.5725 118.8974 58.7045 65.3793 174.0410 50 D 4.8139 7.5630 119.0729 51.4501 40.6661 175.8280 51 E 4.1634 7.9651 119.4038 56.6938 30.3998 176.6993 52 E 4.2266 8.9768 123.2045 58.3897 30.1840 176.3630 53 S 5.0939 7.9708 114.0261 56.1345 65.1525 173.2496 54 Y 5.0999 8.0390 120.7466 56.6459 40.9404 172.6334 55 I 4.9250 8.6221 113.8159 59.5329 40.4312 174.8017 56 V 5.0310 8.3889 123.5045 61.2818 34.6591 174.3102 57 F 4.6627 9.3829 127.2531 57.4294 40.2426 174.6232 58 T 5.0977 8.8777 119.6848 61.1897 70.9166 174.6302 *59 Y 4.7136 8.9106 125.9754 57.7457 38.2519 175.8380 60 R 3.9792 8.4159 117.6798 59.6612 28.2804 182.6566 *65 C 4.7960 8.8955 108.4001 59.7877 30.1401 173.7732 66 S 4.2139 9.2678 117.0334 58.1114 62.5558 173.5923 67 Y 3.7807 8.4319 125.6672 58.1134 38.8537 175.9638 68 V 3.7510 6.7582 125.4298 62.2043 32.0638 176.6641 69 G 3.9746 8.6488 118.1860 44.6084 0.0000 171.5069 70 R 3.4556 7.7910 120.4993 55.0111 29.8524 177.0634 71 R 3.4791 8.6807 127.5595 57.4921 30.1145 177.8778 72 G 3.7766 7.3725 100.4736 45.6993 0.0000 171.6578 72A N 4.5298 8.3535 111.5871 50.5507 36.2126 174.8853 73 G 4.2056 6.9940 105.3654 42.7120 0.0000 171.1311 74 P 4.3410 0.0000 0.0000 62.5096 32.2224 175.8196 75 Q 4.5369 8.5288 117.5249 54.3270 32.1120 174.1161 76 A 4.5783 8.5682 123.1862 51.7667 20.1653 177.1009 77 I 3.9721 8.5317 124.5847 60.1810 39.3092 174.7659 78 S 4.8111 8.3491 128.0966 56.7346 61.9594 171.6949 79 I 3.9037 8.0164 127.4231 61.0387 38.4002 176.5070 *83 N 4.8193 8.6189 119.1767 53.2720 40.0817 174.4556 84 C 4.6442 7.9266 115.4273 60.3854 28.7270 173.0901 85 D 5.0423 8.0901 115.6091 54.4623 41.6585 176.0613 86 K 4.7847 7.7610 115.3170 53.3271 36.5593 175.8714 87 F 4.2482 8.9511 123.6383 61.9700 39.2809 178.0318 88 G 4.0503 8.2116 105.7105 47.2047 0.0000 175.5549 89 I 3.7526 7.6914 121.6664 64.3337 37.1794 178.5037 90 V 3.6337 7.8345 119.1900 65.8587 31.3396 178.1862 91 V 3.6864 7.8125 118.4025 66.1196 31.3675 177.4915 92 H 4.1787 8.3155 117.9363 59.4572 29.7900 177.1338 93 E 4.0877 8.4192 120.3581 59.4860 29.2399 179.3783 94 L 4.0066 8.5431 119.5902 57.4932 41.5783 179.7430 95 G 3.5972 8.3545 105.9109 48.0069 0.0000 175.2840 96 H 4.5392 7.8713 119.6607 58.0800 28.8808 177.6822 97 V 3.6875 7.7185 119.7765 66.5485 31.0523 178.2339 98 I 3.9008 7.4879 117.8727 63.2220 37.0405 175.4830 99 G 3.0052 7.3063 109.8008 44.7716 0.0000 171.8579 100 F 5.1337 7.9962 120.7378 55.3672 41.0957 176.3407 101 W 4.8870 9.0482 124.4382 55.8837 30.9404 175.6062 102 H 4.5205 8.7168 117.5120 56.0559 28.7998 176.8828 103 E 3.7617 8.9913 124.1054 59.5352 29.5380 178.2836 104 H 5.1086 8.1387 110.9086 56.5950 29.0543 175.4876 105 T 4.2818 7.6377 110.6059 61.1981 69.3531 174.7511 106 R 4.1987 7.7992 122.3195 56.3922 30.6236 175.8936 107 P 4.2443 0.0000 0.0000 65.3695 31.7332 176.8217 108 D 4.8500 8.0635 116.2588 53.1706 39.7597 178.3246 109 R 4.0105 8.1824 119.9038 59.6687 29.0899 178.1671 110 D 4.5902 8.0239 118.0327 56.4648 40.9400 177.1748 111 N 4.5438 7.7790 115.4642 54.7344 38.9569 175.0623 112 H 4.9180 8.2315 115.8968 55.8920 32.2976 173.6966 113 V 5.0247 7.6200 108.3872 59.9767 36.1094 174.8705 114 T 4.6498 8.8227 119.1843 61.9923 70.9040 173.6889 115 I 4.4811 8.4261 127.1776 60.8372 38.6203 176.4394 116 I 4.1453 8.4006 129.1292 59.5660 36.2288 176.4952 117 R 3.7946 8.3519 126.1937 59.0974 30.3529 179.1191 118 E 4.0628 8.0785 115.4597 58.5702 29.6769 177.1231 119 N 4.7102 8.1157 115.3750 53.1570 39.1691 174.5185 120 I 4.3863 7.2974 120.4528 60.4969 38.2325 176.0266 121 Q 4.0635 9.1776 125.9203 55.9718 29.6395 174.7016 122 P 4.7565 0.0000 0.0000 63.8217 31.5203 176.9611 123 G 4.0134 9.6799 112.8942 45.7991 0.0000 174.4545 124 Q 4.3354 8.0624 117.6707 55.8000 28.9828 177.0858 125 E 4.1626 8.1417 121.8030 59.3845 29.4293 178.3899 126 Y 4.2500 8.2600 117.4402 60.0230 37.6702 177.7534 127 N 4.1906 7.0034 116.5399 54.5240 38.5731 175.3677 128 F 4.7863 7.8791 117.7218 56.8679 40.0246 175.8398 129 L 4.2718 7.5772 121.2213 