NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 S 4.3379 8.3349 117.1004 58.0266 64.3453 173.2875 *2 T 4.1709 7.8654 117.3808 63.7774 69.6218 173.8029 3 K 4.2783 8.4971 127.3508 56.7316 33.5113 174.9647 4 H 5.5564 8.9331 124.0076 54.0194 31.4723 173.1300 5 I 4.8295 8.5294 114.9052 59.5647 41.6679 173.4925 6 H 5.3313 8.6843 119.6700 53.6529 30.2642 174.7024 7 W 4.5157 8.9218 134.8564 57.5604 30.9123 175.4686 8 D 4.3792 8.5483 124.9894 52.7736 39.5290 176.9282 9 G 2.7449 5.3800 108.2162 44.8528 0.0000 173.4550 10 N 4.8435 7.5801 116.4119 50.8396 40.4990 174.4931 11 L 4.0729 8.3905 120.5832 55.2043 42.4815 177.4180 12 S 4.4859 8.7396 120.0066 57.7518 62.5411 174.4273 13 Q 4.0845 8.5950 129.8515 58.7540 28.7351 178.2292 14 E 4.0737 8.2906 120.1130 59.2897 29.9552 178.9349 15 G 3.6745 8.0193 105.4328 47.6308 0.0000 175.2410 16 F 4.1478 8.4427 123.0848 61.3848 39.4440 177.1228 17 E 3.9159 8.4511 118.0286 59.4015 29.3374 179.5674 18 I 3.7212 7.7224 119.8122 64.3472 36.9823 178.8624 19 V 3.6656 7.4312 118.5038 64.3557 31.4304 177.9950 20 K 3.8913 7.8647 120.1343 58.1908 32.5668 177.6580 21 G 3.6513 7.3671 107.5557 44.5891 0.0000 172.3472 22 E 4.0830 8.6794 122.7831 57.8067 29.6881 177.2797 23 G 3.9194 9.5074 114.3615 45.5915 0.0000 173.7184 24 G 3.9919 7.7233 107.9542 45.0501 0.0000 173.8278 25 V 4.5851 8.5531 121.7755 61.1541 35.0916 173.8141 26 I 5.0761 8.4392 119.8791 59.1836 41.7827 173.8670 27 V 4.6656 8.4906 122.4872 61.6468 33.9470 174.0602 28 C 5.0922 8.8586 125.9890 57.4395 35.2561 171.4907 29 P 4.3397 0.0000 0.0000 62.6655 31.5639 175.3808 30 T 4.7464 8.4706 112.1151 59.5204 72.0777 174.8333 31 K 3.9243 8.5622 120.2404 59.0219 31.9255 178.7015 32 V 4.4461 8.4847 105.9293 59.9921 33.5049 175.5379 33 G 4.3091 5.8659 113.2003 45.6602 0.0000 174.9249 34 Y 5.2568 8.2463 123.1661 55.6939 41.9366 172.8439 35 I 5.0486 8.8891 116.2990 59.3009 41.4830 175.0626 36 I 4.9332 8.8043 125.2077 59.7901 39.7854 174.5264 *38 T 4.4931 8.1171 112.9662 61.8731 70.3115 174.3878 39 S 4.6376 8.5266 112.1116 56.9648 64.3824 173.1247 40 D 4.7112 7.6784 120.4764 51.1231 43.3832 175.6832 41 K 3.8125 8.4662 120.0368 59.7303 31.5465 178.5971 42 K 3.9818 8.1594 118.2983 59.6177 32.0446 179.3636 43 G 3.6876 8.8049 106.2035 47.5400 0.0000 175.9346 44 L 4.1567 8.0252 121.3173 57.6594 41.6390 179.1681 45 E 3.9608 8.3661 118.7003 59.7365 29.4647 179.7153 46 R 3.9695 7.7161 116.7603 58.9898 30.1309 179.1310 47 K 3.9405 7.9545 118.8807 59.6143 32.3315 178.8562 48 F 3.9035 8.4780 118.0901 60.5053 38.6088 177.2642 49 E 3.9601 8.1234 117.4426 59.3786 29.5436 178.4579 50 A 4.1261 7.9568 119.5011 54.7747 18.5225 179.0874 51 K 4.1382 8.0751 117.5061 56.4086 33.2834 177.4258 52 K 3.8672 7.7161 119.4169 55.3361 29.2354 180.7313 53 R 4.3563 7.7747 122.0748 55.7694 31.7788 176.0252 54 N 4.5173 8.7163 123.6871 53.0446 38.0409 176.7226 55 R 4.1863 8.7034 121.6934 57.9182 29.7082 174.3547 56 N 4.5565 8.3140 113.6869 54.8930 38.9270 175.8589 57 K 4.4602 7.8083 120.8963 52.0033 31.5401 179.8680 58 P 4.8279 0.0000 0.0000 61.3863 32.0074 177.0539 59 G 3.9417 8.4375 108.4824 46.5860 0.0000 173.2354 60 V 4.4349 8.3725 113.4203 59.6331 34.8093 175.4609 61 V 4.1967 8.1894 123.0940 61.8323 32.7110 174.9162 62 L 4.3962 8.2071 129.1479 53.9560 42.0139 176.1182 63 C 4.6209 8.8400 123.2038 58.7603 28.8316 174.5264 64 G 4.2184 8.7127 111.9498 45.7343 0.0000 173.3025 65 S 3.8664 7.0471 121.7474 59.1045 68.1112 178.1028 *67 E 4.1214 8.7992 113.0714 55.6403 31.2913 176.6660 68 E 3.1467 7.3843 119.4398 58.5496 29.3995 178.4191 69 L 3.5110 7.0706 120.2098 58.4043 41.8307 179.4016 70 R 3.7822 7.5200 115.1441 58.6943 30.0987 178.3870 71 A 4.1605 7.7136 119.9381 54.0157 18.6257 178.5359 72 L 4.4337 7.2819 115.3632 54.3826 43.3469 176.0721 73 A 4.7743 6.5935 118.6994 49.6186 21.1798 176.8548 74 Q 4.1769 8.2986 120.2411 56.0296 29.3890 175.8747 75 L 4.9489 8.2877 121.6696 53.3984 46.2386 175.6269 76 T 4.6004 8.2482 110.6004 59.2212 71.6306 173.7602 77 P 4.2250 0.0000 0.0000 65.5116 31.1244 178.8472 78 E 3.8530 8.1122 117.0536 59.4668 29.4505 179.3306 79 I 3.9449 7.6253 119.7279 64.3956 37.2646 177.7507 80 D 4.3876 8.4139 118.8995 57.6198 40.8905 178.3959 81 A 4.0282 8.1485 120.9864 54.9314 17.9843 179.2030 82 F 4.1864 8.7230 119.6446 61.9236 39.4277 177.0243 83 Y 4.0737 8.3597 