NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2922 7.8827 121.4454 61.1652 38.7870 173.8039 17 V 4.3139 8.4623 125.2934 61.5653 33.2043 174.1770 18 G 3.6961 8.4248 114.0039 46.5880 0.0000 173.0087 19 G 4.2732 7.8559 110.4562 43.6652 0.0000 172.3908 20 Y 4.9625 7.6827 116.4156 55.1707 42.2315 174.7085 21 T 4.3616 8.5758 116.8659 63.8201 68.5213 175.3758 22 C 4.3522 8.7254 125.4336 61.2622 35.6551 174.2500 23 G 4.1945 8.6043 105.4338 43.3495 0.0000 173.0084 24 A 4.2194 8.6417 124.8037 53.7234 18.6689 177.2995 25 N 4.2064 8.7516 120.5186 54.4884 36.3205 175.1880 26 T 4.2689 7.5266 106.8599 62.3367 70.1947 175.0751 27 V 4.1112 7.0031 121.8555 60.1728 31.3418 173.7466 28 P 4.5085 0.0000 0.0000 64.1187 31.9707 178.1103 29 Y 5.1056 6.8741 115.5349 56.3673 38.7267 174.5373 30 Q 4.5976 7.4048 123.4631 56.1331 29.6677 175.1413 31 V 4.8369 8.9687 125.4455 61.1427 35.6351 173.7280 32 S 4.9216 8.6916 119.0203 56.4241 65.2463 172.4867 33 L 4.7112 8.5844 127.5098 53.2088 43.4884 174.9302 34 N 5.9872 9.1590 122.7951 50.0855 41.9202 175.0031 *37 S 5.0389 7.8714 120.3086 58.6992 64.1653 174.3904 38 G 3.9902 9.2221 109.0376 46.5830 0.0000 173.1756 39 Y 4.5456 6.4245 115.1784 56.1304 40.0892 172.7774 40 H 4.6415 8.8229 121.6300 56.1123 30.3940 174.9584 41 F 4.9660 7.9335 119.2529 56.6378 39.4998 173.5324 42 C 4.7072 6.6377 116.9025 56.2180 44.8013 172.9417 43 G 4.3046 8.5663 108.9879 45.3586 0.0000 172.0562 44 G 4.4064 8.0622 105.6467 46.4185 0.0000 172.5542 45 S 5.4533 8.7675 115.4153 56.4719 66.6344 173.6032 46 L 4.8070 9.0888 127.3594 54.6285 42.4477 177.0994 47 I 4.3218 8.5546 119.9809 61.2651 38.8676 174.7059 48 N 4.4856 7.7659 117.1828 51.9866 39.2686 175.1084 49 S 4.1631 8.4866 113.0004 60.9067 62.8205 175.7150 50 Q 4.5246 8.1888 117.2318 55.1418 30.2812 174.5731 51 W 5.5156 8.0928 118.1480 54.7422 33.3786 174.4745 52 V 5.1000 9.1748 122.7708 61.0813 34.7075 174.4041 53 V 4.9226 8.8188 126.1858 60.4520 33.8512 174.8383 54 S 5.1277 9.1060 117.2767 57.6409 66.1647 171.8632 55 A 4.7468 8.5086 120.2778 50.5455 20.6860 178.4449 56 A 3.8822 8.2798 124.2701 55.1318 18.5234 179.0397 57 H 4.5873 8.5546 109.6145 57.1221 28.6505 175.2431 58 C 4.7586 7.7520 117.1177 56.8846 40.5968 173.3217 59 Y 4.2746 7.6621 122.1550 57.9654 38.7408 175.3607 60 K 3.8945 7.2101 123.8550 55.4419 36.1726 174.9250 61 S 4.4774 8.0209 116.5104 58.1953 64.8368 174.3790 62 G 3.6151 8.6052 109.8087 46.3079 0.0000 173.3072 63 I 4.5965 7.3610 118.6489 59.5237 40.0360 175.8185 64 Q 4.8052 8.4942 126.5753 54.2365 32.1727 173.8462 65 V 4.4985 8.8454 126.5041 61.4483 33.8860 174.5258 66 R 5.2218 8.8835 126.6395 54.6792 32.8392 175.0194 67 L 4.7014 9.2518 124.6366 52.7267 44.8580 177.1341 *69 G 4.3517 8.2160 105.5655 46.3860 0.0000 172.8247 70 E 4.6864 8.4414 118.7316 55.2524 30.4848 174.2124 71 D 4.7406 7.8499 117.4677 54.8623 43.8439 173.9410 72 N 5.1237 9.1059 117.5765 52.7027 39.4719 176.0729 73 I 3.9431 8.5999 119.5131 61.8178 37.9504 176.0674 74 N 4.8104 8.7989 118.0598 53.0339 39.2839 174.6404 75 V 4.2885 7.3658 117.0144 60.7610 34.2405 175.0925 76 V 4.1181 8.4525 126.9975 62.5662 30.7349 175.2175 77 E 4.3259 9.1982 127.5186 55.8556 29.9574 176.9856 78 G 4.0781 8.1595 107.3525 45.5127 0.0000 174.4605 79 N 4.8806 8.2384 115.5497 53.1411 39.7827 174.6299 80 E 5.4461 7.8286 117.8702 55.0648 31.5199 175.7979 81 Q 4.3056 8.3178 119.5621 54.2769 33.0162 173.8956 82 F 5.6410 8.7912 122.7264 55.9618 41.1651 175.0261 83 I 4.6955 8.8952 124.8426 59.5061 40.9809 175.7385 84 S 4.7138 8.6745 121.7569 58.0575 64.5302 173.0243 85 A 4.7412 8.2398 123.9577 51.7476 18.8467 177.6959 86 S 4.5963 8.9250 116.2351 59.7933 64.6845 174.6075 87 K 4.7078 7.5097 117.0331 55.6880 35.5865 175.0299 88 S 5.3148 8.7146 116.9213 56.9766 66.7054 173.7249 89 I 4.6030 9.1828 124.0003 59.6600 40.2246 174.8402 90 V 4.2687 8.4515 127.3435 61.8517 32.8819 175.1200 91 H 3.5628 8.5478 126.4725 55.8785 29.9671 174.3641 92 P 4.2631 0.0000 