NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.3630 8.3344 115.5578 58.0834 64.8495 172.4675 *4 L 4.2161 8.1309 122.0867 55.4720 43.3207 175.4454 5 T 5.2084 8.6739 121.7600 61.9686 71.9995 173.3979 6 I 4.5395 8.9739 127.4875 60.4428 40.0515 175.9614 7 G 3.9475 10.0596 113.5931 46.5699 0.0000 174.4576 8 G 3.9211 8.6838 107.1019 44.5539 0.0000 173.8460 9 K 4.3459 7.8579 121.4225 54.4754 33.9073 175.2416 10 S 5.0366 7.9476 121.2862 56.9952 64.7405 173.5556 11 F 4.9152 8.6584 121.2917 55.7528 42.1961 175.5821 12 Q 4.1345 9.1597 124.4985 58.3722 28.8965 176.6047 13 S 4.6759 8.6751 112.5418 57.2016 63.5955 173.5659 14 R 4.4500 8.5656 124.9793 56.1879 31.2970 174.9653 15 L 4.9628 7.7772 122.6162 53.5556 43.2781 175.5166 16 L 4.6729 9.0440 127.6919 53.2833 43.5722 175.2662 17 L 5.0210 8.4799 126.4331 53.2213 44.2143 175.7407 18 G 4.3478 9.1253 114.3344 46.1220 0.0000 172.9232 19 T 4.9951 9.0313 112.0793 60.4637 71.6076 173.4373 20 G 2.7685 8.9344 110.1786 45.2999 0.0000 174.9457 21 K 4.3615 7.5426 117.7513 56.1269 32.6210 175.7761 22 Y 4.2014 7.7335 116.8945 56.6432 38.5732 175.0462 23 P 4.3508 0.0000 0.0000 65.4087 31.8758 176.8422 24 S 4.3013 7.2413 112.8853 56.3078 67.0902 175.9111 25 F 4.4178 8.1119 121.4730 60.5220 38.6880 177.9099 26 D 4.3625 8.0750 118.4349 57.4809 40.7419 178.5608 27 I 3.6807 7.7083 120.3332 64.2482 37.0519 178.2680 28 Q 2.7403 7.9971 120.3574 58.6569 28.8721 178.1913 29 K 3.8039 8.0036 120.5998 59.5908 32.1952 178.3527 30 E 3.9122 8.2058 119.2857 58.9962 29.6347 178.5994 31 A 3.9118 8.1633 121.3195 55.1077 18.2312 179.6698 32 V 3.4217 7.7260 115.5873 65.9916 31.9031 177.7670 33 A 4.2002 7.9641 120.2806 55.5245 18.1460 180.1638 34 V 3.7351 7.7762 109.2203 63.9428 31.6304 178.5328 35 S 4.2809 7.9252 113.1188 58.9405 63.0474 174.6392 36 E 3.8647 7.8396 119.3904 56.9292 27.5219 174.4151 37 S 4.3249 7.9834 113.3538 58.7759 63.0016 173.5757 38 D 5.1116 8.7747 124.7045 54.6265 43.4201 175.7575 39 I 4.9448 7.4984 118.9539 59.3739 39.7953 174.5794 40 L 5.1706 8.8046 127.2976 53.2083 44.1710 175.5626 41 T 5.3718 8.9719 118.1486 59.7735 70.6733 172.5562 42 F 5.0444 7.4075 118.3936 55.9454 41.2496 173.1913 43 A 4.6710 8.7334 122.9884 51.1106 18.0712 178.4302 44 V 3.7449 7.9525 115.9564 65.2825 31.9347 178.5925 45 R 2.0000 7.4850 118.5384 58.0427 30.2183 177.0846 46 R 4.2523 7.1035 118.5527 54.4032 28.8710 175.1500 *48 N 5.5671 8.1323 117.7860 52.7271 39.6815 177.7731 49 I 3.7580 7.8959 110.9863 63.2461 37.6044 176.6998 50 F 4.2908 8.2224 118.3754 58.6037 39.7893 175.7019 51 E 4.7030 7.8033 114.4470 55.8009 32.2152 176.0540 52 A 4.2560 8.8750 125.7926 52.7693 18.4444 177.7604 53 S 4.7098 8.0439 111.7261 59.6254 63.8168 173.8478 54 Q 4.5645 7.5448 119.2376 53.4693 32.2725 173.2088 55 P 4.4647 0.0000 0.0000 62.6214 32.1208 175.3509 56 N 4.4986 8.2442 117.4922 51.4145 38.7132 175.7783 57 F 4.9267 7.6416 118.8761 58.4248 40.8650 176.2254 58 L 3.6470 7.9834 121.5107 56.0454 39.7332 174.2562 59 E 3.7704 7.5212 118.1508 57.2204 29.8048 176.6446 60 Q 3.5573 8.5041 121.4899 56.4145 26.5824 173.0642 61 L 4.7247 7.2229 116.5806 53.0994 43.6995 176.9138 62 D 4.6646 8.4601 122.8474 52.3140 39.6963 176.2248 63 L 4.3171 8.3257 124.8295 57.2412 42.0810 179.4065 64 S 4.2091 7.9382 111.5870 60.0010 62.4042 174.4864 65 K 4.2187 8.1543 118.3924 56.6016 31.9390 175.1823 66 Y 5.1807 7.4293 115.7910 56.8846 42.7537 174.3678 67 T 4.8122 9.1859 117.9876 62.3203 70.8589 173.9935 68 L 5.0738 9.5369 127.2451 53.6624 43.6518 175.9769 69 L 5.1834 8.8507 127.1104 52.2747 41.6895 173.3720 70 P 3.7294 0.0000 0.0000 61.9080 32.9803 175.8234 71 N 5.8219 9.0331 119.0552 50.1479 41.1671 174.2739 72 T 4.7173 8.0007 106.5045 61.0027 69.5950 174.3781 73 A 4.1396 8.0029 125.2826 54.8380 18.7563 178.0368 74 G 4.0573 9.0002 110.2920 45.8428 0.0000 174.5151 75 A 4.2800 8.1381 123.3867 52.3020 18.8331 178.0402 76 S 4.3678 9.6643 118.2511 58.7908 64.8959 174.8539 77 T 4.8260 7.5584 109.2362 58.6980 72.9774 174.4127 