NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.2204 8.3027 121.4701 55.9118 29.7829 173.9672 2 V 4.2649 8.0373 126.6092 60.4503 32.3785 173.7019 3 T 4.7571 9.3811 117.1401 60.5850 73.3392 171.9522 4 L 5.1030 8.5738 122.5559 53.0864 45.7642 175.1284 5 Q 4.5783 8.8837 123.7503 54.5154 31.9125 174.3570 6 E 5.6723 9.1823 125.8445 55.4872 31.4611 175.3844 7 S 4.5173 8.6813 113.6890 58.5629 65.8198 175.8421 8 G 4.0040 9.2717 108.6356 45.2383 0.0000 174.5312 9 G 3.9558 6.8576 107.5039 43.8013 0.0000 171.0732 10 G 3.6470 7.6543 104.6520 43.8673 0.0000 171.9476 11 L 4.8632 8.2129 122.9320 54.7399 42.9988 177.8314 12 V 4.5893 8.8312 125.0187 59.7427 35.4223 174.4022 13 Q 4.6177 8.6308 124.1973 55.2379 30.2396 173.6113 14 P 4.5247 0.0000 0.0000 64.2644 31.8252 177.0389 15 G 3.9225 9.6619 111.7854 45.4554 0.0000 173.8637 16 G 4.1455 8.0859 107.9225 45.4130 0.0000 172.7142 17 S 5.2499 8.2922 112.7186 57.1171 66.4039 173.0840 18 M 4.6625 9.0879 119.4423 54.2485 36.0322 173.0494 19 K 4.7745 8.4235 125.4984 54.6068 34.6338 174.9453 20 L 4.8054 8.7734 127.6191 53.3843 44.1579 175.7508 21 S 5.4822 9.0611 117.8065 57.0452 67.1371 172.4513 22 C 5.4045 8.9473 121.4759 55.0572 46.6293 172.3047 23 A 5.0943 9.0933 128.6564 50.1869 20.7881 175.5179 24 A 5.2342 7.9925 124.9261 50.5061 21.9089 175.9115 25 S 4.2939 8.6396 111.2532 59.1132 66.2788 177.8410 26 G 4.3299 11.1911 109.5247 46.6129 0.0000 172.6736 27 F 4.9324 7.0749 112.2780 55.7960 40.8160 175.5052 28 T 4.1868 8.4311 118.3344 62.8804 66.4161 174.9140 29 F 3.7384 8.1801 128.4802 60.8330 39.7610 177.5625 30 S 4.2248 8.1430 113.4134 60.8300 62.8676 174.7386 31 D 4.5496 7.7732 119.2631 55.7798 41.1914 176.7961 32 A 4.5984 7.5233 119.9582 51.6729 19.4230 176.8801 33 W 4.8671 8.8672 119.8658 55.1392 31.6738 175.5494 34 V 4.7601 8.5247 123.9126 61.2447 33.8310 174.0693 35 D 5.5859 9.0849 126.1624 52.3069 45.4950 174.4361 36 W 5.0509 8.8493 119.5279 54.9844 32.5566 175.0662 37 V 5.0694 9.2049 123.7220 61.1071 34.7093 174.3388 38 R 5.0507 9.1234 122.7608 54.3517 33.2529 173.9298 39 Q 5.6642 9.1289 120.5092 53.4915 32.5597 174.0157 40 S 5.0238 8.4641 118.6891 56.1703 66.8114 171.6740 41 P 4.4701 0.0000 0.0000 64.2790 31.6890 175.7461 42 G 4.4586 9.1180 118.7774 45.9126 0.0000 174.9318 43 K 4.2038 7.3096 116.2662 55.7798 33.8016 179.5658 44 G 3.8414 8.0207 107.8863 46.6439 0.0000 174.1405 45 L 4.8309 8.5438 124.7054 53.9945 42.6097 175.5237 46 E 4.7989 9.3542 124.0715 53.9691 32.7772 174.4054 47 W 4.5926 9.3204 135.0000 58.0585 31.4245 174.6264 48 V 3.9740 7.9483 125.3492 63.6953 33.2268 174.9177 49 A 4.3606 6.7106 118.8748 51.2127 22.7047 174.0076 50 E 5.3101 8.8442 119.0315 54.9571 33.9991 173.7472 51 I 4.9155 8.6314 125.0078 59.3830 41.0670 175.5072 52 R 3.5896 8.5232 129.1489 54.9476 32.3390 175.2418 52A N 4.5251 7.7758 117.7632 51.9763 39.3292 176.2302 52B K 3.3757 8.6932 118.5268 59.5786 31.8664 178.2339 52C A 4.0465 8.0203 119.3590 54.3960 18.0235 177.8833 53 N 4.8103 8.1662 114.3713 52.8955 39.5179 