0.0000 65.3741 31.0870 177.1022 93 S 4.6997 7.7826 112.6229 58.0157 63.2288 173.1724 94 Y 4.2846 8.0027 123.2142 57.7307 38.9645 174.4921 95 N 4.5966 8.0803 125.9157 51.3656 39.7643 175.1741 96 S 3.8040 7.7958 120.4416 59.8314 63.5424 175.2552 97 N 4.3940 8.2146 118.9789 55.1917 38.5400 175.9829 98 T 4.0056 7.6236 105.3260 60.5425 70.1324 174.8233 99 L 3.6812 7.8296 121.0050 55.4276 39.7058 173.8598 100 N 4.4590 7.5706 118.0317 54.5782 39.6260 174.5395 101 N 4.7434 8.6687 119.9765 54.3042 35.7119 175.7090 102 D 4.7767 7.8927 117.8096 52.9164 39.8040 174.9861 103 I 4.8369 7.1693 120.9077 59.4488 42.3398 172.8732 104 M 5.4387 9.2326 126.3189 54.2484 36.3781 173.2527 105 L 5.4797 9.2129 123.6496 53.1047 45.2810 175.4948 106 I 5.0677 9.0945 123.2490 59.4717 40.8410 174.2433 107 K 3.8748 8.7404 128.5616 54.4278 33.9944 175.2258 108 L 4.6352 7.9722 127.0135 53.8281 42.2539 177.3386 109 K 4.1230 8.8790 122.5682 58.9645 32.4779 177.6391 110 S 4.6511 7.7288 112.8560 56.1423 66.7914 173.2362 111 A 4.4582 8.3212 123.7845 51.8209 18.9469 177.4533 112 A 4.3073 8.8886 123.4025 51.8009 19.9388 177.1662 113 S 4.6415 8.9043 116.1352 57.1002 63.9289 174.5247 114 L 4.5902 8.5248 125.5300 54.0681 42.5167 176.1755 115 N 4.8534 8.8913 118.6914 52.4611 39.6057 174.7712 116 S 4.1840 8.7899 112.7889 62.1183 62.7504 175.7142 117 R 4.1279 8.8913 118.8936 57.1068 30.5076 176.0031 118 V 4.4857 7.8505 116.2570 60.9099 33.3995 173.7175 119 A 5.1968 8.5547 128.4359 50.3182 23.0932 174.7581 120 S 5.1847 8.6734 113.7345 57.2927 65.3966 173.0452 121 I 4.4632 8.3736 120.6845 59.2572 39.7937 175.2386 122 S 4.5345 8.3019 122.6551 57.6992 63.9777 173.8866 123 L 4.3436 8.0845 123.2435 53.2436 42.5914 175.1954 124 P 4.5416 0.0000 0.0000 62.8458 32.3535 176.2885 125 T 4.0680 8.2498 109.3320 62.9703 69.7842 174.6671 *127 S 4.7794 7.5423 114.3649 58.1488 64.0498 173.5158 128 C 4.5136 8.3493 117.2343 56.1237 41.0137 173.4983 129 A 4.5205 7.9094 124.2346 51.1901 20.0310 177.5239 130 S 4.2478 8.0666 115.4864 57.6838 64.1674 173.7082 *132 A 4.1774 8.2052 124.7959 53.4112 19.3306 176.2831 133 G 4.0766 8.8193 109.3195 45.7187 0.0000 174.7929 134 T 4.0319 7.6911 116.9147 63.6617 69.4530 173.9787 135 Q 4.7304 8.5639 124.8117 55.5550 30.1843 175.6210 136 C 5.2630 9.2304 119.7488 55.1179 44.9230 172.3308 137 L 5.2255 9.0924 122.1051 53.4845 44.2935 175.0342 138 I 5.2971 9.0878 126.9532 58.7044 40.3324 174.7740 139 S 4.9490 8.7802 119.3262 56.3559 66.6853 173.0372 140 G 3.8425 7.4123 108.6366 46.1226 0.0000 172.7937 141 W 4.8131 8.6125 117.3673 56.2445 29.5319 177.0493 142 G 4.1417 8.3675 108.7677 44.0555 0.0000 173.6362 143 N 3.5200 8.2168 117.9056 54.2590 38.9334 174.4399 144 T 5.1322 8.1436 112.5289 60.3461 69.3678 173.9786 145 K 4.6234 7.7549 120.8830 54.9310 34.9955 176.3920 146 S 4.2774 8.8531 119.5827 61.1429 63.0740 175.0077 147 S 4.5544 9.0984 117.0958 54.8549 62.3383 173.9101 148 G 4.1055 7.0871 111.0760 44.3887 0.0000 169.2261 149 T 4.7260 7.7755 115.8662 61.8636 72.0028 174.3491 150 S 4.4505 9.3538 122.1620 57.6152 65.7048 172.0468 151 Y 4.8693 8.7255 125.6478 55.5835 39.4749 174.3482 152 P 4.7105 0.0000 0.0000 62.6025 32.9221 175.3566 153 D 4.8870 8.6497 117.5276 54.8806 42.7212 176.6810 154 V 5.7057 7.7016 110.0905 58.2593 34.8287 175.4684 155 L 3.2424 8.2689 123.8112 55.0249 43.0317 175.9255 156 K 4.9268 8.1390 124.6988 54.8053 35.1937 174.5528 157 C 5.2926 8.5412 119.9565 55.1956 43.9032 172.9312 158 L 4.8755 8.4923 122.1790 53.9610 45.5631 174.2794 159 K 5.1598 8.9646 125.4372 55.0469 33.8497 175.6587 160 A 4.9249 9.2223 125.4428 49.7381 23.1593 173.5465 161 P 5.0854 0.0000 0.0000 61.6261 34.1159 175.0142 162 I 4.3250 8.3499 122.1535 61.4041 38.1592 175.6768 163 L 4.9570 8.5041 126.5551 52.8411 43.9561 176.7718 164 S 4.3556 8.4021 114.7880 58.2084 63.8936 175.2202 165 D 4.4785 8.6908 121.9622 57.3353 40.4996 179.2093 166 S 4.1601 8.0634 114.9011 61.5954 62.9207 176.6504 167 S 4.2116 7.9667 117.8245 