78 A 3.9535 9.2816 123.8032 55.5564 18.3618 179.9171 79 E 3.9023 8.1855 116.4406 59.7693 29.5434 179.4101 80 E 4.0227 8.1251 118.2432 59.1250 29.4117 179.2304 81 A 3.9689 7.9176 120.9902 55.1982 18.4139 179.8558 82 V 3.3959 8.0713 117.1138 65.8919 31.5936 178.2071 83 R 3.8854 8.0333 118.5169 59.5025 29.9800 178.5785 84 I 4.0137 7.8926 119.3100 64.4370 37.1632 178.2541 85 A 4.0448 8.2107 121.7145 55.3277 18.1152 179.8713 86 R 4.1687 8.2611 116.6980 59.4696 30.1462 179.1242 87 L 3.8950 8.0550 119.8021 57.9334 42.0145 178.8376 88 A 4.1768 8.3814 120.9224 55.1014 18.3966 179.5836 89 K 3.9611 8.4330 117.9834 59.6409 32.1230 179.0099 90 A 4.0898 8.1733 119.9695 54.4921 18.3612 178.5514 91 S 4.4614 7.8852 109.6805 57.9679 62.6729 174.3111 92 G 3.9729 7.9081 108.2559 47.3514 0.0000 173.8653 93 L 4.8800 7.9469 117.8334 53.8294 42.5116 176.6021 94 C 4.6728 8.1700 118.6537 58.4681 33.4345 172.8442 95 D 4.6499 8.6891 126.7835 54.6724 41.6723 176.4626 *97 I 4.0235 7.3630 119.9126 60.6406 39.9250 173.8798 98 K 4.7858 8.7042 131.0863 55.0880 33.5072 175.4544 99 V 4.1251 8.4570 129.4102 62.2812 32.5783 174.5076 100 E 4.8684 9.3403 129.7164 54.6603 32.1364 175.3430 101 V 4.4660 8.4010 127.4157 60.8043 33.5434 173.6484 102 I 4.1773 8.1344 128.2652 60.9138 37.4705 176.2489 103 G 4.1374 8.9192 112.9324 45.9353 0.0000 172.6465 104 C 4.7667 7.7752 121.1547 57.4627 34.0794 174.8481 105 S 4.1332 8.7724 122.3436 60.9149 63.2211 175.6897 106 R 4.0848 8.0338 120.8906 58.8892 30.1034 177.3272 107 S 4.2909 7.9659 109.9425 58.4928 63.7344 174.6432 108 L 3.8407 8.1397 119.0125 55.2731 39.5778 174.4072 109 L 4.5230 7.5383 118.9656 53.8009 42.7518 174.9943 110 P 4.8379 0.0000 0.0000 62.9619 32.6816 175.3535 111 D 4.6553 9.0191 122.9177 52.7930 41.6600 175.2155 112 P 4.2168 0.0000 0.0000 65.9628 31.3160 178.5537 113 V 3.5401 7.7504 117.5550 65.8637 31.5234 177.8045 114 E 4.0483 8.6102 118.2143 59.4649 29.1988 179.5318 115 T 3.8959 8.0238 116.0990 66.4423 68.5088 176.8070 116 L 3.9549 8.0540 121.0256 57.5514 41.6341 179.4815 117 K 3.8846 8.0913 119.2934 59.5445 32.1170 178.7657 118 A 3.9720 8.3053 121.3989 55.1635 18.2519 179.7713 119 S 4.0175 8.2253 113.7946 61.6839 62.9419 176.5630 120 E 3.9101 8.1944 121.9713 59.2124 29.5205 178.6310 121 Q 3.9296 8.0305 119.5568 59.3668 29.2279 178.3116 122 L 4.0039 8.1258 120.0696 57.5201 41.4451 179.6053 123 L 4.1113 7.9916 119.3076 57.8257 41.3794 179.0148 124 E 3.9978 8.0070 118.0271 59.0711 29.5886 177.7770 125 E 4.4911 7.9286 115.7436 56.2161 29.6889 177.2924 126 G 3.9149 8.2151 107.4966 45.4466 0.0000 173.9262 127 F 4.4662 8.2700 117.7411 56.8981 40.2814 175.3157 128 I 4.1304 8.3653 121.6321 60.3133 37.9551 175.3504 129 V 4.5179 8.6248 127.5380 61.1898 34.0477 174.4083 130 L 5.1801 8.8557 127.4081 52.2649 44.3562 173.4591 131 P 5.0146 0.0000 0.0000 62.2432 32.5431 175.2237 132 Y 4.4542 8.8388 126.0459 57.6635 39.7384 174.1674 133 T 4.3732 7.6143 119.7378 60.6765 71.9601 172.1165 134 S 4.6156 8.1122 117.1767 57.5291 65.1196 173.7488 135 D 4.7040 8.2651 120.5656 53.6603 39.7143 176.0936 136 D 4.3762 7.8525 120.2390 54.5962 41.3390 176.2406 137 V 3.5619 8.3889 126.9691 66.3801 31.6528 178.0341 138 V 3.5729 7.7236 117.3581 65.6953 31.4279 177.3680 139 L 3.8697 8.4505 120.1660 58.0243 41.8383 178.8210 140 A 3.9504 7.8134 120.1432 55.2963 18.2686 179.6518 141 R 3.8527 7.6970 116.5817 59.3643 29.8749 178.8160 142 K 4.1082 7.9683 117.8669 59.3945 32.3369 178.9853 143 L 4.1217 8.0136 119.1652 57.8816 41.6806 179.2844 144 E 3.9818 8.2679 118.4926 59.5969 29.2083 179.2873 145 E 4.1056 8.2986 117.3049 58.7552 29.5182 178.8897 146 L 4.2410 7.6595 118.7099 55.8493 41.6783 177.7331 147 G 4.1720 7.7775 107.4121 45.4453 0.0000 174.3799 148 V 3.8100 7.5710 111.8083 61.6884 31.9785 175.9335 149 H 4.7274 8.7694 118.0976 56.5546 29.0867 175.0363 150 A 4.6399 7.3708 117.6666 51.4667 22.0483 175.3863 151 I 4.6971 7.9983 113.1943 58.4170 41.4949 172.2245 *153 P 4.5106 0.0000 0.0000 62.9346 