175.1766 54 N 4.0044 8.2067 115.9197 54.5249 37.9381 173.2969 55 H 4.3245 8.5020 109.0873 54.6119 27.2810 174.8963 56 A 4.2581 7.3419 119.7091 52.4417 19.2254 177.6620 57 T 5.0267 8.3788 110.4922 59.9014 71.8378 173.6792 58 K 4.8274 8.5429 121.3236 55.1727 36.6297 174.9918 59 Y 5.1141 8.6730 119.7254 56.3293 42.2806 174.9416 60 T 4.4197 8.3262 116.3734 61.7562 68.6520 174.8939 61 E 3.9339 9.3732 129.1805 59.6263 29.5115 179.3084 62 S 4.2995 8.0806 109.9420 60.0127 63.1124 174.6355 63 V 3.8457 7.6072 113.1603 60.3308 33.0715 175.7054 64 K 3.7041 7.4135 119.8295 58.0184 32.2603 176.6493 65 G 4.0446 8.6789 111.5555 45.0931 0.0000 174.1365 66 R 4.4533 7.9836 117.6900 56.9218 32.2876 176.5885 67 F 5.5132 7.9723 115.6070 56.1931 41.5266 175.8150 68 T 4.7367 9.0474 118.3683 61.9568 72.1038 172.6465 69 I 5.1826 9.2391 127.4768 59.6384 40.1346 174.5181 70 S 4.9997 8.9781 122.1249 57.4016 66.9680 172.5930 71 R 5.0906 8.4380 115.3121 54.8865 32.8539 174.4718 72 D 4.7603 9.3469 120.0370 52.5788 43.1522 175.8430 73 D 4.6862 8.9097 127.2612 56.9696 41.2593 179.2340 74 S 4.2524 8.0526 112.6178 60.1498 63.0628 174.9909 75 K 4.3487 7.8183 118.3077 55.1933 32.9262 175.8203 76 S 2.7900 7.5945 114.3200 59.4864 61.0399 171.7018 77 S 4.8701 7.0821 112.7302 56.6247 67.6494 174.0701 78 V 4.7799 8.1402 120.4392 61.4677 35.1714 173.8813 79 Y 5.5294 9.4100 123.3562 56.1842 42.3929 174.5886 80 L 4.5224 8.9326 123.4025 53.3849 45.0139 174.9604 81 Q 4.5150 9.1140 129.6940 55.1855 30.5730 174.0468 82 M 4.4869 9.0652 127.2262 53.4029 34.4377 174.9104 82A N 5.1513 8.6926 120.2870 50.9414 42.5542 174.0839 82B S 3.6949 8.5512 113.3932 59.4879 60.6846 173.5087 82C L 4.3319 7.8998 119.6651 55.1383 42.4404 177.6063 83 R 4.8768 9.1457 121.4807 53.8104 33.2318 177.0022 84 A 4.0681 8.4752 121.7617 55.2898 18.4191 179.3725 85 E 4.2409 8.1263 111.7220 58.1787 29.8678 177.1092 86 D 4.8074 8.0137 118.8205 55.0471 41.4279 176.8876 87 T 4.2382 7.9611 117.7229 62.3150 69.0766 174.6003 88 G 3.9704 8.0219 113.2456 45.6450 0.0000 170.2390 89 I 4.6680 7.6644 120.4550 60.3757 38.7056 174.8961 90 Y 4.9108 9.1296 125.4151 56.4826 40.1831 174.3504 91 Y 5.4217 9.5035 121.8977 56.4275 41.7496 173.7158 92 C 4.2766 9.4249 123.9409 55.2715 41.8074 172.3055 93 T 5.2077 8.2756 119.3146 60.0169 70.8344 172.2554 94 S 4.9426 8.0891 118.4921 56.6695 67.4320 173.1387 95 V 4.7397 8.9020 122.0617 59.8423 31.5186 174.4644 96 P 4.4238 0.0000 0.0000 65.4313 31.7401 176.3945 97 Q 4.4232 7.5520 117.2502 53.8428 31.9306 172.6631 98 L 3.7125 8.2574 123.0365 56.8513 42.1128 177.6031 99 G 3.8312 8.5694 112.5008 45.9529 0.0000 174.4255 100 R 3.7995 7.7521 118.7382 56.5484 30.4523 177.8667 100A G 3.6745 7.7369 107.0032 44.4182 0.0000 173.0319 100B F 5.0653 8.1154 116.0612 56.6492 37.0773 175.2924 101 A 3.9794 8.2386 128.0279 53.9126 19.0004 178.1451 102 Y 5.1256 7.3508 112.2280 56.0430 41.0656 174.6671 103 W 5.2162 8.7925 122.1874 54.8336 32.9647 175.5731 104 G 4.1868 8.5901 110.6474 44.4413 0.0000 173.8194 105 