116.1876 61.0950 37.6117 178.2938 84 Q 4.0663 8.1991 120.4187 59.1890 29.0143 178.4288 85 K 3.9207 7.8370 120.7463 59.6954 32.1933 178.5990 86 H 3.9869 7.6932 115.2965 58.2987 28.5298 177.3579 87 W 4.0957 8.6557 130.6163 60.8847 30.3287 177.7561 88 D 4.4847 8.5276 117.5158 56.7166 40.3364 177.7073 89 E 4.3217 7.6882 115.6934 54.7104 31.0057 175.0042 90 D 4.0990 7.4713 117.1147 55.5378 39.7751 173.3450 91 I 4.4845 7.5439 118.9043 59.0005 39.8040 177.3507 92 L 4.3847 8.4953 129.2690 55.4602 42.7091 175.8956 93 L 4.5999 8.7429 127.7911 53.6082 45.9588 174.4435 94 G 4.5771 8.4045 111.5291 44.6560 0.0000 171.8680 95 C 5.2734 8.8954 120.6834 57.8479 32.5765 173.3971 96 I 4.7454 8.4005 124.5366 60.9376 37.2188 175.2923 97 L 5.0126 9.0057 126.5512 52.2372 46.2396 174.5442 98 P 5.0259 0.0000 0.0000 61.9359 33.1184 175.6378 99 W 4.9366 8.3078 121.6777 55.8292 30.3754 176.9597 100 K 4.0896 8.8903 123.1097 56.3498 32.6110 177.7099 101 A 4.1006 9.1305 126.0140 55.8439 18.3203 179.7215 102 E 4.0071 8.3082 116.6254 59.1909 29.7483 178.6498 103 A 4.2433 8.1824 120.7253 55.3407 18.6270 178.8236 104 Y 3.8677 8.5734 118.1874 60.4728 38.8320 177.8738 105 E 3.8935 8.2586 119.3963 59.3356 29.4263 179.1914 106 K 3.7652 7.6379 116.5434 59.4483 32.0733 178.4050 107 L 4.2217 8.1669 120.8330 58.6403 41.8514 179.4481 108 K 4.1102 7.8116 117.1930 58.7617 31.6699 179.0651 109 A 3.9353 7.5505 120.7778 55.4039 17.9828 178.7784 110 Y 4.1639 7.4788 114.0241 59.3523 37.6957 178.9081 111 G 3.9875 8.1689 106.4339 45.6756 0.0000 173.6626 112 D 4.5047 7.7917 117.4889 53.0075 39.7066 176.4898 113 G 3.8575 7.9942 108.2279 46.9552 0.0000 176.2569 114 R 3.8183 7.9635 117.9763 58.1914 29.6665 178.1840 115 E 3.7486 7.9897 118.0979 58.7454 29.6250 178.5928 116 E 3.9352 7.6610 119.1717 58.1376 30.0310 177.0826 117 L 4.3282 7.7368 118.8506 54.4074 42.1980 176.0279 *119 T 4.4984 7.7315 107.5945 61.6044 69.8998 172.8169 120 D 4.8214 8.1377 122.3569 51.7439 41.5469 177.1766 121 I 3.8150 8.1582 111.4831 63.7498 37.5891 177.0941 122 R 4.0578 8.0444 118.2666 56.8907 30.1333 177.0195 123 G 3.8188 8.4790 107.2467 45.5403 0.0000 172.9064 124 T 5.2641 8.6538 109.7989 60.1561 71.8709 173.3470 125 S 5.0541 8.9173 117.4812 57.0983 68.3031 172.5573 126 C 4.9715 8.4296 121.3079 58.5022 32.9290 171.9757 127 F 5.0541 9.0971 126.1504 56.0386 40.6030 175.1901 128 V 5.1844 8.7266 123.8963 61.0467 34.4287 174.2812 129 I 5.1806 8.5480 119.5795 58.7562 41.4651 174.7932 130 K 3.6535 8.5048 118.9586 57.4491 29.6612 176.0158 131 F 4.5288 7.9123 112.0087 56.9779 39.2374 173.7984 132 G 3.9603 7.4512 112.0796 44.0336 0.0000 174.0489 133 V 3.3263 7.8038 124.3244 65.9256 31.6511 177.9729 134 A 3.3592 6.8750 119.8665 55.1369 17.9485 179.7155 135 G 3.8060 7.6579 103.1863 47.4821 0.0000 175.7104 136 E 3.8706 7.7713 120.9039 59.3450 29.1130 179.2432 137 Q 4.0243 8.3422 118.3721 59.1977 28.6127 179.2255 138 I 3.9394 7.2225 117.6570 64.4579 37.2592 178.0922 139 A 4.2497 8.0596 120.4452 54.9682 18.3904 179.3784 140 K 4.3001 8.2121 118.1731 59.5956 32.2943 179.7190 141 E 4.2930 8.0243 115.5781 56.7690 29.2951 178.7100 *143 W 4.9594 7.9291 129.5439 57.7061 32.3845 177.3288 144 E 3.9933 8.6667 116.5027 58.3625 29.0255 178.0132 145 K 4.5018 8.1653 115.6210 56.4251 32.9136 176.4555 146 E 4.5598 7.5964 115.5851 54.5134 31.8367 176.0431 147 G 3.5234 7.8109 106.1112 46.4329 0.0000 174.0987 148 R 4.7801 6.9907 117.4894 54.3360 32.5426 175.3265 *150 V 3.6817 8.0226 117.6507 63.9119 32.8264 175.4254 151 Y 5.4665 8.7064 123.8857 56.6556 41.6344 174.2993 152 A 5.2508 8.4305 121.1332 52.4600 23.4412 175.0422 153 S 4.8832 8.1792 112.1515 56.9474 65.9505 173.6562 154 S 4.6381 8.5358 118.6683 58.2742 63.8434 174.5792 155 A 4.2444 8.8975 125.5526 51.9882 16.6807 179.2560 156 N 3.9668 8.4635 123.6734 53.9427 37.6464 176.5947 *162 N 4.6705 9.1958 132.3970 52.8027 39.3835 176.4451 163 R 4.0762 9.1110 115.1812 57.0558 26.8618 182.1982 164 G 4.0842 8.9892 107.0143 46.7482 0.0000 174.3939 165 K 5.0380 7.9532 120.8253 52.0590 35.0167 182.1192 166 V 2.9190 8.7987 125.3503 64.2857 31.3224 178.4764 167 E 4.1666 8.0880 114.3921 56.9993 29.7664 181.3836 168 G 3.9380 8.0597 106.4580 47.2966 0.0000 175.3087 169 I 3.8200 7.1882 113.5117 61.9810 38.1370 177.7016 170 G 3.9995 8.2114 108.2740 45.9911 0.0000 174.6434 171 E 3.9524 