NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.4900 8.0427 122.7572 54.8220 44.1994 174.8665 2 K 4.7985 9.3404 127.1061 54.3397 34.8172 173.0586 3 I 5.1650 8.9537 130.3318 59.5731 40.7060 174.2207 4 A 4.9268 8.6038 126.2686 50.0787 23.1497 174.4955 5 A 5.0314 8.8383 121.2848 50.0322 22.1641 175.2774 6 F 5.2926 9.6255 124.7981 56.5716 42.8907 172.9306 7 N 4.8780 9.3149 125.4693 52.5564 39.5459 174.3523 8 I 3.8527 7.6327 128.5652 58.9888 38.1177 176.0261 9 R 3.8566 8.2340 127.7937 58.4666 30.6273 176.8477 10 T 3.4674 9.0897 123.6035 64.4290 66.7522 173.0649 11 F 4.0645 8.1895 123.1919 58.6174 40.5454 174.2548 12 G 3.5232 7.2595 115.4484 44.4445 0.0000 172.5091 13 E 3.7792 8.5666 118.0984 59.9029 29.1892 179.1976 14 T 3.8246 7.7399 113.4743 66.5901 68.9366 175.9969 15 K 4.0057 7.7621 120.6347 59.8794 32.1596 178.5375 16 M 4.0883 7.9411 117.1418 57.5576 31.9079 178.1227 17 S 4.5476 7.5690 114.1556 58.5237 63.5083 173.3514 18 N 4.6438 7.6617 121.2008 51.9217 39.0647 175.2648 19 A 4.2230 8.6415 128.9163 55.5123 18.0745 179.1532 20 T 3.8666 7.9864 113.8510 66.7347 68.6300 176.8111 21 L 4.0973 8.1088 120.1770 57.8250 41.6564 179.2814 22 A 3.8083 8.4571 121.0642 55.0915 18.2831 179.6286 23 S 3.8429 7.9767 111.4642 61.8217 62.4137 176.1202 24 Y 3.8914 7.5873 118.8332 60.8322 37.5778 178.4481 25 I 3.7716 7.8549 120.8913 64.3815 37.1696 178.4517 26 V 3.4777 7.7548 119.0883 65.9685 31.0632 177.6594 27 R 3.8241 7.4410 116.4413 59.6735 30.2694 177.9602 28 I 3.9055 8.0440 119.3522 64.5445 37.1394 178.3938 29 V 3.7492 7.8592 118.7422 66.3294 31.1538 178.0831 30 R 4.4955 7.9383 116.8813 57.8134 29.9300 178.5512 31 R 3.8137 7.4123 117.0268 56.8805 30.2360 175.8022 32 Y 4.9890 7.0062 115.7071 56.0757 41.4124 175.2997 33 D 4.7156 9.2897 122.4347 56.4996 42.6065 176.7851 34 I 5.4543 7.8742 118.7243 59.4091 41.2678 175.0714 35 V 4.9289 9.4878 126.1483 59.9199 35.0447 173.9541 36 L 4.5882 8.7737 126.8801 53.6985 43.5843 174.8234 37 I 4.8053 9.2003 128.4817 59.7116 39.7701 174.9739 38 Q 4.7859 8.7851 125.0884 53.8688 33.2857 174.4576 39 E 3.9856 8.3927 116.3787 57.0987 27.5917 174.8378 40 V 4.2426 7.1905 118.8679 62.2185 30.9660 174.5555 41 R 4.5296 8.6277 128.9506 54.4657 28.9694 175.7259 42 D 4.7154 7.6392 120.3360 52.7240 42.5589 175.5047 43 S 4.0366 8.3526 119.4680 60.7869 63.2111 175.2366 44 H 4.7486 8.0557 114.7829 54.9231 29.1894 174.5976 45 L 4.2340 7.8792 117.7540 56.0533 40.0035 177.1832 46 V 3.5628 7.5659 119.9233 66.1068 31.4257 177.8035 47 A 3.8841 8.8293 120.9904 55.0912 18.1734 179.6714 48 V 3.7703 8.4608 117.0422 66.2428 31.6690 178.5671 49 G 3.5744 8.0629 105.1833 47.6615 0.0000 175.8902 50 K 4.2333 8.2351 120.9174 59.1252 32.0181 179.2565 51 L 4.0349 8.0945 120.6884 58.2596 42.1216 179.0932 52 L 4.0039 7.9558 118.8994 57.5205 41.1994 179.1588 53 D 4.3558 7.7192 118.1605 57.6535 40.5976 178.0069 54 Y 4.2149 7.9481 116.4624 61.2758 37.7391 178.9207 55 L 4.1581 8.0577 118.3577 57.2622 41.8407 178.4632 56 N 5.3604 8.3338 115.8853 52.2689 38.6776 176.9199 57 Q 3.9654 7.7423 120.4699 58.5323 28.7229 177.0635 58 D 4.7596 8.0290 116.4623 54.6226 42.8412 176.0298 59 D 4.7002 7.7361 118.4067 51.7650 44.0868 174.1334 60 P 4.4898 0.0000 0.0000 64.8556 31.5552 176.4281 61 N 5.0872 8.4005 117.1375 53.3135 39.3753 176.5742 62 T 3.9590 8.3980 116.0921 66.4334 69.0896 173.8971 63 Y 4.8600 8.9989 118.5969 56.4700 42.1270 174.5032 64 H 5.5206 8.5984 120.3028 54.5349 32.4408 172.3523 65 Y 6.1544 8.0261 115.9929 56.7265 41.0925 174.1981 66 V 4.6012 8.8609 119.1434 61.1096 34.8129 174.3092 67 V 5.2190 8.5530 126.7444 60.0166 34.2628 175.6344 68 S 4.7064 8.7839 118.6715 57.4727 64.8358 173.2464 69 E 4.3560 8.5839 119.3071 55.2267 30.4194 175.3819 70 P 4.3960 0.0000 0.0000 62.9631 31.8473 176.0561 71 L 4.7656 9.7284 125.1446 52.0705 44.6667 176.1663 72 G 4.4807 7.9425 111.9042 46.8014 0.0000 171.9115 73 R 4.6005 8.3762 120.0151 57.6395 32.4339 176.6095 74 N 5.2476 7.6227 118.4534 52.9649 36.9010 177.5511 75 S 4.6104 8.7984 121.7847 59.7445 64.7476 173.5152 76 Y 4.2455 8.0180 122.6237 57.3130 38.9599 175.0366 77 K 4.8093 7.9164 124.7348 54.7267 35.8436 175.2881 78 E 4.8230 8.6607 121.0020 54.9268 33.9982 174.8302 79 R 4.4435 8.7023 120.8349 54.9243 33.6980 174.6469 80 Y 4.8386 8.3945 118.6962 56.5139 39.8379 174.5531 81 L 5.2988 8.9244 126.9297 53.2866 45.1017 174.7580 82 F 5.6591 9.5812 125.5822 56.0234 