54.2121 42.0280 177.1169 130 K 4.3167 8.3237 121.2613 56.5869 32.7020 176.9769 131 M 4.0209 8.6625 124.0360 55.0269 32.6904 176.4146 132 E 4.1112 8.5130 121.5472 55.7875 30.6979 176.5410 132A P 4.1443 0.0000 0.0000 65.7049 31.5278 178.6548 132B G 3.7340 8.0138 106.4528 47.4710 0.0000 173.4903 133 E 4.4706 8.2311 118.7737 56.3356 31.2234 175.8468 134 V 4.8787 7.3953 118.2673 60.8555 34.3765 174.3178 135 N 4.9169 8.7901 126.3385 51.9163 40.3153 174.4006 136 S 4.2926 8.8626 122.7522 59.1388 63.2825 175.3244 137 L 3.5958 9.2046 119.6312 55.7214 39.1692 175.7905 138 G 3.9908 8.4851 105.6538 45.4616 0.0000 174.2867 139 E 4.2761 7.9687 119.9395 55.3278 30.2278 177.0840 140 R 4.1152 8.3480 119.4850 55.6853 30.5432 175.7805 141 Y 3.6461 8.4726 120.2345 58.2999 38.8706 174.9186 142 D 4.6693 7.8857 126.5348 52.0905 41.2819 176.3433 143 F 4.2839 8.6475 125.7662 60.0215 39.1566 176.0531 144 D 4.6724 8.0923 117.6863 53.9495 41.4226 176.2446 145 S 4.3422 7.7980 113.7474 58.9332 62.7515 174.8531 146 I 3.8363 8.9121 127.1170 63.4354 38.0068 176.2883 147 M 4.4190 8.2763 119.1563 55.7011 32.3306 174.7567 148 H 4.8480 8.0315 120.8574 54.9226 30.8722 174.5179 149 Y 4.4932 8.4794 123.8812 58.0240 38.2838 175.7076 150 A 4.6464 8.1992 125.1529 51.3013 19.5352 179.1254 151 R 4.2558 8.6070 115.3358 58.5647 29.8078 177.7845 152 N 5.1810 7.9450 115.0669 52.4307 37.9672 173.8783 153 T 3.8475 7.6343 115.5238 65.6153 68.9119 173.9907 154 F 4.0465 8.3586 122.2104 58.4117 36.8325 175.0088 155 S 4.7261 7.9087 114.9380 58.1951 62.5401 174.4588 156 R 4.1566 8.8089 122.7875 56.9546 29.6949 175.8561 157 G 3.7463 7.9834 109.7222 46.2552 0.0000 172.8557 157 M 4.2663 7.9334 120.5222 56.5552 35.9427 174.2557 160 F 4.2733 8.4561 120.0921 56.9696 37.3092 174.8574 161 L 4.4602 7.3080 121.1037 53.4695 41.8236 176.0348 162 D 4.8294 8.5907 124.4068 54.2460 41.8555 176.4737 163 T 4.3734 8.8714 112.4576 62.2385 70.9105 174.3386 164 I 5.0410 7.8174 122.0700 59.3373 40.8394 174.5587 165 L 4.6641 8.9716 129.4135 52.5009 43.8276 173.8198 166 P 4.9687 0.0000 0.0000 62.2999 32.1061 176.6871 167 S 4.3131 9.0101 118.6356 58.1821 63.0714 174.3499 168 R 4.1388 8.4361 125.1178 56.0309 30.6077 176.6115 168A D 4.7133 8.5829 121.9481 52.4615 40.7552 176.8147 168B D 4.3450 8.4967 117.9431 56.9759 40.7336 177.2071 168C N 4.5353 8.3089 114.7183 53.0299 38.8047 175.7385 168D G 3.8678 8.2997 106.7862 45.7191 0.0000 173.2993 169 I 4.2376 7.9664 121.1992 59.3749 38.3883 175.2309 170 R 4.2601 8.3460 124.7239 54.6350 30.5339 174.8780 171 P 4.1992 0.0000 0.0000 61.9634 31.9593 176.2361 172 A 4.2099 8.3161 124.6315 52.1676 19.0020 177.0855 173 I 4.7959 8.1943 113.8491 60.1840 40.6700 175.5547 174 G 4.2384 9.0807 110.0697 45.0933 0.0000 173.7065 175 Q 4.1740 7.8452 116.9511 56.3899 29.5857 176.5226 176 R 4.6275 8.1142 118.0295 55.8446 31.1236 176.8857 176 T 4.6375 8.0342 111.1295 61.6446 70.0236 175.2856 181 R 4.5660 7.8730 114.7481 54.6178 32.3246 174.3737 182 L 3.7526 8.5759 119.3883 54.9480 42.1710 178.3083 183 S 4.4137 8.4227 117.6964 57.5393 65.4795 175.4263 184 K 3.9468 8.5484 121.8181 59.7697 31.7704 179.8254 185 G 3.6571 7.8657 106.6944 47.1364 0.0000 175.3807 186 D 4.1595 8.1966 121.5119 57.1183 40.8047 178.9086 187 I 3.6817 7.5815 119.9513 64.4690 37.1627 178.4359 188 A 4.0588 8.1221 121.5963 55.2027 18.0926 179.4906 189 Q 4.0658 8.4121 117.9791 59.1918 29.1668 178.1407 190 A 4.4760 8.6342 122.1459 55.3078 18.2521 179.7749 191 R 4.0445 8.1741 115.9228 59.3976 30.5297 179.1802 192 K 4.1830 8.0970 117.8766 59.3753 31.8774 179.0795 193 L 3.9215 8.1607 119.7154 57.9088 42.0315 177.7152 194 Y 4.1165 7.9598 113.3026 56.3707 38.5397 175.5973 195 R 3.6429 7.7170 118.5021 57.3587 28.3644 175.2677 *198 C 4.6774 8.0662 111.7436 55.8914 41.7924 172.8120 199 P 4.4693 0.0000 0.0000 62.4865 31.6361 176.2648 200 A 4.1747 8.4831 121.8805 52.6890 18.2793 177.4843 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 1 A 8.12 4.52 1.47 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 