60.6682 62.9461 175.7469 168 C 4.3481 7.9865 121.9156 59.7548 43.2859 175.7632 169 K 4.0063 8.3138 119.0096 59.4779 31.6471 179.3348 170 S 4.2735 8.0158 114.8141 61.3035 62.7734 176.1653 171 A 4.0131 7.6175 123.1265 53.6857 19.6734 177.3385 172 Y 4.8203 7.6502 113.8157 55.0958 38.1652 172.7989 173 P 4.5126 0.0000 0.0000 64.0096 32.2966 177.1004 174 G 3.9909 8.9884 109.6504 46.2800 0.0000 173.7906 175 Q 4.5501 8.2049 117.1541 55.3940 30.5758 175.6412 176 I 4.4435 7.8430 119.2574 60.0008 38.5076 175.0866 177 T 4.6599 8.1782 114.7626 59.5208 71.2072 174.7551 178 S 4.3789 8.5443 114.4081 60.0881 63.2817 174.2565 179 N 4.9271 8.1313 118.6730 53.4581 38.5020 173.8746 180 M 5.6221 7.7910 117.5445 53.9019 36.3856 174.4452 181 F 5.0837 8.6664 114.3793 56.0594 41.9895 172.4694 182 C 5.5541 9.0596 116.5034 55.6417 41.5559 172.6671 183 A 4.9852 9.2455 121.8677 50.7610 22.4422 176.2281 184A G 3.9891 6.7937 107.3291 44.9356 0.0000 172.7143 184 Y 4.6372 8.2352 120.3112 56.0040 40.8887 176.2747 185 L 4.1200 8.6787 125.9481 57.3704 42.0443 179.4009 186 E 4.0246 8.2001 115.8563 57.5439 29.7757 176.9681 187 G 3.7833 7.6850 105.2912 44.5160 0.0000 171.0124 188A G 4.2201 9.4630 105.6959 44.6441 0.0000 173.7695 188 K 5.2926 7.1327 116.9728 53.5766 35.2643 175.3638 189 D 4.6161 8.4052 122.5526 54.0425 44.8589 174.4876 190 S 4.9795 8.6684 116.7278 57.8297 65.5572 172.7655 191 C 4.7620 9.1011 118.9228 55.3612 48.0174 172.4309 192 Q 4.3888 8.5059 119.2296 57.6362 28.3768 176.6659 193 G 4.3213 8.5325 109.5444 46.2656 0.0000 174.6105 194 D 4.6351 8.7337 118.8360 55.8059 41.5756 176.4609 195 S 4.2757 7.9545 114.7579 59.9078 63.2005 175.3997 196 G 4.1392 8.9990 113.8314 46.4427 0.0000 173.6261 197 G 4.1698 8.0814 107.5565 45.2231 0.0000 171.2197 198 P 5.1276 0.0000 0.0000 62.3957 33.4633 175.7423 199 V 4.5966 8.4748 120.6673 61.4720 34.4697 174.0154 200 V 4.8016 8.8729 129.0377 61.2722 34.2305 173.7387 201 C 5.0716 8.5779 124.3620 55.7204 44.0893 174.5303 202 S 3.8247 9.9107 119.4560 59.6392 60.0354 173.3444 203 G 3.9447 8.6597 106.0711 45.3173 0.0000 174.0838 204 K 4.7225 7.5094 117.4208 53.0429 35.3719 175.3814 *209 L 4.2542 8.2678 122.3088 55.4641 42.3670 175.9581 210 Q 4.5821 8.9392 125.7093 56.4592 31.1517 175.7237 211 G 5.3657 8.0242 104.5538 45.7866 0.0000 171.4052 212 I 5.1753 8.1902 119.4125 58.9008 41.2235 175.2702 213 V 3.6893 9.0157 127.4357 63.9377 31.7736 174.2641 214 S 4.9843 8.5383 121.3273 58.6691 64.2302 174.6299 215 W 4.9647 7.5004 114.4625 56.5356 32.0021 171.9192 216 G 3.5480 8.0205 104.2264 46.8375 0.0000 172.4829 217 S 4.7274 8.3798 115.3998 56.5161 63.5299 172.9576 *219 G 4.4681 8.0784 118.5813 45.6457 0.0000 171.0708 220 C 4.9677 8.1407 116.2366 56.5136 43.1965 173.7626 221A A 3.9703 9.0649 125.1726 53.2252 16.5165 177.2376 221 Q 4.5846 7.2967 117.6654 56.2179 29.8728 175.8799 222 K 4.1454 8.4050 121.5394 57.8684 32.7636 176.0444 223 N 4.2798 9.2254 121.4115 54.1335 37.0195 175.4025 224 K 4.3817 7.5051 116.1713 53.7357 32.3888 173.8325 225 P 4.5909 0.0000 0.0000 62.2330 33.1532 177.3217 226 G 3.7039 8.4785 106.8270 45.9312 0.0000 172.7867 227 V 4.3901 7.6167 121.8120 60.6583 34.0790 174.0965 228 Y 4.8948 8.2577 124.5182 56.0061 41.8790 175.0441 229 T 4.4355 8.4783 119.5184 63.5992 70.0588 174.4733 230 K 5.1276 9.2509 128.2098 55.0901 31.0183 177.0322 231 V 3.9712 8.7316 125.1500 65.9221 31.4179 174.7722 232 C 4.3588 8.3581 112.4283 58.1374 41.4763 174.7277 233 N 4.2942 8.0439 117.1575 54.1919 38.5890 175.0046 234 Y 4.8237 7.9538 117.8377 57.5866 39.1678 177.5655 235 V 3.6713 8.0668 121.5742 66.4024 31.4705 178.1177 236 S 4.1251 8.1046 114.3419 61.1300 62.6369 176.2897 237 W 4.1627 8.2480 130.6203 60.5066 30.4901 177.8120 238 I 3.0197 8.3253 120.0433 64.2499 36.6434 178.5017 239 K 3.7368 8.0891 119.3029 59.5788 31.6315 179.5051 240 Q 3.8969 7.9487 117.3818 59.1451 28.8084 178.6162 241 T 3.7565 7.5853 117.1661 66.4480 68.1025 176.9597 242 I 2.5448 7.2054 114.8761 