Q 4.1914 8.7007 117.0943 56.9365 29.0825 177.9157 106 G 4.0385 9.5939 103.6963 45.8294 0.0000 172.5936 107 T 4.6493 8.5319 114.6621 59.8594 71.2855 172.3592 108 L 4.6033 8.5423 130.4546 54.4766 43.7088 174.9987 109 V 4.6814 9.0872 127.2400 61.5046 33.7737 174.2542 110 T 4.7585 8.7651 124.8807 61.8600 71.1002 173.3810 111 V 4.6698 8.5647 128.2449 61.9461 32.1894 174.9090 112 S 4.7609 8.7381 120.8560 57.6170 65.4562 174.6319 113 A 4.2837 8.8060 126.7681 52.5555 19.0230 177.7621 114 A 4.0919 7.6142 118.9618 51.8095 18.9617 177.0960 115 S 4.9057 7.9217 113.7091 56.3580 65.4486 174.2110 116 T 4.5246 8.4408 118.4771 64.5052 68.9397 174.0151 117 T 4.9042 9.5385 122.7555 61.1316 72.7366 172.0522 118 P 4.9898 0.0000 0.0000 62.0184 32.6386 173.9423 119 P 4.9885 0.0000 0.0000 62.4176 33.2941 174.9442 120 S 4.7033 8.8829 116.3228 56.6053 65.8460 173.5120 121 V 4.6015 7.8404 122.8606 61.2184 33.8049 173.9771 122 Y 5.0507 8.9103 126.1595 55.4456 40.5890 173.6345 123 P 4.8032 0.0000 0.0000 62.6590 33.0577 175.9237 124 L 4.7722 9.3059 121.8280 53.2960 44.1931 175.2784 125 A 4.9003 8.4576 125.3222 48.9817 21.5912 174.4808 126 P 4.3084 0.0000 0.0000 62.8118 31.8992 177.0507 127 G 3.7505 8.4127 110.3878 48.4403 0.0000 176.1731 128 S 4.4324 7.7567 115.6095 57.0782 64.5206 172.9961 129 G 4.1655 8.3857 108.5165 43.9701 0.0000 173.9571 130 G 3.6617 8.7282 110.7787 45.7787 0.0000 171.0336 131 A 3.3057 8.4265 126.9117 51.8719 14.9397 178.3525 128 G 3.9224 7.7767 108.7095 43.8782 0.0000 173.2961 129 S 4.6755 8.3657 115.4165 57.1701 64.8961 173.6572 130 M 4.1817 8.6782 121.5787 56.0787 33.3719 172.4336 131 V 3.1057 8.2165 122.3117 61.5719 28.7397 176.8525 139 T 4.6878 8.4549 119.5942 61.9039 70.3898 173.6674 140 L 4.5820 8.5450 125.7355 53.0334 45.8416 175.2187 141 G 4.7576 8.7848 106.4453 45.5576 0.0000 170.9731 142 C 5.4925 9.7254 119.7204 54.7461 43.7133 172.1274 143 L 5.1005 9.3029 129.0690 53.4305 44.1136 175.0114 144 V 4.9530 9.2664 126.8912 61.0959 33.7276 174.2186 145 K 5.1421 8.9790 126.8443 56.0615 36.5044 177.3312 146 G 4.3057 9.0966 108.7381 45.4911 0.0000 172.9532 147 Y 5.0225 7.4043 117.7874 55.8613 41.1335 174.1380 148 F 5.0251 8.9907 118.8555 57.2447 43.5772 171.8719 149 P 3.8214 0.0000 0.0000 61.2511 33.9198 175.0130 150 E 4.2163 8.2826 118.6913 55.8763 30.1051 174.1017 151 P 4.8092 0.0000 0.0000 61.3296 33.6974 174.5550 152 V 4.6003 7.8100 110.8794 59.5775 35.1844 175.2880 153 T 4.6094 8.5791 113.5046 59.8910 71.6345 173.2040 154 V 5.2795 8.2724 123.6263 60.2642 34.8206 174.3786 *156 T 4.9636 8.2552 116.2991 61.6493 70.9971 172.2190 157 W 4.8245 8.4055 121.1340 54.3613 32.2363 176.3738 *162 N 4.5828 8.2807 122.7587 54.4966 39.2616 174.5068 163 S 3.8460 10.4028 107.0314 59.5588 61.5984 174.3095 164 G 4.0434 8.5094 108.9143 45.5051 0.0000 175.5278 165 A 4.0222 7.9212 122.2286 54.4144 18.4764 177.4138 166 L 4.6190 7.8276 116.3910 53.4341 42.1656 176.2672 167 S 4.5568 8.4889 117.1907 58.9529 64.9268 175.2328 168 S 4.1020 8.1345 114.5685 61.4007 