32.6412 176.3591 154 G 4.5793 8.4778 111.3726 44.4061 0.0000 173.9370 155 A 4.0671 8.5602 126.2165 54.8085 18.2861 177.5262 156 S 4.6717 7.5436 107.9435 56.7647 65.7548 172.0531 157 P 4.3543 0.0000 0.0000 62.4610 31.4842 176.2718 158 I 3.7466 8.3641 121.9945 63.2657 37.2525 176.6022 159 G 3.9221 8.8901 112.4447 45.8076 0.0000 174.4854 160 S 4.0841 8.2240 115.4102 59.1008 63.2319 175.6320 161 G 3.9012 8.1205 106.6976 46.1595 0.0000 174.0174 162 Q 4.1126 8.1091 118.0079 55.8082 29.4533 177.6162 163 G 3.8239 8.1502 106.0801 45.3035 0.0000 172.2486 164 I 4.0794 8.2549 120.9117 60.7564 38.0281 176.7438 165 L 4.3261 8.4873 128.7936 56.3634 42.4662 176.9230 166 N 4.9788 7.6281 116.4687 49.8031 38.7852 172.2795 167 P 4.1102 0.0000 0.0000 65.1621 31.5860 178.4113 168 L 3.6532 7.8152 119.6790 58.1435 42.0804 178.5218 169 N 4.5708 8.3030 116.3800 56.2973 38.3865 177.1792 170 L 3.9073 7.8685 121.7537 58.1424 42.0410 179.1863 171 S 4.0068 8.0898 115.4078 61.6198 62.8009 176.6952 172 F 4.4608 7.9422 120.3505 60.6742 38.5004 177.8427 173 I 3.7804 8.1249 119.8080 64.3070 36.7014 178.5844 174 I 3.7230 7.8032 113.0491 64.1795 37.5456 177.9650 175 E 4.1401 8.4105 119.7446 58.3211 29.3319 178.4027 176 Q 4.3130 7.8055 115.3387 56.0982 29.7685 176.1871 177 A 4.8466 7.0838 123.3658 52.0783 18.8230 177.2991 178 K 4.5382 9.6554 119.4428 56.1563 33.4836 176.2449 179 V 4.7716 7.4418 111.0766 58.2002 35.9356 173.4738 180 P 4.6592 0.0000 0.0000 63.2897 32.6664 175.2356 181 V 4.7965 9.1735 121.6095 61.2126 34.0013 173.9389 182 I 4.8341 8.3122 128.6323 58.8645 40.1072 175.1051 183 V 3.9177 8.4397 130.5380 63.0193 32.7859 173.9825 184 D 5.2434 9.0748 127.9522 53.1417 43.3499 176.4776 185 A 3.7369 9.8576 130.7026 52.7236 18.5721 177.4536 186 G 4.1340 8.4584 103.8864 46.6871 0.0000 173.5222 187 I 4.3775 7.3894 120.1592 60.6273 38.0853 175.7613 188 G 4.0059 8.9360 112.2063 46.3136 0.0000 172.7848 189 S 4.6115 7.7868 112.1561 55.1310 66.1289 172.8644 190 P 4.2734 0.0000 0.0000 65.7403 30.7908 178.8362 191 K 3.9912 8.0936 117.0194 60.2478 32.1547 178.8346 192 D 4.4555 8.2479 119.7528 57.0001 40.5585 178.5729 193 A 4.0793 7.9507 119.6556 55.0451 18.6940 179.0390 194 A 4.2278 8.4680 119.7793 55.4953 18.4878 179.1348 195 Y 4.4987 8.1978 117.8494 60.8162 38.8877 178.5419 196 A 3.6021 7.7810 117.8077 53.3891 18.1960 178.7223 *198 E 4.4040 8.0939 120.9432 57.6707 31.4143 177.1239 199 L 4.1287 7.6725 116.6070 55.2822 41.8909 177.5820 200 G 3.0128 7.8582 106.4116 44.5573 0.0000 173.8634 201 A 4.0436 7.2371 121.8996 52.2181 18.7487 178.0204 202 D 4.5436 8.6378 120.0656 55.3400 41.9411 176.3274 203 G 4.0090 7.2300 104.6527 46.0341 0.0000 172.1266 204 V 4.9629 8.1699 118.7086 60.9168 35.4481 173.6175 205 L 5.1707 9.0317 129.6610 53.4019 44.1656 175.0235 206 L 4.8902 9.0466 126.0792 54.4053 45.7956 175.5863 207 N 5.0279 8.8185 116.0722 52.7742 40.1788 176.1909 208 T 3.8386 7.9206 112.3474 63.5267 69.0843 176.0126 209 A 4.0163 7.9290 122.1259 54.6992 18.5534 179.0262 210 V 3.8732 7.7503 116.4530 65.5971 31.9375 178.4616 211 S 3.5954 7.6432 113.4292 60.5357 62.4164 175.5051 212 G 3.6982 7.9738 109.4381 45.6547 0.0000 173.8089 213 A 4.2504 7.3675 122.8924 51.6381 19.0479 177.5569 214 D 4.4698 8.6077 119.4760 56.7025 41.0501 176.6077 215 D 4.8039 7.5663 117.6493 50.8169 41.2369 172.5703 216 P 4.6146 0.0000 0.0000 65.2359 32.3302 178.2183 217 V 3.7282 7.9789 117.2760 65.9442 31.6813 178.7344 218 K 4.0338 8.3082 118.6612 56.7428 31.3116 178.1542 *220 A 4.2803 8.0823 121.5718 51.7131 20.5416 179.0631 221 R 3.9856 8.0024 115.4496 59.4434 30.4415 178.9500 222 A 3.8463 8.2331 117.6483 52.8961 18.1298 178.8482 *224 K 4.2272 8.1995 121.3416 57.9350 34.0426 178.0620 225 L 4.0195 7.9733 118.4365 57.6558 41.3532 179.3753 226 A 4.0030 8.2033 120.8239 55.2307 18.3494 179.8884 227 V 3.5749 7.7461 116.2603 66.1199 31.5920 177.9878 228 E 3.9719 8.2450 118.0816 59.2382 29.2664 179.1390 229 A 4.0975 8.5201 121.3997 55.2214 18.5208 179.9413 230 G 3.6806 