63.2935 37.2066 177.8969 243 A 4.0863 7.4672 120.6950 53.7011 18.2104 178.6328 244 S 4.7266 7.2252 111.8564 58.1690 63.4845 173.9559 245 N 4.6910 7.9226 125.3079 53.6591 39.5378 174.1897 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 16 I 7.88 4.29 1.78 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 1.48 0.61 0.89 0.00 0.00 17 V 8.46 4.31 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 1.02 0.00 0.00 0.88 0.00 0.00 18 G 8.42 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.86 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 7.68 4.96 0.00 3.01 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.58 4.36 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 22 C 8.73 4.35 0.00 2.76 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 23 G 8.60 4.19 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 0.00 24 A 8.64 4.22 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.75 4.21 0.00 2.83 2.88 0.00 0.00 7.27 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 26 T 7.53 4.27 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 1.33 0.00 0.00 27 V 7.00 4.11 1.74 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 0.31 0.00 0.00 0.77 0.00 0.00 28 P 0.00 4.51 0.00 2.37 2.41 0.00 3.79 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.96 0.00 29 Y 6.87 5.11 0.00 3.25 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 30 Q 7.40 4.60 0.00 1.80 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.51 0.00 0.00 0.00 0.00 0.00 1.94 2.49 0.00 31 V 8.97 4.84 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 0.88 0.00 0.00 1.09 0.00 0.00 32 S 8.69 4.92 0.00 3.04 3.31 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 33 L 8.58 4.71 0.00 0.43 1.01 0.78 0.24 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 34 N 9.16 5.99 0.00 2.44 2.50 0.00 0.00 6.55 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *37 S 7.87 5.04 0.00 3.68 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 38 G 9.22 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 39 Y 6.42 4.55 0.00 3.07 2.99 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 40 H 8.82 4.64 0.00 2.86 3.16 0.00 5.87 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.93 4.97 0.00 3.18 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 42 C 6.64 4.71 0.00 2.20 2.85 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 43 G 8.57 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.06 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 0.00 0.00 0.00 45 S 8.77 5.45 0.00 3.83 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 46 L 9.09 4.81 0.00 1.87 1.67 1.09 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.55 4.32 1.90 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 1.52 0.94 1.01 0.00 0.00 48 N 7.77 4.49 0.00 2.93 2.97 0.00 0.00 6.27 8.20 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 49 S 8.49 4.16 0.00 4.04 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 50 Q 8.19 4.52 0.00 2.12 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.83 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 51 W 8.09 5.52 0.00 3.13 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 9.17 5.10 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.98 0.00 0.00 53 V 8.82 4.92 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 0.71 0.00 0.00 1.02 0.00 0.00 54 S 9.11 5.13 0.00 3.87 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 55 A 8.51 4.75 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.28 3.88 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.55 4.59 0.00 3.37 3.58 0.00 5.55 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.75 4.76 0.00 3.22 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 7.66 4.27 0.00 2.92 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 7.21 3.89 0.00 1.32 1.22 0.00 0.61 0.00 0.00 0.98 0.00 0.00 2.60 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.94 0.94 7.81 61 S 8.02 4.48 0.00 3.74 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.61 3.62 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 0.00 0.00 0.00 63 I 7.36 4.60 1.88 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.04 0.95 0.00 0.00 64 Q 8.49 4.81 0.00 2.