62.8469 175.8551 169 G 3.8206 7.5250 107.7807 45.5536 0.0000 172.2677 *171 V 4.3542 7.7959 118.7547 62.7038 33.0475 174.2200 172 H 4.7046 9.0426 123.5193 54.4009 32.2111 172.4372 173 T 4.8969 8.3639 120.5853 61.7913 69.9389 174.4599 174 F 4.5697 8.9648 125.8742 55.8106 40.2413 174.4426 175 P 4.3431 0.0000 0.0000 62.6563 31.7871 176.4828 176 A 4.5833 8.4984 123.4834 52.2297 19.4043 176.7976 177 V 4.5591 9.0792 119.6019 60.9598 34.8077 174.0844 178 L 4.9726 8.4069 128.7049 53.6783 43.9582 175.6881 179 Q 4.4293 8.1040 121.8551 55.8088 30.9031 174.6240 180 S 3.7905 8.7528 111.1337 61.5869 63.2961 174.4185 181 D 4.6328 7.6838 120.1617 54.4620 41.5684 175.7301 *184 L 4.3101 7.4531 118.4393 55.0711 44.8162 175.2899 185 Y 4.7488 8.0230 120.3392 59.0869 39.4804 175.1264 186 T 5.2630 9.1170 119.4664 61.8396 72.4423 172.7595 187 L 5.3697 9.6850 128.3888 53.2552 46.0196 175.1874 188 S 5.4210 8.8203 118.2334 56.8014 66.9661 172.5037 189 S 5.5611 9.2067 115.1181 56.9506 66.0285 172.8148 190 S 5.5092 9.7462 120.8269 56.6395 66.7701 173.1017 191 V 4.4836 8.2135 119.5572 60.2979 34.6264 173.9024 192 T 5.2549 8.3497 120.7497 62.0037 70.1826 174.0517 193 V 4.5759 8.0533 118.2672 58.4616 35.6807 173.6803 194 P 4.6965 0.0000 0.0000 62.7619 32.0277 177.9298 195 S 4.3901 8.8576 116.6304 60.1957 63.5613 174.9578 196 S 4.3676 7.8585 115.2764 59.7086 63.9150 175.7530 *198 T 4.6525 7.7717 117.5065 62.9849 70.0887 173.3508 199 W 4.9049 7.6927 128.5385 54.9201 33.1225 173.1804 200 P 3.1894 0.0000 0.0000 63.1043 31.2178 177.5344 *202 S 4.3842 7.9172 114.4367 58.7398 64.5048 173.9766 203 Q 4.6339 8.2307 117.2109 54.6287 30.4455 175.6935 204 T 4.2765 8.4454 118.4793 63.5839 69.4319 174.1667 205 V 4.7751 8.8275 125.9311 61.5043 34.6031 174.1577 206 T 5.2852 9.5302 124.2023 60.8341 72.6407 172.2269 *208 C 4.1781 8.4772 123.6095 56.4019 39.6268 171.7540 209 N 5.5280 8.4682 123.5828 50.6479 40.7645 173.6665 210 V 4.7863 8.8651 124.1670 60.8348 34.6026 174.0641 211 A 4.9988 8.7322 128.5800 50.4428 22.4993 174.3429 212 H 4.7756 9.1362 122.1803 53.4123 31.1178 172.0936 213 P 4.1166 0.0000 0.0000 65.3399 31.5444 178.7002 214 A 3.9064 7.8756 119.1197 54.6137 18.1583 178.0885 215 S 4.5804 7.6845 106.4168 57.4135 63.6871 174.0233 216 S 3.7423 7.6645 115.6010 60.0843 60.8649 171.8242 217 T 4.5080 7.4988 115.9880 62.9534 70.0096 174.2248 218 Q 4.9293 8.4091 123.1313 54.3342 32.8489 174.6331 219 V 4.4277 8.9778 123.2219 61.2264 35.7467 173.4778 220 D 5.3529 8.7212 126.4704 52.5123 43.8824 174.7269 221 K 4.5392 8.6997 123.3007 54.2798 35.1187 175.6338 222 K 4.5788 8.7470 126.2299 55.9718 33.8709 176.0657 223 I 4.2486 8.8406 128.0241 60.3303 38.1318 175.5716 *226 V 4.7228 8.1111 119.4672 60.3791 32.7003 174.0756 227 P 4.7102 0.0000 0.0000 62.8606 31.8031 176.6532 228 K 4.2469 8.7795 120.6671 57.0236 32.8164 176.2292 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 E 8.30 4.22 0.00 2.06 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 2.36 0.00 2 V 8.04 4.26 1.65 