41.2747 174.6069 83 L 5.6479 9.3144 124.8034 53.2923 44.2328 175.6426 84 F 5.6041 9.0073 116.4821 55.7850 42.1098 173.4604 85 R 4.5419 9.0684 120.5636 53.8422 30.3702 175.9998 86 P 4.9049 0.0000 0.0000 64.4154 31.5935 177.0523 87 N 4.5759 7.9968 115.1886 53.9756 38.0061 175.7066 88 K 4.3764 7.9619 117.7341 57.2950 33.7302 176.2534 89 V 4.8545 7.4274 116.1379 61.3304 35.7416 174.0007 90 S 4.7721 8.7775 117.6344 56.5037 66.2273 172.6997 91 V 3.7045 8.1247 125.9114 61.9913 31.4120 175.4129 92 L 4.1211 8.3603 128.9774 57.1982 42.5045 176.3074 93 D 4.4459 7.1347 115.2228 54.1487 44.5307 174.1175 94 T 5.2849 8.4274 115.2227 61.4897 70.4834 171.8400 95 Y 4.9103 8.7973 122.7385 56.2525 41.7851 172.7168 96 Q 4.7130 8.6788 122.1464 54.6420 30.5469 174.5400 97 Y 4.3152 8.9715 128.8814 57.9309 39.6027 174.9979 98 D 4.6206 8.0637 127.0445 53.1939 41.3306 175.4354 99 D 4.6498 8.5105 125.4685 52.8636 40.8375 175.1549 100 G 3.9890 8.2471 104.5416 45.2479 0.0000 168.9917 101 C 3.9020 8.6140 123.9700 56.5722 40.2713 173.2457 *104 C 4.4280 8.4708 119.8121 56.7666 41.0439 172.7203 105 G 4.0011 8.7386 109.0593 46.3226 0.0000 174.9206 106 N 4.6384 8.0371 115.5769 54.1567 39.5780 175.4694 107 D 5.1204 8.2565 116.9661 53.0989 39.6819 176.5608 108 S 4.3050 8.6417 115.7405 59.2237 63.8468 173.9254 109 F 5.1897 8.2843 119.1212 55.8449 42.9006 174.8595 110 S 4.3244 9.0245 118.3329 60.9721 62.5134 173.7720 111 R 4.8052 7.6934 119.9491 52.8805 29.8872 174.0155 112 E 3.6596 8.5775 118.0788 55.8351 30.3126 176.2977 113 P 4.4726 0.0000 0.0000 62.2815 32.6740 175.1573 114 A 4.6899 8.0811 125.2531 51.1521 20.8215 176.1602 115 V 4.7374 8.5309 120.9401 60.9703 34.9203 174.5402 116 V 4.4098 8.2919 126.7142 60.7759 34.9579 173.6719 117 K 4.3638 8.0826 129.0788 54.6658 33.7926 175.0432 118 F 4.8500 8.5359 126.0044 55.5504 42.5997 174.2965 119 S 4.9189 8.6848 116.1031 56.6133 64.7527 172.8148 120 S 4.6641 8.7830 121.6805 57.0839 64.2450 174.0322 121 H 4.5075 9.0662 125.5923 58.0278 29.0116 177.1115 122 S 4.3228 8.1642 112.4008 59.5651 63.3764 173.6579 123 T 4.7971 6.8638 107.5814 59.3397 71.1271 174.7139 124 K 4.0141 8.5885 121.0309 59.5644 32.1119 178.1620 125 V 3.8256 7.6508 117.2391 62.8871 32.0851 175.5125 126 K 5.1782 8.6090 125.0614 56.5043 33.8806 175.6987 127 E 5.2187 7.9833 120.2293 54.9005 32.7245 173.8555 128 F 5.1287 8.4575 119.7003 56.2082 41.8906 172.4633 129 A 5.2741 8.8070 121.0587 50.2683 22.4258 175.3024 130 I 5.1204 8.9645 120.9667 59.5418 40.8294 174.7566 131 V 4.6858 9.1762 126.7607 61.1634 33.6138 174.0197 132 A 4.9836 8.5261 130.1931 50.5066 21.0263 175.5648 133 L 4.6412 8.7170 123.5169 53.7978 45.7162 174.4648 134 H 5.5075 9.3978 127.6883 54.4343 30.2186 174.0547 135 S 4.7210 8.9570 120.3769 57.7834 64.4498 173.5791 136 A 4.2888 9.1489 124.2848 50.4492 19.4582 176.1957 137 P 3.6445 0.0000 0.0000 65.8120 31.4728 178.5969 138 S 4.1715 7.9981 112.0502 61.2840 62.9589 175.2848 139 D 4.8779 8.1353 118.5497 53.7125 41.5379 177.8978 140 A 3.9284 7.8427 123.4775 55.5577 18.2131 180.3337 141 V 3.3616 7.7938 115.4950 66.2216 31.5143 177.6143 142 A 3.8977 7.9314 119.6339 55.2189 17.9402 179.0098 143 E 3.5485 7.7736 116.1113 59.5367 30.1993 178.7755 144 I 3.6531 7.9802 120.1788 64.3017 37.1873 177.8986 145 N 4.3503 8.2801 117.9392 56.8730 38.7797 176.9740 146 S 4.2811 7.9751 115.9206 60.7670 62.7878 176.3104 147 L 4.1236 7.7923 121.6314 57.3033 41.0685 178.5905 148 Y 3.9891 7.8798 119.7290 60.7655 38.7332 177.7294 149 D 4.4227 8.2884 119.9679 57.0655 40.8479 178.8852 150 V 3.2432 7.5566 118.3919 65.9740 31.6720 176.8441 151 Y 4.1838 7.9835 119.4146 60.9607 38.4561 177.8796 152 L 3.8378 7.5579 120.7377 58.4341 42.1558 178.5234 153 D 4.2601 8.0588 117.6470 57.2534 41.1011 178.3885 154 V 3.3653 7.9060 118.8939 66.0473 31.5884 178.0898 155 Q 4.0349 7.9637 118.0970 59.0475 28.2521 178.8130 156 Q 3.9383 7.9866 118.5311 58.3628 28.7534 178.5791 157 K 3.8339 7.4695 118.6367 58.6556 32.4338 178.6948 158 W 4.8665 7.9621 115.9062 55.8069 29.9785 176.0313 159 H 4.7154 7.9993 113.7536 56.4960 25.4741 173.9058 160 L 4.8458 8.0483 119.4379 53.4825 44.2195 175.4498 161 N 4.8219 8.5863 120.7318 53.8550 39.8464 175.1928 162 D 4.9901 7.9988 118.0135 54.0768 40.5639 174.7227 163 V 4.9832 9.0220 122.6235 61.1371 35.6108 173.2497 164 M 5.0826 9.7523 127.7680 53.8847 34.6144 174.1193 165 L 5.2725 9.0362 126.6002 53.3913 44.1895 175.2679 