8.7485 119.3345 60.9239 29.5352 180.3208 172 R 4.0530 7.9088 118.2400 59.4693 30.2530 177.9729 173 I 3.8222 7.6675 117.7532 64.5785 37.2556 177.6414 174 E 4.0935 7.9288 118.7820 58.6036 29.7524 177.3645 175 S 4.4210 7.6961 113.3907 57.8849 64.5177 174.1532 *177 V 3.8830 7.0906 119.9135 64.0908 32.3395 174.2853 178 D 4.6741 8.4132 123.5137 56.3686 41.6131 176.6526 179 L 4.6484 7.6012 118.2803 53.8201 45.9384 173.8495 180 V 4.5068 8.4079 125.0395 61.1781 34.0433 174.0738 181 I 4.7570 8.3844 129.4951 60.2047 38.3677 175.1335 182 E 4.8333 8.9385 126.9868 54.2760 31.9497 176.5618 183 A 4.7222 8.5625 121.7122 49.7555 21.4177 177.6691 184 D 4.6810 8.5849 127.4243 58.8899 41.3010 179.4413 185 D 4.4648 8.2442 120.8105 58.4330 39.6448 179.6207 186 Y 4.3664 7.8009 119.9344 60.8993 38.9388 178.3829 187 V 3.5175 7.9207 118.2804 65.8140 31.1840 177.7065 188 A 4.1104 8.0443 120.8062 54.9364 18.0429 179.4925 189 S 4.1962 7.8132 111.2527 60.7891 63.1670 176.3425 190 I 3.8199 7.0458 122.1205 63.0693 38.3892 176.1659 191 Q 4.6478 7.5947 116.4792 53.9297 28.8337 174.5384 192 P 4.3535 0.0000 0.0000 64.7101 32.1158 177.5445 193 D 4.6357 7.9907 115.8069 53.1130 39.8283 175.7009 194 K 4.5212 7.8021 119.4487 55.0601 34.9600 174.5076 195 T 4.6261 8.3309 110.2189 59.3966 71.2268 175.0750 196 I 3.7112 8.2076 120.7464 63.9891 38.0569 176.7182 197 E 4.1397 8.1756 119.1087 58.3833 29.5442 177.3160 198 T 4.3057 7.2595 106.9201 61.2000 69.8902 175.2053 199 R 4.0313 7.6891 119.5275 55.8439 30.1799 176.1836 200 Y 4.2444 8.2366 117.9942 58.5275 38.2967 175.9900 201 E 4.6772 8.7959 121.2722 56.1142 30.9242 175.1163 202 Q 4.6021 7.7358 116.5991 55.2022 32.2090 173.6779 203 G 4.1460 8.4053 107.1322 45.0013 0.0000 174.6366 204 V 4.3854 7.6312 119.0938 61.7068 34.2555 173.8239 *206 V 3.9260 8.2166 118.3113 63.1645 32.9169 176.6165 207 S 4.7147 8.7700 123.7563 57.4900 64.3735 172.6766 *209 V 4.3804 8.0729 120.0902 61.6393 32.5250 175.6433 210 D 4.7571 8.8949 122.2129 52.0584 41.3803 176.9732 211 K 4.0526 8.5176 117.0642 59.5294 32.6175 177.1542 212 D 4.5476 8.6310 118.4630 54.2013 41.1013 177.2599 213 G 3.9296 8.4789 110.6380 45.5925 0.0000 174.5278 214 K 4.2896 7.8129 121.4154 53.0149 32.7391 180.9041 215 L 4.2440 8.5109 124.4540 54.6847 42.3994 177.1375 216 I 3.9201 8.0977 118.3936 60.1677 38.2029 174.0735 217 P 4.5147 0.0000 0.0000 62.1079 31.9384 176.4609 218 Q 4.2860 8.4146 119.8760 56.4141 28.6829 176.2102 219 Q 4.1358 8.7522 123.9033 55.9576 29.8330 176.5190 220 G 3.9701 8.9733 104.6795 45.3074 0.0000 174.4929 221 A 4.0622 8.6083 126.0831 54.2222 18.4948 177.7259 222 D 4.7911 7.9100 113.0813 52.9511 40.2323 176.6712 223 S 4.5443 7.8605 115.0980 58.0876 62.7267 173.6098 224 R 4.6353 7.7379 118.4381 55.7338 33.5607 175.5944 225 S 3.8590 8.7633 115.2315 59.4174 60.5745 172.8216 226 V 3.8882 7.1308 118.0908 62.7870 31.9434 175.0066 227 E 4.7483 8.3077 124.8131 53.8943 33.4438 173.5376 228 P 4.5119 0.0000 0.0000 62.8977 32.0638 174.9714 229 C 4.7491 7.9734 113.4641 55.8560 32.8621 171.7889 230 P 4.3987 0.0000 0.0000 62.9998 32.2073 175.8626 231 V 4.7976 8.3635 122.1186 61.0575 34.9245 174.5077 232 V 4.1073 8.8211 129.1616 62.9946 31.8087 176.0183 233 I 4.4037 8.4147 120.8625 60.2507 39.8169 175.1514 234 R 4.6497 7.4737 123.4610 54.5810 33.3271 174.2502 235 K 4.2011 8.9023 127.3718 56.1870 33.3724 176.5992 236 G 3.7837 7.9531 109.5045 45.3649 0.0000 171.4671 237 L 3.2898 7.7269 120.9551 56.8601 42.3163 177.4867 238 D 4.5197 8.5699 123.8259 55.3639 38.3906 175.6430 239 I 3.6593 7.1905 121.4482 64.1640 37.8297 176.6018 240 D 4.5272 7.9688 118.8889 56.5787 39.3242 178.4011 241 K 4.1409 7.8760 118.4277 58.1658 33.6290 178.8580 242 I 4.0684 7.3279 120.9526 61.4466 33.0628 175.7858 *245 H 4.8627 8.0371 120.0179 55.6755 31.4374 176.0608 246 L 4.1473 8.2808 119.6381 57.8066 41.3570 179.5977 247 S 4.6622 8.1609 111.2424 60.8845 63.4603 175.0469 248 D 4.5464 8.3014 120.2312 56.2306 40.8793 176.5990 249 Q 4.3448 7.6984 117.5311 55.8450 30.4964 175.3836 250 F 4.9722 8.2984 115.4728 55.7157 42.1944 174.7468 251 N 4.6645 9.0831 121.0162 54.5368 38.9005 175.1740 252 S 4.5201 8.1477 112.6158 56.3919 64.7397 172.5447 253 W 5.3219 8.1854 123.3024 55.6591 31.0884 173.2921 254 N 5.1095 9.2318 117.4660 51.5857 41.8317 173.0278 255 Y 4.9717 8.6005 122.5720 55.9577 40.3662 