8.4409 106.0175 47.3669 0.0000 175.9429 231 R 4.0137 8.0869 121.0738 59.1493 30.0816 178.5597 232 L 4.0171 8.2134 119.0318 57.8869 41.6183 179.4119 233 S 4.0922 8.3433 113.1388 61.5146 62.1018 175.4133 234 Y 4.2960 7.9214 121.0252 61.0834 38.6081 177.9218 235 E 3.9312 8.1486 117.8219 58.9884 29.6687 178.6338 236 A 4.2560 8.0599 119.4735 51.7801 19.7541 175.9068 237 G 3.5643 7.4122 106.6538 45.1279 0.0000 173.8148 238 R 4.1275 7.8065 120.0100 55.9041 30.5526 177.6497 239 I 3.8838 7.9423 112.5396 60.0635 38.2451 174.1600 240 P 4.5807 0.0000 0.0000 61.9103 32.6970 175.0092 241 L 4.3756 8.0639 118.2612 53.2091 42.4031 177.0874 242 K 3.7896 8.5076 124.8849 56.4735 32.6841 175.8534 243 Q 4.4008 8.1685 124.5741 54.7928 29.3333 175.0204 244 Y 4.3143 8.6216 121.0123 57.5398 38.9219 175.8992 245 G 3.8250 8.1326 107.2081 46.8500 0.0000 173.4266 246 T 4.4446 7.6360 108.5678 59.2166 71.0612 175.2158 247 A 4.0896 8.4134 124.1498 54.8623 18.3443 178.7782 248 S 4.4121 7.7501 108.6727 59.8857 63.6134 175.1555 249 S 4.5266 8.0248 117.7207 55.2303 63.1058 169.1660 250 P 4.3318 0.0000 0.0000 65.3642 31.4487 176.5018 251 G 3.9529 9.0104 111.4790 44.3309 0.0000 172.7438 252 E 4.1260 8.0145 124.4391 56.7533 30.1749 174.3271 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 2 S 8.33 4.36 0.00 3.92 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 *4 L 8.13 4.22 0.00 1.91 1.81 0.98 0.64 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 5 T 8.67 5.21 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 1.25 0.00 0.00 6 I 8.97 4.54 2.18 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 1.33 1.26 1.05 0.00 0.00 7 G 10.06 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 0.00 0.00 0.00 8 G 8.68 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 9 K 7.86 4.35 0.00 1.72 1.69 0.00 1.60 0.00 0.00 1.74 0.00 0.00 2.85 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.43 1.08 7.81 10 S 7.95 5.04 0.00 3.74 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 11 F 8.66 4.92 0.00 3.02 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 12 Q 9.16 4.13 0.00 2.28 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.32 0.00 13 S 8.68 4.68 0.00 3.99 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 14 R 8.57 4.45 0.00 1.83 2.03 0.00 3.19 0.00 0.00 3.38 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.67 0.00 15 L 7.78 4.96 0.00 1.67 1.59 0.98 0.97 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 16 L 9.04 4.67 0.00 1.58 1.51 0.83 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 17 L 8.48 5.02 0.00 1.79 1.49 0.98 0.90 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 18 G 9.13 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 19 T 9.03 5.00 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 1.23 0.00 0.00 20 G 8.93 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 0.00 0.00 0.00 21 K 7.54 4.36 0.00 1.42 1.57 0.00 1.58 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.12 1.12 7.81 22 Y 7.73 4.20 0.00 2.93 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 23 P 0.00 4.35 0.00 2.16 2.17 0.00 4.00 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.98 0.00 24 S 7.24 4.30 0.00 4.11 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 25 F 8.11 4.42 0.00 3.13 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 D 8.08 4.36 0.00 2.78 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 27 I 7.71 3.68 2.00 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 0.65 0.96 0.00 0.00 28 Q 8.00 2.74 0.00 1.96 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.79 0.00 0.00 0.00 0.00 0.00 2.08 1.76 0.00 29 K 8.00 3.80 0.00 1.98 1.95 0.00 1.58 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.49 7.81 30 E 8.21 3.91 0.00 2.19 2.02 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 2.29 2.35 0.00 31 A 8.16 3.91 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 32 V 7.73 3.42 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 0.50 0.00 0.00 0.80 0.00 