166 M 4.8786 9.3533 122.8857 54.1915 36.6193 175.2058 167 G 4.2304 7.0483 108.2440 45.0133 0.0000 171.8425 168 D 5.1077 8.9346 120.8187 52.9117 39.7215 177.1604 169 F 4.8702 8.9096 124.3472 57.0991 39.5163 176.0418 170 N 4.0248 8.2580 116.6840 54.1764 36.4295 174.5673 171 A 4.5327 8.5428 117.8613 52.0094 18.5007 177.0760 172 D 4.7764 8.6914 118.6316 56.0809 45.2674 177.1678 173 C 4.0527 8.5268 119.5044 58.2336 38.9757 176.8481 174 S 3.8949 8.5508 123.8896 62.2613 62.3215 174.7093 175 Y 4.4289 7.3934 117.2898 59.6800 37.9583 175.5602 176 V 4.1266 7.5432 118.5097 61.1319 33.0285 174.6354 177 T 4.4244 8.7951 118.6644 59.9182 70.4644 176.1458 178 S 4.2996 8.8407 117.4042 62.1312 62.6440 176.9962 179 S 4.3702 8.0019 110.2977 59.3032 63.2854 174.4097 180 Q 4.2908 7.9870 120.4371 56.5227 29.4596 177.7241 181 W 4.2827 7.6932 118.2735 59.4925 29.2601 178.5840 182 S 4.2381 8.1514 113.6747 61.5017 62.3390 175.4543 183 S 4.2234 7.9945 114.5783 59.6738 63.0543 174.5214 184 I 4.4320 7.4024 122.4041 59.7532 38.0608 176.5325 185 R 3.9709 9.0415 127.4459 58.2723 29.6357 178.7318 186 L 3.9355 8.0546 118.7045 56.9495 42.1927 177.6620 187 R 4.5781 7.9468 117.1712 58.4911 31.0955 177.5374 188 T 4.1819 8.1945 109.2581 62.8552 68.9019 174.3799 189 S 4.5340 7.9807 118.3502 57.7912 62.8468 174.3115 190 S 4.6911 8.7426 120.9756 59.3528 63.0632 175.1890 191 T 3.7731 7.6973 118.8282 65.9250 68.2588 174.4395 192 F 5.1409 7.4718 117.9004 55.7444 41.0931 175.3380 193 Q 4.7785 9.1586 124.3688 54.2064 31.5545 174.2467 194 W 4.7227 9.0313 126.6122 55.5074 29.1879 176.1104 195 L 4.1879 8.7955 126.8162 57.1177 41.9322 178.0679 196 I 4.1875 7.6982 120.0906 59.2183 37.9099 173.9133 197 P 4.6491 0.0000 0.0000 61.7938 32.3573 177.0096 198 D 4.4336 8.3824 118.2543 57.2109 40.7310 177.8369 199 S 4.3856 7.9031 112.4200 58.7304 63.3317 174.1486 200 A 4.1787 7.5890 123.4737 51.6535 18.8692 176.7526 201 D 4.8716 8.5575 120.1489 53.1927 41.9944 175.6304 202 T 4.9300 8.7670 117.0377 61.5391 70.1685 173.4955 203 T 4.6510 7.6613 111.4938 60.0626 70.1171 174.5958 204 A 3.3644 8.3491 127.3032 54.5908 19.0738 178.0685 205 T 4.1434 7.4555 104.8545 60.9979 70.2933 174.2285 206 S 4.2788 8.4177 114.7683 59.9312 63.3501 174.4060 207 T 4.0776 7.1661 110.4994 61.5644 69.1672 174.1230 208 N 4.9394 8.2414 120.6072 51.6404 39.4131 173.3240 209 C 4.8912 8.0643 119.8795 54.8190 44.5028 174.4708 210 A 4.7968 9.7395 130.1732 51.2616 17.2784 176.5812 211 Y 4.8116 7.7673 121.6894 60.3747 38.8431 176.2363 212 D 5.2191 8.4243 120.3815 53.9416 42.4562 176.2934 213 R 4.6933 8.5500 121.0002 54.4893 35.4762 174.2024 214 I 4.7053 8.0197 120.2777 59.6714 40.8310 174.5294 215 V 4.6187 8.7906 127.4942 61.0174 34.3184 174.7740 216 V 5.0954 8.7230 118.7716 59.6689 36.1760 174.3600 217 A 4.8582 9.0744 124.3255 51.1004 22.9953 175.9149 218 G 4.2874 8.8978 108.7875 45.5298 0.0000 175.2138 219 S 4.1242 8.9281 120.4803 61.2542 62.8917 176.2879 220 L 3.9108 7.8291 122.7127 57.8094 42.2070 178.3559 221 L 4.0074 8.1520 120.1416 58.3758 42.2796 178.7582 222 Q 4.0104 8.4016 118.6640 59.1299 28.4181 179.2497 223 S 4.2672 8.2079 114.3704 61.0402 63.4282 176.0066 224 S 4.2202 7.9770 116.6600 59.4476 62.2215 173.8540 225 V 4.0260 6.7340 120.9761 62.8546 32.2191 175.7294 226 V 3.9463 8.5844 128.3450 61.5810 32.5974 173.4153 227 P 4.3576 0.0000 0.0000 63.7604 31.5375 176.8276 228 G 3.9230 9.0471 112.3912 45.8330 0.0000 174.1539 229 S 4.2245 7.8695 114.5459 59.7149 63.6146 174.3014 230 A 4.4898 7.9231 123.2256 52.1513 18.4414 176.5519 231 A 4.6024 8.9252 123.1476 50.4914 23.2863 173.8154 232 P 4.7344 0.0000 0.0000 62.8927 32.6249 176.1887 233 F 4.5623 8.8902 125.4726 56.9157 39.8696 175.8164 234 D 3.3700 7.6083 126.6483 52.8044 40.6109 175.8519 235 F 3.4546 7.3106 123.3935 58.8735 38.1013 177.1897 236 Q 3.7800 7.2724 119.7764 59.0102 28.5800 177.8325 237 A 3.8102 7.8976 121.4056 55.0527 18.1986 179.2405 238 A 3.8247 7.1354 117.8340 55.0305 18.4733 178.5969 239 Y 4.8721 7.4956 111.5750 56.6951 39.5403 175.5985 240 G 3.8329 7.6253 106.4247 46.4549 0.0000 173.9386 241 L 4.4052 7.9956 117.8740 53.5535 43.3968 178.0986 242 S 4.4066 8.2128 114.4966 57.8604 64.4535 174.7094 243 N 4.3431 8.5759 123.8213 56.7282 38.6895 177.0005 244 E 3.9739 8.1435 118.5833 59.3599 29.4691 178.6542 245 M 4.0231 7.9251 117.8652 58.2735 32.8368 177.4264 246 A 4.3755 8.5082 121.3879 55.2638 16.9399 179.4084 