176.1299 256 R 4.6067 8.3311 126.0794 53.6204 30.7707 173.9183 257 Q 3.7513 7.7039 120.7508 57.7924 29.8157 176.6788 258 G 3.9356 8.5486 113.0736 45.7325 0.0000 173.2688 259 E 4.3475 7.8597 119.4925 56.2977 29.5859 176.7409 *260 Y 4.2203 7.4923 123.3985 57.7088 37.7927 177.4221 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 0 S 8.33 4.34 0.00 3.65 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 *2 T 7.87 4.17 4.49 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 1.28 0.00 0.00 3 K 8.50 4.28 0.00 1.91 1.70 0.00 1.59 0.00 0.00 1.85 0.00 0.00 3.00 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.53 1.57 7.81 4 H 8.93 5.56 0.00 3.01 3.16 0.00 5.71 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 I 8.53 4.83 1.95 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.28 0.96 0.00 0.00 6 H 8.68 5.33 0.00 3.09 3.33 0.00 5.70 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 W 8.92 4.52 0.00 3.26 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 8 D 8.55 4.38 0.00 2.60 2.61 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 9 G 5.38 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 0.00 0.00 0.00 10 N 7.58 4.84 0.00 2.77 2.75 0.00 0.00 6.88 8.34 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 11 L 8.39 4.07 0.00 1.61 1.62 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.74 4.49 0.00 4.09 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 13 Q 8.59 4.08 0.00 2.15 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.69 0.00 0.00 0.00 0.00 0.00 2.46 2.37 0.00 14 E 8.29 4.07 0.00 2.09 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 2.42 2.42 0.00 15 G 8.02 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 0.00 0.00 0.00 16 F 8.44 4.15 0.00 3.16 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.45 3.92 0.00 2.10 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.61 0.00 18 I 7.72 3.72 2.00 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 1.59 1.22 0.91 0.00 0.00 19 V 7.43 3.67 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 0.67 0.00 0.00 0.89 0.00 0.00 20 K 7.86 3.89 0.00 1.14 1.77 0.00 1.58 0.00 0.00 1.60 0.00 0.00 3.02 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.33 1.26 7.81 21 G 7.37 3.65 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 0.00 0.00 0.00 22 E 8.68 4.08 0.00 1.93 1.90 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 2.29 2.32 0.00 23 G 9.51 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 1.44 1.47 7.81 32 V 8.48 4.45 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 0.70 0.00 0.00 0.94 0.00 0.00 33 G 5.87 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 0.00 0.00 0.00 34 Y 8.25 5.26 0.00 2.97 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 35 I 8.89 5.05 1.93 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.93 0.89 0.00 0.00 36 I 8.80 4.93 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.55 0.91 0.00 0.00 *38 T 8.12 4.49 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 1.38 0.00 0.00 39 S 8.53 4.64 0.00 3.82 3.82 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 40 D 7.68 4.71 0.00 3.01 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 41 K 8.47 3.81 0.00 1.76 1.80 0.00 1.42 0.00 0.00 1.67 0.00 0.00 3.15 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.54 1.47 7.81 42 K 8.16 3.98 0.00 1.79 1.85 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.52 1.45 7.81 43 G 8.80 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 0.00 0.00 0.00 44 L 8.03 4.16 0.00 1.86 1.73 0.74 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 45 E 8.37 3.96 0.00 2.10 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 2.48 2.47 0.00 46 R 7.72 3.97 0.00 2.09 2.00 0.00 3.13 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 47 K 7.95 3.94 0.00 2.05 1.99 0.00 1.43 0.00 0.00 1.55 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.39 1.48 7.81 48 F 8.48 3.90 0.00 3.12 3.11 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 49 E 8.12 3.96 0.00 2.29 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.20 0.00 50 A 7.96 4.13 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 K 8.08 4.14 0.00 1.66 1.80 0.00 1.80 0.00 0.00 1.78 0.00 0.00 2.85 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.38 1.48 7.81 52 K 7.72 3.87 0.00 1.95 1.74 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.29 1.23 7.81 53 R 7.77 4.36 0.00 1.54 1.51 0.00 2.74 0.00 0.00 2.