0.00 0.00 2 A 7.83 4.01 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 3 T 8.50 4.58 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 1.09 0.00 0.00 4 S 8.83 4.46 0.00 3.91 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 5 R 7.93 4.42 0.00 1.86 1.88 0.00 3.29 0.00 0.00 3.20 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.71 0.00 6 T 8.60 3.76 4.17 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 1.15 0.00 0.00 7 E 8.02 3.97 0.00 1.92 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 2.25 2.28 0.00 8 R 7.92 4.31 0.00 1.93 1.82 0.00 3.09 0.00 0.00 3.30 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 9 I 7.15 4.25 1.78 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.47 0.30 0.00 0.00 10 W 9.03 4.22 0.00 3.53 3.36 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 11 P 0.00 4.47 0.00 2.23 2.01 0.00 3.81 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.08 0.00 12 G 9.39 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 13 G 8.43 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 14 V 7.45 4.50 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 0.77 0.00 0.00 0.98 0.00 0.00 15 I 8.12 3.69 0.82 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.25 -0.15 -0.11 0.00 0.00 16 P 0.00 5.10 0.00 2.18 1.95 0.00 3.50 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.14 0.00 17 Y 8.59 5.61 0.00 3.23 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 V 9.29 4.76 2.34 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 1.08 0.00 0.00 0.77 0.00 0.00 19 I 8.72 4.96 2.02 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.89 1.08 0.00 0.00 20 G 8.41 4.28 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 0.00 21 G 8.97 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 0.00 0.00 0.00 21A N 7.90 4.47 0.00 2.63 2.94 0.00 0.00 6.27 8.12 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 22 F 7.38 4.35 0.00 3.21 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 T 8.42 4.28 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 1.22 0.00 0.00 24 G 8.66 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 0.00 0.00 0.00 25 S 7.88 4.02 0.00 3.85 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 26 Q 7.93 3.56 0.00 2.16 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.56 0.00 0.00 0.00 0.00 0.00 2.44 2.34 0.00 27 R 8.02 3.49 0.00 1.87 1.90 0.00 3.16 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 28 A 7.89 3.92 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 29 M 7.78 3.93 0.00 1.93 2.02 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.85 0.00 30 F 7.67 4.31 0.00 2.62 1.86 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 31 K 7.96 3.77 0.00 1.88 1.79 0.00 1.62 0.00 0.00 1.64 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.42 7.81 32 Q 8.43 4.06 0.00 2.38 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.53 2.48 0.00 33 A 8.40 3.90 1.27 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 0.00 0.00 0.00 34 M 8.04 3.57 0.00 1.31 1.83 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 1.07 0.00 35 R 8.46 4.01 0.00 1.97 2.17 0.00 3.30 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.74 0.00 36 H 8.34 4.26 0.00 3.54 3.51 0.00 5.83 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 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45 F 9.68 5.15 0.00 2.99 3.08 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 46 I 8.59 4.83 1.86 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.00 0.87 0.00 0.00 47 E 8.61 3.46 0.00 1.67 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 1.91 2.12 0.00 48 R 8.19 3.71 0.00 1.48 1.48 0.00 2.21 0.00 0.00 2.67 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.22 0.00 49 S 9.57 4.51 0.00 3.89 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 D 7.56 4.81 0.00 2.73 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 51 E 7.97 4.16 0.00 2.04 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 52 E 8.98 4.23 