247 L 4.1545 8.3413 118.7567 58.0897 41.9595 178.8472 248 A 4.1327 7.6770 119.5707 54.2332 18.2970 179.4008 249 I 3.9536 7.6073 118.2510 61.8495 37.7893 175.8487 250 S 4.6362 6.8724 109.4729 58.0128 65.8975 175.3766 251 D 4.8577 8.3945 122.4414 53.7496 40.4901 175.1817 252 H 5.3327 8.2986 115.8847 54.4698 31.8476 172.9616 253 Y 5.1663 8.4148 119.5591 56.6011 39.2708 174.0619 254 P 4.6906 0.0000 0.0000 62.8761 33.0154 175.4824 255 V 4.9931 8.6899 115.8945 59.6234 34.4892 174.7617 256 E 5.2640 9.1970 122.1641 54.7904 33.6370 174.6345 257 V 4.9581 8.6784 118.4976 60.8274 35.5022 173.3438 258 T 5.1084 8.7257 118.4321 61.9236 71.1411 173.3062 259 L 5.0468 9.0340 126.1584 53.2575 44.1943 176.5493 260 T 4.2275 8.7710 116.2635 62.3041 67.2210 173.4626 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 L 8.04 4.49 0.00 1.82 1.61 0.95 0.24 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 2 K 9.34 4.80 0.00 1.89 1.77 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.69 1.62 7.81 3 I 8.95 5.17 1.82 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 1.17 0.58 0.91 0.00 0.00 4 A 8.60 4.93 0.06 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 5 A 8.84 5.03 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 6 F 9.63 5.29 0.00 2.87 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 7 N 9.31 4.88 0.00 2.66 2.62 0.00 0.00 7.12 7.94 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 8 I 7.63 3.85 1.63 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.87 0.00 0.00 9 R 8.23 3.86 0.00 1.97 1.91 0.00 3.45 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.83 0.00 10 T 9.09 3.47 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 1.23 0.00 0.00 11 F 8.19 4.06 0.00 3.15 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 12 G 7.26 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.57 3.78 0.00 1.96 1.96 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 2.34 2.35 0.00 14 T 7.74 3.82 4.18 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 1.18 0.00 0.00 15 K 7.76 4.01 0.00 1.70 1.64 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.43 1.49 7.81 16 M 7.94 4.09 0.00 1.89 1.97 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 1.97 0.00 17 S 7.57 4.55 0.00 4.03 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 18 N 7.66 4.64 0.00 2.74 2.83 0.00 0.00 6.93 7.61 0.00 0.00 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 A 8.64 4.22 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 T 7.99 3.87 4.42 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 1.36 0.00 0.00 21 L 8.11 4.10 0.00 2.02 1.71 0.98 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 22 A 8.46 3.81 1.01 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 23 S 7.98 3.84 0.00 3.84 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 24 Y 7.59 3.89 0.00 3.22 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 25 I 7.85 3.77 1.97 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 1.46 1.11 0.95 0.00 0.00 26 V 7.75 3.48 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 1.08 0.00 0.00 0.69 0.00 0.00 27 R 7.44 3.82 0.00 1.88 2.13 0.00 3.23 0.00 0.00 2.92 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.69 0.00 28 I 8.04 3.91 2.20 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.39 0.95 0.00 0.00 29 V 7.86 3.75 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 0.73 0.00 0.00 0.98 0.00 0.00 30 R 7.94 4.50 0.00 1.97 2.02 0.00 3.25 0.00 0.00 3.09 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.67 0.00 31 R 7.41 3.81 0.00 0.67 1.04 0.00 2.46 0.00 0.00 2.66 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.56 0.00 32 Y 7.01 4.99 0.00 3.04 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 33 D 9.29 4.72 0.00 2.72 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 34 I 7.87 5.45 1.85 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.59 0.93 0.00 0.00 35 V 9.49 4.93 2.26 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 1.03 0.00 0.00 1.04 0.00 0.00 36 L 8.77 4.59 0.00 1.30 1.42 0.20 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 37 I 9.20 4.81 1.60 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.57 0.38 0.00 0.00 38 Q 8.79 4.79 0.00 1.85 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.20 0.00 0.00 0.00 0.00 0.00 2.46 2.27 0.00 39 E 8.39 3.99 0.00 2.12 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 0.00 2.52 2.29 0.00 