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.88 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 65 V 8.85 4.50 2.20 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 0.95 0.00 0.00 0.91 0.00 0.00 66 R 8.88 5.22 0.00 1.72 1.85 0.00 2.70 0.00 0.00 2.32 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.29 0.00 67 L 9.25 4.70 0.00 1.58 1.61 0.95 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.22 4.35 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 0.00 70 E 8.44 4.69 0.00 2.17 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.10 0.00 71 D 7.85 4.74 0.00 2.76 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 9.11 5.12 0.00 2.84 2.79 0.00 0.00 7.21 7.34 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 73 I 8.60 3.94 1.45 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.54 -0.41 0.00 0.00 74 N 8.80 4.81 0.00 2.80 2.87 0.00 0.00 6.56 7.95 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 75 V 7.37 4.29 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 0.74 0.00 0.00 1.00 0.00 0.00 76 V 8.45 4.12 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 0.80 0.00 0.00 1.04 0.00 0.00 77 E 9.20 4.33 0.00 2.00 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 2.31 2.47 0.00 78 G 8.16 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.24 4.88 0.00 2.80 2.80 0.00 0.00 7.13 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 80 E 7.83 5.45 0.00 1.25 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.42 0.00 81 Q 8.32 4.31 0.00 1.94 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.84 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 82 F 8.79 5.64 0.00 2.80 2.77 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 83 I 8.90 4.70 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.71 0.95 0.00 0.00 84 S 8.67 4.71 0.00 3.75 3.74 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 85 A 8.24 4.74 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 86 S 8.92 4.60 0.00 3.75 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 87 K 7.51 4.71 0.00 1.85 1.89 0.00 1.45 0.00 0.00 1.93 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.23 1.50 7.81 88 S 8.71 5.31 0.00 3.95 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 89 I 9.18 4.60 2.06 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.97 1.14 0.00 0.00 90 V 8.45 4.27 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 0.56 0.00 0.00 0.75 0.00 0.00 91 H 8.55 3.56 0.00 2.86 3.08 0.00 5.65 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.26 0.00 2.15 2.17 0.00 2.53 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.85 0.00 93 S 7.78 4.70 0.00 3.93 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 94 Y 8.00 4.28 0.00 2.97 2.89 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 95 N 8.08 4.60 0.00 2.57 2.42 0.00 0.00 6.52 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 96 S 7.80 3.80 0.00 3.99 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 97 N 8.21 4.39 0.00 2.78 2.78 0.00 0.00 6.79 7.10 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 98 T 7.62 4.01 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 1.09 0.00 0.00 99 L 7.83 3.68 0.00 1.39 1.86 0.92 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.57 4.46 0.00 2.72 2.62 0.00 0.00 7.27 6.56 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 0.00 101 N 8.67 4.74 0.00 3.07 2.62 0.00 0.00 7.23 8.25 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 0.00 102 D 7.89 4.78 0.00 3.10 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.17 4.84 1.53 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.32 0.13 0.00 0.00 104 M 9.23 5.44 0.00 2.13 1.82 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.65 