0.00 2.05 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.37 0.00 53 S 7.97 5.09 0.00 3.80 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 8.04 5.10 0.00 3.11 3.08 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 55 I 8.62 4.92 1.68 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.69 0.87 0.00 0.00 56 V 8.39 5.03 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 1.25 0.00 0.00 1.17 0.00 0.00 57 F 9.38 4.66 0.00 2.75 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 T 8.88 5.10 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 1.27 0.00 0.00 *59 Y 8.91 4.71 0.00 2.37 2.17 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 60 R 8.42 3.98 0.00 1.84 1.61 0.00 3.27 0.00 0.00 3.22 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.49 0.00 *65 C 8.90 4.80 0.00 3.07 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 66 S 9.27 4.21 0.00 3.76 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 67 Y 8.43 3.78 0.00 2.90 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 V 6.76 3.75 0.67 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 -0.18 0.00 0.00 -0.30 0.00 0.00 69 G 8.65 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 70 R 7.79 3.46 0.00 0.67 1.07 0.00 2.43 0.00 0.00 2.63 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.50 0.00 71 R 8.68 3.48 0.00 0.67 1.37 0.00 3.00 0.00 0.00 2.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.03 0.00 72 G 7.37 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72A N 8.35 4.53 0.00 2.76 2.83 0.00 0.00 7.23 7.65 0.00 0.00 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 G 6.99 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 0.00 0.00 0.00 0.00 74 P 0.00 4.34 0.00 1.73 0.92 0.00 3.59 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 1.83 1.84 0.00 75 Q 8.53 4.54 0.00 1.97 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.02 0.00 0.00 0.00 0.00 0.00 2.44 2.32 0.00 76 A 8.57 4.58 1.22 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 0.00 0.00 77 I 8.53 3.97 1.48 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 1.21 -0.34 0.00 0.00 78 S 8.35 4.81 0.00 3.43 3.67 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 79 I 8.02 3.90 2.17 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.17 1.17 0.00 0.00 *83 N 8.62 4.82 0.00 2.75 2.91 0.00 0.00 6.91 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 C 7.93 4.64 0.00 3.01 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 85 D 8.09 5.04 0.00 2.68 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 K 7.76 4.78 0.00 1.85 1.72 0.00 1.77 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.48 7.81 87 F 8.95 4.25 0.00 2.98 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 G 8.21 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 0.00 0.00 0.00 89 I 7.69 3.75 2.05 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.72 0.97 0.00 0.00 90 V 7.83 3.63 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.18 0.00 0.00 91 V 7.81 3.69 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 0.66 0.00 0.00 0.02 0.00 0.00 92 H 8.32 4.18 0.00 3.34 3.52 0.00 5.84 0.00 0.00 0.00 0.00 6.92 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0.00 0.00 0.00 0.00 101 W 9.05 4.89 0.00 3.17 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 0.00 102 H 8.72 4.52 0.00 2.83 2.92 0.00 5.65 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 E 8.99 3.76 0.00 1.90 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.47 0.00 104 H 8.14 5.11 0.00 3.40 3.30 0.00 5.17 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 0.00 105 T 7.64 4.28 4.17 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 0.88 0.00 0.00 106 R 7.80 4.20 0.00 2.07 2.21 0.00 3.07 0.00 0.00 2.97 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 107 P 0.00 4.24 0.00 2.03 2.11 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 2.00 2.20 0.00 108 D 8.06 4.85 0.00 2.87 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 0.00 109 R 8.18 