40 V 7.19 4.24 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 1.12 0.00 0.00 0.77 0.00 0.00 41 R 8.63 4.53 0.00 1.78 1.81 0.00 3.37 0.00 0.00 3.20 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.49 0.00 42 D 7.64 4.72 0.00 2.73 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 S 8.35 4.04 0.00 3.77 3.64 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 0.00 0.00 0.00 44 H 8.06 4.75 0.00 3.17 3.29 0.00 5.77 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 45 L 7.88 4.23 0.00 1.91 1.78 0.99 1.18 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 46 V 7.57 3.56 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 1.08 0.00 0.00 0.94 0.00 0.00 47 A 8.83 3.88 1.10 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 0.00 0.00 48 V 8.46 3.77 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 0.79 0.00 0.00 1.04 0.00 0.00 49 G 8.06 3.57 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 0.00 0.00 0.00 50 K 8.24 4.23 0.00 2.02 2.00 0.00 1.67 0.00 0.00 1.57 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.65 7.81 51 L 8.09 4.03 0.00 1.98 1.87 0.86 0.51 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 52 L 7.96 4.00 0.00 1.83 1.66 0.17 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 53 D 7.72 4.36 0.00 2.89 2.66 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 54 Y 7.95 4.21 0.00 3.20 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 55 L 8.06 4.16 0.00 1.64 1.81 0.50 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 56 N 8.33 5.36 0.00 2.92 2.93 0.00 0.00 6.37 7.05 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 57 Q 7.74 3.97 0.00 2.14 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.33 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.32 0.00 58 D 8.03 4.76 0.00 2.68 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 59 D 7.74 4.70 0.00 2.74 2.45 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 60 P 0.00 4.49 0.00 2.25 2.19 0.00 3.78 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 2.01 2.00 0.00 61 N 8.40 5.09 0.00 2.77 2.77 0.00 0.00 7.00 7.44 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 62 T 8.40 3.96 4.64 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 0.00 0.00 1.22 0.00 0.00 63 Y 9.00 4.86 0.00 2.89 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 64 H 8.60 5.52 0.00 1.94 2.89 0.00 5.64 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 Y 8.03 6.15 0.00 3.21 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 66 V 8.86 4.60 2.26 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 1.16 0.00 0.00 0.90 0.00 0.00 67 V 8.55 5.22 2.42 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 1.02 0.00 0.00 1.06 0.00 0.00 68 S 8.78 4.71 0.00 4.25 4.18 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 69 E 8.58 4.36 0.00 1.90 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 2.35 2.31 0.00 70 P 0.00 4.40 0.00 1.87 1.92 0.00 3.61 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.07 0.00 71 L 9.73 4.77 0.00 1.46 1.51 1.05 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 72 G 7.94 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 0.00 0.00 0.00 0.00 73 R 8.38 4.60 0.00 1.81 1.98 0.00 3.26 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 74 N 7.62 5.25 0.00 2.81 1.98 0.00 0.00 6.73 7.57 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 75 S 8.80 4.61 0.00 3.98 3.98 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 76 Y 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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 85 R 9.07 4.54 0.00 1.70 1.78 0.00 3.27 0.00 0.00 3.44 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.34 0.00 86 P 0.00 4.90 0.00 2.05 1.99 0.00 3.24 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.29 0.00 87 N 8.00 4.58 0.00 2.83 2.95 0.00 0.00 5.95 7.13 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 88 K 7.96 4.38 0.00 1.91 1.90 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.46 7.81 89 V 7.43 4.85 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 0.91 0.00 0.00 0.88 0.00 0.00 90 S 8.78 4.77 0.00 3.89 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 V 8.12 3.70 1.80 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 0.49 0.00 0.00 -0.05 0.00 0.00 92 L 8.36 4.12 0.00 1.18 1.36 0.67 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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3.09 