0.00 33 A 7.96 4.20 1.43 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 0.00 0.00 0.00 34 V 7.78 3.74 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 0.84 0.00 0.00 1.04 0.00 0.00 35 S 7.93 4.28 0.00 4.09 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 36 E 7.84 3.86 0.00 2.22 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 2.29 2.26 0.00 37 S 7.98 4.32 0.00 3.89 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 D 8.77 5.11 0.00 2.84 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 39 I 7.50 4.94 1.69 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.61 0.78 0.00 0.00 40 L 8.80 5.17 0.00 1.69 1.61 0.36 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 41 T 8.97 5.37 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 42 F 7.41 5.04 0.00 3.32 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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2.16 2.16 0.00 52 A 8.88 4.26 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 53 S 8.04 4.71 0.00 3.99 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 54 Q 7.54 4.56 0.00 1.96 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 7.05 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 55 P 0.00 4.46 0.00 2.25 2.18 0.00 3.74 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.15 0.00 56 N 8.24 4.50 0.00 2.65 2.83 0.00 0.00 6.11 7.43 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 57 F 7.64 4.93 0.00 3.07 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 58 L 7.98 3.65 0.00 1.72 1.57 0.05 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 59 E 7.52 3.77 0.00 1.25 1.12 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 1.47 1.83 0.00 60 Q 8.50 3.56 0.00 2.23 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.50 0.00 0.00 0.00 0.00 0.00 2.20 2.22 0.00 61 L 7.22 4.72 0.00 1.80 1.60 0.86 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 62 D 8.46 4.66 0.00 2.71 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.33 4.32 0.00 1.83 1.81 0.96 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 64 S 7.94 4.21 0.00 3.79 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 65 K 8.15 4.22 0.00 0.82 1.25 0.00 1.59 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.58 1.36 7.81 66 Y 7.43 5.18 0.00 2.86 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 67 T 9.19 4.81 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 1.39 0.00 0.00 68 L 9.54 5.07 0.00 1.74 2.00 1.14 0.51 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 77 T 7.56 4.83 4.36 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 1.21 0.00 0.00 78 A 9.28 3.95 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 79 E 8.19 3.90 0.00 2.07 2.02 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 2.40 2.47 0.00 80 E 8.13 4.02 0.00 2.11 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 0.00 2.35 2.33 0.00 81 A 7.92 3.97 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 82 V 8.07 3.40 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 1.04 0.00 0.00 0.92 0.00 0.00 83 R 8.03 3.89 0.00 2.05 2.15 0.00 3.18 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 84 I 7.89 4.01 2.07 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.87 0.99 0.00 0.00 85 A 8.21 4.04 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 R 8.26 4.17 0.00 2.08 2.08 0.00 3.17 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.89 0.00 87 L 8.06 3.89 0.00 1.62 1.74 0.71 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 88 A 8.38 4.18 1.57 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 89 K 8.43 3.96 0.00 2.22 1.86 0.00 1.55 0.00 0.00 1.62 0.00 0.00 2.87 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.36 1.15 7.81 90 A 8.17 4.09 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 91 S 7.89 4.46 0.00 3.97 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 G 7.91 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 93 L 7.95 4.88 0.00 1.85 1.97 1.00 0.82 0.00 0.00 0.00 0.00 0.00 