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.44 0.00 54 N 8.72 4.52 0.00 2.69 2.70 0.00 0.00 6.93 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 55 R 8.70 4.19 0.00 1.82 1.88 0.00 3.23 0.00 0.00 3.22 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.22 0.00 56 N 8.31 4.56 0.00 2.73 2.91 0.00 0.00 6.69 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 57 K 7.81 4.46 0.00 1.77 1.63 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.30 1.25 7.81 58 P 0.00 4.83 0.00 2.07 2.05 0.00 3.69 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.12 0.00 59 G 8.44 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 60 V 8.37 4.43 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 0.72 0.00 0.00 0.88 0.00 0.00 61 V 8.19 4.20 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 0.97 0.00 0.00 0.80 0.00 0.00 62 L 8.21 4.40 0.00 1.46 1.33 0.69 -0.13 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 63 C 8.84 4.62 0.00 3.12 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 64 G 8.71 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 65 S 7.05 3.87 0.00 3.74 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 *67 E 8.80 4.12 0.00 1.94 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 0.00 2.21 1.88 0.00 68 E 7.38 3.15 0.00 1.16 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 1.56 1.47 0.00 69 L 7.07 3.51 0.00 1.35 1.24 0.16 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 70 R 7.52 3.78 0.00 1.67 1.85 0.00 3.12 0.00 0.00 3.12 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.45 0.00 71 A 7.71 4.16 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 72 L 7.28 4.43 0.00 1.24 1.13 0.97 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 73 A 6.59 4.77 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 Q 8.30 4.18 0.00 1.95 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.64 0.00 0.00 0.00 0.00 0.00 2.40 2.36 0.00 75 L 8.29 4.95 0.00 1.36 1.46 0.76 0.62 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 76 T 8.25 4.60 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 77 P 0.00 4.22 0.00 2.16 2.12 0.00 3.61 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 78 E 8.11 3.85 0.00 1.97 1.55 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 2.12 2.30 0.00 79 I 7.63 3.94 1.98 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.09 1.15 0.00 0.00 80 D 8.41 4.39 0.00 2.75 2.84 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 81 A 8.15 4.03 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 82 F 8.72 4.19 0.00 3.25 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 Y 8.36 4.07 0.00 3.30 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 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0.00 1.84 1.57 0.99 0.95 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 93 L 8.74 4.60 0.00 1.52 1.33 0.68 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 94 G 8.40 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.90 5.27 0.00 3.14 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 96 I 8.40 4.75 1.90 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 1.26 0.50 0.96 0.00 0.00 97 L 9.01 5.01 0.00 1.64 1.47 0.90 0.82 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 98 P 0.00 5.03 0.00 2.12 2.01 0.00 3.59 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 2.11 2.28 0.00 99 W 8.31 4.94 0.00 3.05 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 K 8.89 4.09 0.00 1.96 1.82 0.00 1.83 0.00 0.00 1.79 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.46 7.81 101 A 9.13 4.10 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 E 8.31 4.01 0.00 2.15 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 103 A 8.18 4.24 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 0.00 0.00 0.00 0.00 0.00 0.00 104 Y 8.57 3.87 0.00 3.18 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 0.00 105 E 8.26 3.89 0.00 2.28 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 2.59 2.54 0.00 106 K 7.64 3.77 0.00 2.25 1.87 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.48 1.33 7.81 107 L 8.17 4.22 0.00 1.50 1.31 0.83 -0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 108 K 7.81 4.11 0.00 1.78 1.68 0.00 1.58 0.00 0.00 1.37 