0.00 0.00 3.20 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 112 E 8.58 3.66 0.00 2.25 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 2.38 2.60 0.00 113 P 0.00 4.47 0.00 1.74 1.78 0.00 3.26 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.23 0.00 114 A 8.08 4.69 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 0.00 115 V 8.53 4.74 1.18 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 1.08 0.00 0.00 0.47 0.00 0.00 116 V 8.29 4.41 1.11 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 -0.28 0.00 0.00 -0.10 0.00 0.00 117 K 8.08 4.36 0.00 0.79 0.74 0.00 0.99 0.00 0.00 1.14 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.77 0.62 7.81 118 F 8.54 4.85 0.00 1.89 2.35 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 0.00 119 S 8.68 4.92 0.00 3.69 3.56 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 0.00 120 S 8.78 4.66 0.00 4.03 3.83 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 0.00 121 H 9.07 4.51 0.00 3.16 3.32 0.00 5.75 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 S 8.16 4.32 0.00 4.00 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 0.00 123 T 6.86 4.80 4.26 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 1.23 0.00 0.00 124 K 8.59 4.01 0.00 1.76 1.93 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.44 7.81 125 V 7.65 3.83 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 0.94 0.00 0.00 0.86 0.00 0.00 126 K 8.61 5.18 0.00 1.72 1.82 0.00 2.04 0.00 0.00 1.97 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.22 7.81 127 E 7.98 5.22 0.00 1.91 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.14 0.00 128 F 8.46 5.13 0.00 3.38 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 0.00 129 A 8.81 5.27 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 I 8.96 5.12 2.18 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.57 1.35 0.00 0.00 131 V 9.18 4.69 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 0.88 0.00 0.00 0.97 0.00 0.00 132 A 8.53 4.98 0.64 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 0.00 0.00 0.00 0.00 0.00 133 L 8.72 4.64 0.00 1.56 1.44 0.94 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 134 H 9.40 5.51 0.00 3.52 3.33 0.00 5.82 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 S 8.96 4.72 0.00 3.95 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 0.00 136 A 9.15 4.29 1.23 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 0.00 0.00 0.00 137 P 0.00 3.64 0.00 1.63 0.49 0.00 3.40 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.77 0.00 138 S 8.00 4.17 0.00 3.80 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 0.00 139 D 8.14 4.88 0.00 2.62 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 0.00 140 A 7.84 3.93 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 0.00 141 V 7.79 3.36 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 0.94 0.00 0.00 0.79 0.00 0.00 142 A 7.93 3.90 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 0.00 143 E 7.77 3.55 0.00 2.14 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 2.50 2.75 0.00 144 I 7.98 3.65 1.89 0.00 0.00 0.96 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0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 153 D 8.06 4.26 0.00 3.08 2.96 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 0.00 154 V 7.91 3.37 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 1.17 0.00 0.00 0.95 0.00 0.00 155 Q 7.96 4.03 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.15 1.67 0.00 156 Q 7.99 3.94 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.96 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 157 K 7.47 3.83 0.00 1.17 0.98 0.00 1.08 0.00 0.00 1.04 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.04 1.18 7.81 158 W 7.96 4.87 0.00 3.35 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 0.00 159 H 8.00 4.72 0.00 3.37 3.42 0.00 5.70 0.00 0.00 0.00 0.00 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 L 8.05 4.85 0.00 1.70 1.71 1.02 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 161 N 8.59 4.82 0.00 2.83 2.98 0.00 0.00 7.32 8.06 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 0.00 162 D 8.00 4.99 0.00 2.75 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 0.00 163 V 9.02 4.98 2.59 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 1.20 0.00 0.00 1.18 0.00 0.00 164 M 9.75 5.08 0.00 2.21 1.87 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.52 0.00 165 L 9.04 5.27 0.00 1.60 1.60 1.