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0.67 0.99 0.00 0.00 103 G 8.92 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 0.00 104 C 7.78 4.77 0.00 2.91 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 0.00 105 S 8.77 4.13 0.00 4.02 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 0.00 106 R 8.03 4.08 0.00 1.79 1.98 0.00 3.23 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 107 S 7.97 4.29 0.00 4.03 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 0.00 108 L 8.14 3.84 0.00 1.84 1.84 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 109 L 7.54 4.52 0.00 1.61 1.58 0.93 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 110 P 0.00 4.84 0.00 1.95 2.00 0.00 3.70 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 1.80 1.26 0.00 111 D 9.02 4.66 0.00 2.73 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.22 0.00 2.27 2.25 0.00 3.73 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 2.00 0.00 113 V 7.75 3.54 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 1.05 0.00 0.00 0.92 0.00 0.00 114 E 8.61 4.05 0.00 2.02 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 2.59 2.49 0.00 115 T 8.02 3.90 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 1.19 0.00 0.00 116 L 8.05 3.95 0.00 1.95 1.70 0.92 0.53 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 0.00 117 K 8.09 3.88 0.00 1.94 1.95 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.45 7.81 118 A 8.31 3.97 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 S 8.23 4.02 0.00 4.04 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 0.00 120 E 8.19 3.91 0.00 2.15 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 0.00 2.31 2.32 0.00 121 Q 8.03 3.93 0.00 2.22 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.57 0.00 0.00 0.00 0.00 0.00 2.35 2.53 0.00 122 L 8.13 4.00 0.00 1.65 1.36 0.63 0.18 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 0.00 123 L 7.99 4.11 0.00 1.92 1.76 1.01 0.96 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 0.00 124 E 8.01 4.00 0.00 2.02 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 2.36 2.38 0.00 125 E 7.93 4.49 0.00 2.45 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 0.00 2.43 2.51 0.00 126 G 8.22 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 0.00 0.00 0.00 127 F 8.27 4.47 0.00 3.02 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 0.00 128 I 8.37 4.13 1.90 0.00 0.00 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 1.21 0.77 0.84 0.00 0.00 129 V 8.62 4.52 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 1.10 0.00 0.00 1.07 0.00 0.00 130 L 8.86 5.18 0.00 1.64 1.57 0.96 0.70 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 0.00 131 P 0.00 5.01 0.00 2.05 2.04 0.00 4.09 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 132 Y 8.84 4.45 0.00 2.90 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 0.00 133 T 7.61 4.37 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 1.10 0.00 0.00 134 S 8.11 4.62 0.00 3.94 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 0.00 135 D 8.27 4.70 0.00 2.76 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 0.00 136 D 7.85 4.38 0.00 2.74 2.56 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 0.00 137 V 8.39 3.56 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 0.94 0.00 0.00 1.11 0.00 0.00 138 V 7.72 3.57 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 1.02 0.00 0.00 0.87 0.00 0.00 139 L 8.45 3.87 0.00 1.84 1.86 0.89 0.76 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 0.00 140 A 7.81 3.95 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 0.00 141 R 7.70 3.85 0.00 1.89 2.03 0.00 3.09 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.66 0.00 142 K 7.97 4.11 0.00 1.93 1.84 0.00 1.76 0.00 0.00 1.87 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.66 1.61 7.81 143 L 8.01 4.12 0.00 1.87 1.69 0.87 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 144 E 8.27 3.98 0.00 2.18 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 2.33 