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.95 0.88 7.81 109 A 7.55 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 Y 7.48 4.16 0.00 3.09 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 0.00 111 G 8.17 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 0.00 112 D 7.79 4.50 0.00 2.79 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 0.00 113 G 7.99 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 0.00 0.00 0.00 114 R 7.96 3.82 0.00 1.75 2.13 0.00 2.84 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.46 0.00 115 E 7.99 3.75 0.00 1.98 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 1.92 2.04 0.00 116 E 7.66 3.94 0.00 1.82 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 2.17 2.18 0.00 117 L 7.74 4.33 0.00 1.44 1.33 0.16 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 *119 T 7.73 4.50 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 1.22 0.00 0.00 120 D 8.14 4.82 0.00 2.93 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 I 8.16 3.81 1.87 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 1.42 0.60 0.91 0.00 0.00 122 R 8.04 4.06 0.00 1.84 2.02 0.00 3.23 0.00 0.00 3.43 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 123 G 8.48 3.82 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 0.00 0.00 0.00 124 T 8.65 5.26 4.43 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 125 S 8.92 5.05 0.00 3.38 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 0.00 126 C 8.43 4.97 0.00 3.00 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 0.00 127 F 9.10 5.05 0.00 3.00 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 0.00 128 V 8.73 5.18 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 1.10 0.00 0.00 0.91 0.00 0.00 129 I 8.55 5.18 2.31 0.00 0.00 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 1.58 1.29 1.26 0.00 0.00 130 K 8.50 3.65 0.00 1.97 1.87 0.00 1.48 0.00 0.00 1.18 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.09 1.07 7.81 131 F 7.91 4.53 0.00 3.25 3.27 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 0.00 132 G 7.45 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 0.00 0.00 0.00 133 V 7.80 3.33 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.96 0.00 0.00 134 A 6.87 3.36 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 G 7.66 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 E 7.77 3.87 0.00 1.94 1.81 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 1.47 1.47 0.00 137 Q 8.34 4.02 0.00 2.23 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.56 0.00 138 I 7.22 3.94 1.96 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 1.60 0.66 1.06 0.00 0.00 139 A 8.06 4.25 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 K 8.21 4.30 0.00 2.10 2.04 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.34 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.56 1.62 7.81 141 E 8.02 4.29 0.00 2.28 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 2.27 2.17 0.00 *143 W 7.93 4.96 0.00 3.48 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 E 8.67 3.99 0.00 2.22 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 0.00 2.49 2.58 0.00 145 K 8.17 4.50 0.00 1.96 1.88 0.00 1.90 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.39 7.81 146 E 7.60 4.56 0.00 1.97 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 2.45 2.35 0.00 147 G 7.81 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 0.00 148 R 6.99 4.78 0.00 1.87 1.88 0.00 3.15 0.00 0.00 3.13 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 *150 V 8.02 3.68 2.01 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 0.90 0.00 0.00 0.89 0.00 0.00 151 Y 8.71 5.47 0.00 2.82 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 0.00 152 A 8.43 5.25 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 0.00 0.00 0.00 0.00 0.00 0.00 153 S 8.18 4.88 0.00 3.75 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 0.00 154 S 8.54 4.64 0.00 3.92 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 0.00 155 A 8.90 4.24 1.31 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 0.00 0.00 156 N 8.46 3.97 0.00 2.87 2.28 0.00 0.00 7.21 8.00 0.00 0.00 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 N 9.20 4.67 0.00 3.17 3.15 0.00 0.00 6.06 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 0.00 163 R 9.11 4.08 0.00 2.02 1.93 0.00 3.27 