0.00 105 L 9.21 5.48 0.00 1.70 1.78 0.01 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.09 5.07 1.93 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 1.20 0.95 0.90 0.00 0.00 107 K 8.74 3.87 0.00 0.79 1.09 0.00 1.33 0.00 0.00 1.36 0.00 0.00 2.62 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.72 0.21 7.81 108 L 7.97 4.64 0.00 1.48 1.56 0.98 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.88 4.12 0.00 1.67 1.83 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.50 7.81 110 S 7.73 4.65 0.00 3.77 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 0.00 111 A 8.32 4.46 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 0.00 112 A 8.89 4.31 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 0.00 113 S 8.90 4.64 0.00 3.74 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 0.00 114 L 8.52 4.59 0.00 1.65 1.71 0.96 1.06 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 0.00 115 N 8.89 4.85 0.00 2.86 2.91 0.00 0.00 6.85 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.79 4.18 0.00 3.89 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 0.00 117 R 8.89 4.13 0.00 1.95 1.97 0.00 3.06 0.00 0.00 3.26 7.39 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.54 4.78 0.00 4.00 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 0.00 128 C 8.35 4.51 0.00 2.94 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 0.00 129 A 7.91 4.52 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 0.00 130 S 8.07 4.25 0.00 3.95 3.74 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 *132 A 8.21 4.18 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 0.00 133 G 8.82 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.69 4.03 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 1.15 0.00 0.00 135 Q 8.56 4.73 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 136 C 9.23 5.26 0.00 2.73 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 0.00 137 L 9.09 5.23 0.00 1.74 1.56 1.04 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.09 5.30 1.88 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 1.57 1.03 0.00 0.00 139 S 8.78 4.95 0.00 3.51 3.59 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 0.00 0.00 0.00 0.00 140 G 7.41 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 8.61 4.81 0.00 3.18 2.94 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 0.00 142 G 8.37 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 0.00 0.00 0.00 143 N 8.22 3.52 0.00 2.12 2.56 0.00 0.00 7.34 7.26 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 0.00 144 T 8.14 5.13 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 1.25 0.00 0.00 145 K 7.75 4.62 0.00 1.73 1.70 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.27 1.32 7.81 146 S 8.85 4.28 0.00 3.87 4.10 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 0.00 147 S 9.10 4.55 0.00 3.82 3.79 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 0.00 148 G 7.09 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 0.00 0.00 0.00 149 T 7.78 4.73 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 1.48 0.00 0.00 150 S 9.35 4.45 0.00 3.82 3.62 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 0.00 151 Y 8.73 4.87 0.00 2.95 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 0.00 152 P 0.00 4.71 0.00 2.41 2.08 0.00 4.10 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 2.12 2.01 0.00 153 D 8.65 4.89 0.00 2.69 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.70 5.71 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.97 0.00 0.00 155 L 8.27 3.24 0.00 1.33 1.23 -0.85 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.14 4.93 0.00 1.68 1.48 0.00 1.59 0.00 0.00 1.55 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.45 7.81 157 C 8.54 5.29 0.00 1.55 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.49 4.88 0.00 1.69 1.44 1.02 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.96 5.16 0.00 1.81 1.81 0.00 1.85 0.00 0.00 1.77 0.00 0.00 2.74 