2.55 0.00 145 E 8.30 4.11 0.00 2.07 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 0.00 2.34 2.56 0.00 146 L 7.66 4.24 0.00 1.77 1.72 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 147 G 7.78 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 0.00 148 V 7.57 3.81 2.25 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 0.78 0.00 0.00 1.00 0.00 0.00 149 H 8.77 4.73 0.00 3.05 3.42 0.00 5.89 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 A 7.37 4.64 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 0.00 151 I 8.00 4.70 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.92 0.90 0.00 0.00 *153 P 0.00 4.51 0.00 2.11 2.20 0.00 3.90 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.95 0.00 154 G 8.48 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 0.00 155 A 8.56 4.07 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 0.00 156 S 7.54 4.67 0.00 3.98 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 0.00 157 P 0.00 4.35 0.00 2.21 2.25 0.00 3.63 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.14 0.00 158 I 8.36 3.75 1.83 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.42 0.82 0.00 0.00 159 G 8.89 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 0.00 160 S 8.22 4.08 0.00 4.00 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 G 8.12 3.90 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 0.00 0.00 0.00 170 L 7.87 3.91 0.00 1.68 1.67 0.85 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 171 S 8.09 4.01 0.00 3.75 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 0.00 172 F 7.94 4.46 0.00 3.28 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 0.00 173 I 8.12 3.78 2.02 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.35 0.90 0.00 0.00 174 I 7.80 3.72 1.82 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.51 0.89 0.00 0.00 175 E 8.41 4.14 0.00 2.20 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 0.00 2.40 2.36 0.00 176 Q 7.81 4.31 0.00 2.23 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.85 0.00 0.00 0.00 0.00 0.00 2.58 2.37 0.00 177 A 7.08 4.85 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 0.00 178 K 9.66 4.54 0.00 1.69 1.82 0.00 1.65 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.37 7.81 179 V 7.44 4.77 2.27 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 0.75 0.00 0.00 1.00 0.00 0.00 180 P 0.00 4.66 0.00 2.13 2.22 0.00 3.80 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.23 0.00 181 V 9.17 4.80 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 1.04 0.00 0.00 0.92 0.00 0.00 182 I 8.31 4.83 1.85 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 1.10 1.18 0.95 0.00 0.00 183 V 8.44 3.92 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 0.87 0.00 0.00 0.86 0.00 0.00 184 D 9.07 5.24 0.00 2.85 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 0.00 185 A 9.86 3.74 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 0.00 186 G 8.46 4.13 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 Y 8.20 4.50 0.00 3.16 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 A 7.78 3.60 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 *198 E 8.09 4.40 0.00 2.41 2.25 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 2.32 2.58 0.00 199 L 7.67 4.13 0.00 1.63 1.56 0.30 0.91 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 0.00 200 G 7.86 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 0.00 0.00 0.00 201 A 7.24 4.04 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 0.00 202 D 8.64 4.54 0.00 2.53 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 0.00 203 G 7.23 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 V 8.17 4.96 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 0.79 0.00 0.00 0.91 0.00 0.00 205 L 9.03 5.17 0.00 1.68 1.47 0.92 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 206 L 9.05 4.89 0.00 1.55 1.47 0.92 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 207 N 8.82 5.03 0.00 2.75 2.66 0.00 0.00 5.79 