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0.00 0.00 3.34 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.62 0.00 118 E 8.08 4.06 0.00 1.94 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 2.30 2.32 0.00 119 N 8.12 4.71 0.00 2.94 2.81 0.00 0.00 6.85 6.50 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 0.00 120 I 7.30 4.39 1.83 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.09 0.88 0.00 0.00 121 Q 9.18 4.06 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.92 0.00 0.00 0.00 0.00 0.00 2.46 2.60 0.00 122 P 0.00 4.76 0.00 1.95 2.03 0.00 3.75 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.97 0.00 123 G 9.68 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 0.00 124 Q 8.06 4.34 0.00 2.08 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.74 0.00 0.00 0.00 0.00 0.00 2.29 2.65 0.00 125 E 8.14 4.16 0.00 2.13 2.06 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 2.40 2.40 0.00 126 Y 8.26 4.25 0.00 3.22 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 0.00 127 N 7.00 4.19 0.00 2.36 2.64 0.00 0.00 6.85 7.40 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 0.00 128 F 7.88 4.79 0.00 3.10 3.15 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 0.00 129 L 7.58 4.27 0.00 1.62 1.60 0.99 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 130 K 8.32 4.32 0.00 1.61 1.70 0.00 1.74 0.00 0.00 1.87 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.49 7.81 131 M 8.66 4.02 0.00 1.46 1.77 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.46 0.00 132 E 8.51 4.11 0.00 1.77 1.79 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 2.29 2.18 0.00 132A P 0.00 4.14 0.00 2.19 2.29 0.00 3.65 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.94 0.00 132B G 8.01 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 0.00 0.00 0.00 133 E 8.23 4.47 0.00 1.75 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 134 V 7.40 4.88 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 0.80 0.00 0.00 0.86 0.00 0.00 135 N 8.79 4.92 0.00 2.73 2.67 0.00 0.00 7.27 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 S 8.86 4.29 0.00 3.96 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 0.00 137 L 9.20 3.60 0.00 1.84 1.80 0.98 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 138 G 8.49 3.99 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 0.00 0.00 0.00 139 E 7.97 4.28 0.00 2.16 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 140 R 8.35 4.12 0.00 1.97 1.98 0.00 3.11 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 141 Y 8.47 3.65 0.00 2.66 2.29 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 0.00 142 D 7.89 4.67 0.00 2.64 2.47 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 0.00 143 F 8.65 4.28 0.00 3.13 3.12 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 0.00 144 D 8.09 4.67 0.00 2.73 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 0.00 145 S 7.80 4.34 0.00 3.95 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 0.00 146 I 8.91 3.84 1.76 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.84 0.89 0.00 0.00 147 M 8.28 4.42 0.00 2.20 2.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.47 0.00 148 H 8.03 4.85 0.00 3.27 3.24 0.00 5.59 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 0.00 149 Y 8.48 4.49 0.00 2.86 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 0.00 150 A 8.20 4.65 1.27 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 0.00 0.00 0.00 151 R 8.61 4.26 0.00 2.07 2.28 0.00 2.95 0.00 0.00 3.44 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.77 0.00 152 N 7.95 5.18 0.00 2.85 3.03 0.00 0.00 6.29 7.22 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 0.00 153 T 7.63 3.85 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 -0.05 0.00 0.00 154 F 8.36 4.05 0.00 3.65 3.19 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.91 4.73 0.00 3.95 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 R 8.81 4.16 0.00 1.96 2.05 0.00 3.14 0.00 0.00 3.27 