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.64 7.81 160 A 9.22 4.92 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 0.00 161 P 0.00 5.09 0.00 2.03 2.10 0.00 3.19 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.79 0.00 162 I 8.35 4.32 1.75 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 1.03 0.62 0.78 0.00 0.00 163 L 8.50 4.96 0.00 1.55 1.59 0.92 0.78 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 0.00 164 S 8.40 4.36 0.00 4.01 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 0.00 165 D 8.69 4.48 0.00 2.74 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 0.00 166 S 8.06 4.16 0.00 4.05 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 0.00 167 S 7.97 4.21 0.00 4.03 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 0.00 168 C 7.99 4.35 0.00 3.22 3.40 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 0.00 169 K 8.31 4.01 0.00 1.84 1.91 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.66 7.81 170 S 8.02 4.27 0.00 3.85 3.91 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 0.00 171 A 7.62 4.01 1.04 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 0.00 0.00 172 Y 7.65 4.82 0.00 3.23 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 0.00 173 P 0.00 4.51 0.00 2.07 2.04 0.00 3.86 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 2.05 2.22 0.00 174 G 8.99 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 0.00 175 Q 8.20 4.55 0.00 2.46 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.40 6.58 0.00 0.00 0.00 0.00 0.00 2.29 2.60 0.00 176 I 7.84 4.44 1.98 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 1.87 0.95 0.99 0.00 0.00 177 T 8.18 4.66 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 1.27 0.00 0.00 178 S 8.54 4.38 0.00 4.01 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 N 8.13 4.93 0.00 3.03 3.12 0.00 0.00 6.64 9.28 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 0.00 180 M 7.79 5.62 0.00 1.78 1.98 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.61 0.00 181 F 8.67 5.08 0.00 3.07 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 0.00 182 C 9.06 5.55 0.00 2.97 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 0.00 183 A 9.25 4.99 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 184A G 6.79 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 0.00 184 Y 8.24 4.64 0.00 3.08 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 0.00 185 L 8.68 4.12 0.00 1.73 1.73 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.20 4.02 0.00 2.10 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 2.38 2.29 0.00 187 G 7.69 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 188A G 9.46 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 0.00 0.00 0.00 0.00 188 K 7.13 5.29 0.00 1.49 1.74 0.00 0.91 0.00 0.00 1.98 0.00 0.00 2.29 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.44 1.10 7.81 189 D 8.41 4.62 0.00 2.77 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 0.00 190 S 8.67 4.98 0.00 4.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 C 9.10 4.76 0.00 2.94 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 0.00 192 Q 8.51 4.39 0.00 2.43 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.18 5.74 0.00 0.00 0.00 0.00 0.00 2.50 2.53 0.00 193 G 8.53 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.73 4.64 0.00 2.99 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 0.00 195 S 7.95 4.28 0.00 3.96 3.91 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 0.00 196 G 9.00 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 0.00 0.00 0.00 197 G 8.08 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 0.00 0.00 0.00 0.00 198 P 0.00 5.13 0.00 2.33 2.37 0.00 3.71 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 2.23 2.24 0.00 199 V 8.47 4.60 2.28 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 0.88 0.00 0.00 0.79 0.00 0.00 200 V 8.87 4.80 2.12 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 0.68 0.00 0.00 0.62 0.00 