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 T 7.92 3.84 4.13 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 1.10 0.00 0.00 209 A 7.93 4.02 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 0.00 210 V 7.75 3.87 2.18 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 1.24 0.00 0.00 0.95 0.00 0.00 211 S 7.64 3.60 0.00 3.27 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 G 7.97 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 0.00 213 A 7.37 4.25 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 0.00 214 D 8.61 4.47 0.00 2.67 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 0.00 215 D 7.57 4.80 0.00 2.58 2.54 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 0.00 216 P 0.00 4.61 0.00 2.26 2.44 0.00 3.78 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.26 0.00 217 V 7.98 3.73 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 0.96 0.00 0.00 0.92 0.00 0.00 218 K 8.31 4.03 0.00 1.95 1.90 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.40 7.81 *220 A 8.08 4.28 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 0.00 221 R 8.00 3.99 0.00 1.91 2.14 0.00 3.11 0.00 0.00 3.18 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 222 A 8.23 3.85 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *224 K 8.20 4.23 0.00 1.94 2.06 0.00 1.87 0.00 0.00 2.01 0.00 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.43 1.50 7.81 225 L 7.97 4.02 0.00 1.91 1.72 0.93 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 226 A 8.20 4.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.75 3.57 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.94 0.00 0.00 228 E 8.25 3.97 0.00 2.25 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 0.00 2.36 2.64 0.00 229 A 8.52 4.10 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 0.00 230 G 8.44 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 0.00 0.00 0.00 231 R 8.09 4.01 0.00 2.06 2.19 0.00 3.27 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.92 0.00 232 L 8.21 4.02 0.00 2.06 1.74 0.99 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 233 S 8.34 4.09 0.00 4.01 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 0.00 234 Y 7.92 4.30 0.00 3.06 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 0.00 235 E 8.15 3.93 0.00 2.17 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 2.40 2.59 0.00 236 A 8.06 4.26 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 0.00 237 G 7.41 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 0.00 0.00 0.00 238 R 7.81 4.13 0.00 1.94 1.98 0.00 3.08 0.00 0.00 3.32 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 239 I 7.94 3.88 1.86 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 1.47 0.59 0.90 0.00 0.00 240 P 0.00 4.58 0.00 2.18 2.11 0.00 3.74 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 1.95 1.96 0.00 241 L 8.06 4.38 0.00 1.63 1.65 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 242 K 8.51 3.79 0.00 1.55 1.35 0.00 1.63 0.00 0.00 1.40 0.00 0.00 2.70 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.53 1.15 7.81 243 Q 8.17 4.40 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.73 0.00 0.00 0.00 0.00 0.00 2.25 2.42 0.00 244 Y 8.62 4.31 0.00 2.96 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 0.00 245 G 8.13 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 0.00 246 T 7.64 4.44 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 1.24 0.00 0.00 247 A 8.41 4.09 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 0.00 248 S 7.75 4.41 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 0.00 249 S 8.02 4.53 0.00 3.90 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 0.00 250 P 0.00 4.33 0.00 2.05 2.05 0.00 3.65 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 251 G 9.01 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 0.00 0.00 0.00 252 E 8.01 4.13 0.00 2.14 1.94 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 2.27 2.24 0.00 * Residues marked with a * may have inaccurate shift predictions.