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.58 0.00 157 G 7.98 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.93 4.27 0.00 1.86 1.81 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 160 F 8.46 4.27 0.00 3.24 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 0.00 161 L 7.31 4.46 0.00 1.77 1.64 0.93 1.10 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 0.00 162 D 8.59 4.83 0.00 2.70 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 0.00 163 T 8.87 4.37 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 1.17 0.00 0.00 164 I 7.82 5.04 2.09 0.00 0.00 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 1.54 1.06 1.15 0.00 0.00 165 L 8.97 4.66 0.00 1.75 1.56 0.94 1.13 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 0.00 166 P 0.00 4.97 0.00 1.86 1.99 0.00 3.77 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.24 0.00 167 S 9.01 4.31 0.00 3.92 3.86 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 0.00 168 R 8.44 4.14 0.00 1.82 1.81 0.00 3.24 0.00 0.00 3.30 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.59 0.00 168A D 8.58 4.71 0.00 2.89 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168B D 8.50 4.34 0.00 2.69 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168C N 8.31 4.54 0.00 2.85 2.83 0.00 0.00 6.99 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168D G 8.30 3.87 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 0.00 0.00 0.00 169 I 7.97 4.24 1.98 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 1.27 0.66 0.86 0.00 0.00 170 R 8.35 4.26 0.00 1.74 1.80 0.00 3.19 0.00 0.00 3.40 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 171 P 0.00 4.20 0.00 1.43 1.70 0.00 3.14 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 0.49 1.58 0.00 172 A 8.32 4.21 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 I 8.19 4.80 2.07 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.87 1.08 0.00 0.00 174 G 9.08 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 0.00 0.00 0.00 0.00 175 Q 7.85 4.17 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.48 7.44 0.00 0.00 0.00 0.00 0.00 2.53 2.47 0.00 176 R 8.11 4.63 0.00 1.81 1.88 0.00 3.47 0.00 0.00 3.42 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.51 0.00 176 T 8.03 4.64 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 181 R 7.87 4.57 0.00 1.97 1.93 0.00 3.25 0.00 0.00 3.39 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.70 0.00 182 L 8.58 3.75 0.00 1.26 1.21 -0.15 -0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 183 S 8.42 4.41 0.00 4.04 4.11 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 0.00 0.00 0.00 184 K 8.55 3.95 0.00 1.80 1.89 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.50 1.49 7.81 185 G 7.87 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 0.00 186 D 8.20 4.16 0.00 2.61 2.40 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 0.00 187 I 7.58 3.68 1.95 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 1.28 0.59 0.98 0.00 0.00 188 A 8.12 4.06 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 0.00 189 Q 8.41 4.07 0.00 2.33 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.73 2.53 0.00 190 A 8.63 4.48 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 0.00 0.00 0.00 0.00 0.00 191 R 8.17 4.04 0.00 2.07 2.09 0.00 3.30 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.92 0.00 192 K 8.10 4.18 0.00 2.04 1.90 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.64 7.81 193 L 8.16 3.92 0.00 1.73 2.02 0.71 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 194 Y 7.96 4.12 0.00 3.20 3.05 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 0.00 195 R 7.72 3.64 0.00 2.05 1.97 0.00 3.14 0.00 0.00 3.14 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 *198 C 8.07 4.68 0.00 3.06 3.12 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 0.00 199 P 0.00 4.47 0.00 2.20 2.08 0.00 3.81 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 2.01 1.99 0.00 200 A 8.48 4.17 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.