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.18 0.00 164 G 8.99 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 0.00 165 K 7.95 5.04 0.00 1.59 1.62 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.25 1.20 7.81 166 V 8.80 2.92 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 0.71 0.00 0.00 0.53 0.00 0.00 167 E 8.09 4.17 0.00 2.01 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.87 0.00 168 G 8.06 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 0.00 169 I 7.19 3.82 1.82 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.58 0.79 0.00 0.00 170 G 8.21 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 0.00 0.00 0.00 171 E 8.75 3.95 0.00 1.99 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 2.31 1.94 0.00 172 R 7.91 4.05 0.00 1.79 1.99 0.00 3.22 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.73 0.00 173 I 7.67 3.82 1.85 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 1.51 0.63 0.89 0.00 0.00 174 E 7.93 4.09 0.00 2.09 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 2.33 2.49 0.00 175 S 7.70 4.42 0.00 4.09 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 *177 V 7.09 3.88 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 0.90 0.00 0.00 0.96 0.00 0.00 178 D 8.41 4.67 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 0.00 179 L 7.60 4.65 0.00 1.74 1.45 0.98 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 180 V 8.41 4.51 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 0.73 0.00 0.00 0.78 0.00 0.00 181 I 8.38 4.76 1.90 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 1.29 0.74 0.98 0.00 0.00 182 E 8.94 4.83 0.00 1.69 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.19 0.00 183 A 8.56 4.72 1.53 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 0.00 0.00 184 D 8.58 4.68 0.00 2.82 2.87 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 0.00 185 D 8.24 4.46 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 0.00 186 Y 7.80 4.37 0.00 3.12 3.41 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 0.00 187 V 7.92 3.52 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.85 0.00 0.00 188 A 8.04 4.11 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 0.00 189 S 7.81 4.20 0.00 4.03 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 0.00 190 I 7.05 3.82 1.83 0.00 0.00 0.46 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 0.55 0.86 0.00 0.00 191 Q 7.59 4.65 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 192 P 0.00 4.35 0.00 2.03 2.10 0.00 3.65 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 2.01 2.20 0.00 193 D 7.99 4.64 0.00 2.78 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 0.00 194 K 7.80 4.52 0.00 1.85 1.79 0.00 1.59 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.37 1.45 7.81 195 T 8.33 4.63 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 0.00 196 I 8.21 3.71 1.87 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 1.41 0.82 0.91 0.00 0.00 197 E 8.18 4.14 0.00 1.98 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 2.30 2.28 0.00 198 T 7.26 4.31 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 1.16 0.00 0.00 199 R 7.69 4.03 0.00 1.96 2.02 0.00 3.07 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.59 0.00 200 Y 8.24 4.24 0.00 3.03 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 0.00 201 E 8.80 4.68 0.00 1.96 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 2.23 2.27 0.00 202 Q 7.74 4.60 0.00 2.09 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.83 0.00 0.00 0.00 0.00 0.00 2.39 2.51 0.00 203 G 8.41 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 V 7.63 4.39 2.01 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 1.15 0.00 0.00 0.84 0.00 0.00 *206 V 8.22 3.93 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 0.65 0.00 0.00 0.85 0.00 0.00 207 S 8.77 4.71 0.00 3.91 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 *209 V 8.07 4.38 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 0.96 0.00 0.00 210 D 8.89 4.76 0.00 2.83 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 0.00 211 K 8.52 4.05 0.00 2.14 1.99 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.03 7.81 212 D 8.63 4.55 0.00 2.78 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 0.00 213 G 8.48 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 K 7.81 4.29 0.00 1.70 1.69 