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 166 M 9.35 4.88 0.00 2.07 1.85 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 167 G 7.05 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 0.00 0.00 0.00 0.00 168 D 8.93 5.11 0.00 2.87 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 0.00 169 F 8.91 4.87 0.00 3.31 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 0.00 170 N 8.26 4.02 0.00 2.75 2.72 0.00 0.00 6.91 8.57 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 0.00 171 A 8.54 4.53 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 0.00 0.00 0.00 0.00 0.00 172 D 8.69 4.78 0.00 3.03 2.48 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 0.00 173 C 8.53 4.05 0.00 3.21 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 S 8.55 3.89 0.00 3.02 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 0.00 175 Y 7.39 4.43 0.00 3.24 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 0.00 176 V 7.54 4.13 1.83 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 -0.50 0.00 0.00 0.78 0.00 0.00 177 T 8.80 4.42 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 1.17 0.00 0.00 178 S 8.84 4.30 0.00 3.94 4.04 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 0.00 179 S 8.00 4.37 0.00 3.98 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 0.00 180 Q 7.99 4.29 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.83 0.00 0.00 0.00 0.00 0.00 2.26 2.24 0.00 181 W 7.69 4.28 0.00 3.36 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 0.00 182 S 8.15 4.24 0.00 3.88 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 0.00 183 S 7.99 4.22 0.00 4.04 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 0.00 184 I 7.40 4.43 2.17 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.76 1.15 0.00 0.00 185 R 9.04 3.97 0.00 1.64 1.07 0.00 2.68 0.00 0.00 3.04 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.41 0.00 186 L 8.05 3.94 0.00 1.70 1.95 -0.12 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 187 R 7.95 4.58 0.00 1.89 2.15 0.00 2.21 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 1.06 1.38 0.00 188 T 8.19 4.18 4.26 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 1.37 0.00 0.00 189 S 7.98 4.53 0.00 4.11 4.41 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 0.00 190 S 8.74 4.69 0.00 4.04 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 0.00 191 T 7.70 3.77 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 0.46 0.00 0.00 192 F 7.47 5.14 0.00 3.29 2.88 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 0.00 193 Q 9.16 4.78 0.00 2.14 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.82 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 194 W 9.03 4.72 0.00 3.14 3.23 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 0.00 195 L 8.80 4.19 0.00 1.62 1.72 0.88 0.72 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 0.00 196 I 7.70 4.19 1.93 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.77 0.97 0.00 0.00 197 P 0.00 4.65 0.00 2.20 2.18 0.00 3.73 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 198 D 8.38 4.43 0.00 2.58 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 0.00 199 S 7.90 4.39 0.00 3.84 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 0.00 200 A 7.59 4.18 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 0.00 201 D 8.56 4.87 0.00 2.78 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 0.00 202 T 8.77 4.93 4.40 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 1.33 0.00 0.00 203 T 7.66 4.65 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 1.14 0.00 0.00 204 A 8.35 3.36 1.01 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 0.00 205 T 7.46 4.14 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 1.20 0.00 0.00 206 S 8.42 4.28 0.00 3.98 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 0.00 207 T 7.17 4.08 4.16 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 1.21 0.00 0.00 208 N 8.24 4.94 0.00 2.61 2.68 0.00 0.00 6.77 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 0.00 209 C 8.06 4.89 0.00 1.95 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 0.00 0.00 0.00 210 A 9.74 4.80 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 Y 7.77 4.81 0.00 3.19 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 0.00 212 D 8.42 5.22 0.00 2.75 2.65 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 