0.00 201 C 8.58 5.07 0.00 2.80 2.85 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 0.00 202 S 9.91 3.82 0.00 3.96 3.91 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 0.00 203 G 8.66 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 0.00 0.00 0.00 204 K 7.51 4.72 0.00 1.74 1.63 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.40 7.81 *209 L 8.27 4.25 0.00 1.51 1.64 1.02 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 8.94 4.58 0.00 1.97 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.35 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 211 G 8.02 5.37 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 0.00 212 I 8.19 5.18 1.93 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.98 1.05 0.00 0.00 213 V 9.02 3.69 2.37 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 0.97 0.00 0.00 1.18 0.00 0.00 214 S 8.54 4.98 0.00 3.91 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 0.00 215 W 7.50 4.96 0.00 3.35 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 0.00 216 G 8.02 3.55 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 0.00 0.00 0.00 217 S 8.38 4.73 0.00 4.21 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 *219 G 8.08 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.14 4.97 0.00 2.94 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 221A A 9.06 3.97 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 0.00 221 Q 7.30 4.58 0.00 2.32 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 7.14 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 222 K 8.41 4.15 0.00 1.72 1.71 0.00 1.93 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.56 7.81 223 N 9.23 4.28 0.00 2.79 2.79 0.00 0.00 6.75 7.64 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 0.00 224 K 7.51 4.38 0.00 1.69 1.79 0.00 1.67 0.00 0.00 1.36 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.50 7.81 225 P 0.00 4.59 0.00 2.13 2.11 0.00 3.68 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.01 0.00 226 G 8.48 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.62 4.39 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 0.30 0.00 0.00 -0.79 0.00 0.00 228 Y 8.26 4.89 0.00 1.43 2.28 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 0.00 229 T 8.48 4.44 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 230 K 9.25 5.13 0.00 2.17 1.97 0.00 1.82 0.00 0.00 1.80 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.66 7.81 231 V 8.73 3.97 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 1.16 0.00 0.00 1.13 0.00 0.00 232 C 8.36 4.36 0.00 3.17 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 0.00 233 N 8.04 4.29 0.00 2.35 2.41 0.00 0.00 6.92 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 0.00 234 Y 7.95 4.82 0.00 3.16 3.29 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 0.00 235 V 8.07 3.67 2.12 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 1.12 0.00 0.00 1.11 0.00 0.00 236 S 8.10 4.13 0.00 3.97 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 0.00 237 W 8.25 4.16 0.00 3.46 3.61 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 0.00 0.00 0.00 0.00 238 I 8.33 3.02 1.98 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.95 0.72 0.00 0.00 239 K 8.09 3.74 0.00 1.79 1.78 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.62 7.81 240 Q 7.95 3.90 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.10 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 241 T 7.59 3.76 3.50 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 0.00 0.00 0.00 0.81 0.00 0.00 242 I 7.21 2.54 0.56 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.49 -0.45 0.00 0.00 243 A 7.47 4.09 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 0.00 244 S 7.23 4.73 0.00 3.74 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 0.00 245 N 7.92 4.69 0.00 3.04 2.99 0.00 0.00 6.93 7.27 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 * Residues marked with a * may have inaccurate shift predictions.