0.00 1.82 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.43 0.99 7.81 215 L 8.51 4.24 0.00 1.58 1.63 0.94 1.05 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 0.00 216 I 8.10 3.92 1.87 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.74 0.91 0.00 0.00 217 P 0.00 4.51 0.00 2.09 2.04 0.00 3.87 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 2.04 2.11 0.00 218 Q 8.41 4.29 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.05 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 219 Q 8.75 4.14 0.00 2.31 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.53 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 220 G 8.97 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 0.00 221 A 8.61 4.06 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 0.00 222 D 7.91 4.79 0.00 2.78 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 0.00 223 S 7.86 4.54 0.00 4.05 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 0.00 224 R 7.74 4.64 0.00 1.84 1.80 0.00 3.28 0.00 0.00 3.34 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 225 S 8.76 3.86 0.00 4.00 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 0.00 226 V 7.13 3.89 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 0.79 0.00 0.00 0.97 0.00 0.00 227 E 8.31 4.75 0.00 1.93 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 2.21 2.32 0.00 228 P 0.00 4.51 0.00 2.03 1.98 0.00 3.66 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 2.03 2.07 0.00 229 C 7.97 4.75 0.00 3.16 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 0.00 230 P 0.00 4.40 0.00 1.61 1.39 0.00 3.49 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 1.08 0.00 231 V 8.36 4.80 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.99 0.00 0.00 232 V 8.82 4.11 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 0.91 0.00 0.00 0.90 0.00 0.00 233 I 8.41 4.40 1.82 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.25 0.86 0.00 0.00 234 R 7.47 4.65 0.00 1.82 1.72 0.00 3.17 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 235 K 8.90 4.20 0.00 1.86 1.79 0.00 2.12 0.00 0.00 1.88 0.00 0.00 3.04 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.63 1.62 7.81 236 G 7.95 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 0.00 237 L 7.73 3.29 0.00 1.53 1.51 0.96 1.25 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 0.00 238 D 8.57 4.52 0.00 2.82 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 0.00 239 I 7.19 3.66 1.91 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.71 0.95 0.00 0.00 240 D 7.97 4.53 0.00 2.89 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 0.00 241 K 7.88 4.14 0.00 1.70 1.81 0.00 1.71 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.39 1.49 7.81 242 I 7.33 4.07 1.85 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.73 0.94 0.00 0.00 *245 H 8.04 4.86 0.00 3.41 3.37 0.00 5.64 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 0.00 246 L 8.28 4.15 0.00 0.89 0.35 -0.01 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 247 S 8.16 4.66 0.00 4.24 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 0.00 248 D 8.30 4.55 0.00 2.91 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 0.00 249 Q 7.70 4.34 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.59 0.00 0.00 0.00 0.00 0.00 2.03 1.34 0.00 250 F 8.30 4.97 0.00 3.10 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 0.00 251 N 9.08 4.66 0.00 2.79 2.92 0.00 0.00 6.70 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 0.00 252 S 8.15 4.52 0.00 3.84 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 0.00 253 W 8.19 5.32 0.00 3.36 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 254 N 9.23 5.11 0.00 2.73 2.75 0.00 0.00 6.83 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 0.00 255 Y 8.60 4.97 0.00 3.11 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 256 R 8.33 4.61 0.00 1.62 1.72 0.00 3.36 0.00 0.00 3.11 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 257 Q 7.70 3.75 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.81 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 258 G 8.55 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 0.00 259 E 7.86 4.35 0.00 1.93 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 2.45 2.21 0.00 *260 Y 7.49 4.22 0.00 2.27 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.