0.00 0.00 0.00 0.00 213 R 8.55 4.69 0.00 0.67 1.41 0.00 3.71 0.00 0.00 3.32 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 2.19 0.00 214 I 8.02 4.71 1.80 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.64 0.84 0.00 0.00 215 V 8.79 4.62 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 -0.20 0.00 0.00 216 V 8.72 5.10 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 0.63 0.00 0.00 0.91 0.00 0.00 217 A 9.07 4.86 0.80 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 0.00 0.00 218 G 8.90 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 S 8.93 4.12 0.00 4.06 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 L 7.83 3.91 0.00 1.69 1.77 0.95 1.01 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 0.00 221 L 8.15 4.01 0.00 2.02 1.78 0.97 0.51 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 Q 8.40 4.01 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 223 S 8.21 4.27 0.00 4.00 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 0.00 224 S 7.98 4.22 0.00 4.04 3.94 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 0.00 0.00 0.00 225 V 6.73 4.03 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 0.73 0.00 0.00 0.86 0.00 0.00 226 V 8.58 3.95 2.16 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 0.88 0.00 0.00 0.96 0.00 0.00 227 P 0.00 4.36 0.00 1.97 1.98 0.00 3.78 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 228 G 9.05 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 0.00 229 S 7.87 4.22 0.00 4.03 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 0.00 230 A 7.92 4.49 1.25 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 0.00 0.00 231 A 8.93 4.60 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 0.00 232 P 0.00 4.73 0.00 2.12 2.21 0.00 3.50 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.14 0.00 233 F 8.89 4.56 0.00 3.23 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 0.00 234 D 7.61 3.37 0.00 1.88 1.95 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 0.00 235 F 7.31 3.45 0.00 3.32 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 0.00 236 Q 7.27 3.78 0.00 1.89 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.95 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 237 A 7.90 3.81 1.19 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 0.00 0.00 238 A 7.14 3.82 0.75 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 0.00 239 Y 7.50 4.87 0.00 3.07 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 0.00 240 G 7.63 3.83 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 0.00 0.00 0.00 241 L 8.00 4.41 0.00 1.65 1.60 0.96 0.74 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 0.00 242 S 8.21 4.41 0.00 3.90 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 0.00 243 N 8.58 4.34 0.00 2.86 2.79 0.00 0.00 6.66 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 0.00 244 E 8.14 3.97 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 245 M 7.93 4.02 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.55 0.00 246 A 8.51 4.38 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 0.00 247 L 8.34 4.15 0.00 2.11 1.71 0.97 1.06 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 0.00 248 A 7.68 4.13 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 0.00 249 I 7.61 3.95 2.19 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 1.44 0.73 0.77 0.00 0.00 250 S 6.87 4.64 0.00 3.84 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 251 D 8.39 4.86 0.00 2.77 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 0.00 252 H 8.30 5.33 0.00 3.41 3.44 0.00 5.69 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 253 Y 8.41 5.17 0.00 2.96 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 254 P 0.00 4.69 0.00 2.01 1.51 0.00 4.02 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 1.26 0.00 255 V 8.69 4.99 2.07 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 0.91 0.00 0.00 0.94 0.00 0.00 256 E 9.20 5.26 0.00 1.97 1.82 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 2.42 2.27 0.00 257 V 8.68 4.96 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.89 0.00 0.00 258 T 8.73 5.11 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 1.27 0.00 0.00 259 L 9.03 5.05 0.00 1.42 1.48 0.47 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 260 T 8.77 4.23 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 1.20 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.