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 -0.47 0.00 0.00 0.67 0.00 0.00 3 T 9.38 4.76 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 4 L 8.57 5.10 0.00 1.62 1.56 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 5 Q 8.88 4.58 0.00 2.11 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 6 E 9.18 5.67 0.00 2.01 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 0.00 2.62 2.28 0.00 7 S 8.68 4.52 0.00 3.87 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 8 G 9.27 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 9 G 6.86 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 10 G 7.65 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 11 L 8.21 4.86 0.00 1.66 1.61 1.21 1.04 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 12 V 8.83 4.59 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 0.73 0.00 0.00 0.89 0.00 0.00 13 Q 8.63 4.62 0.00 2.21 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.09 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 14 P 0.00 4.52 0.00 2.09 2.00 0.00 3.79 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 2.05 2.12 0.00 15 G 9.66 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 16 G 8.09 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 0.00 0.00 0.00 17 S 8.29 5.25 0.00 3.87 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 18 M 9.09 4.66 0.00 1.79 1.74 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.24 0.00 19 K 8.42 4.77 0.00 1.79 1.55 0.00 1.76 0.00 0.00 1.55 0.00 0.00 2.28 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.28 1.34 7.81 20 L 8.77 4.81 0.00 0.80 1.28 0.15 0.69 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 21 S 9.06 5.48 0.00 3.86 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 22 C 8.95 5.40 0.00 2.72 2.86 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 23 A 9.09 5.09 1.15 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 24 A 7.99 5.23 1.09 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 0.00 0.00 25 S 8.64 4.29 0.00 3.75 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 26 G 11.19 4.33 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 0.00 27 F 7.07 4.93 0.00 3.19 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 28 T 8.43 4.19 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 1.32 0.00 0.00 29 F 8.18 3.74 0.00 2.57 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 30 S 8.14 4.22 0.00 4.06 4.07 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 31 D 7.77 4.55 0.00 2.90 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.52 4.60 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 W 8.87 4.87 0.00 3.25 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 34 V 8.52 4.76 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 0.86 0.00 0.00 0.78 0.00 0.00 35 D 9.08 5.59 0.00 1.98 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 W 8.85 5.05 0.00 3.25 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 V 9.20 5.07 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.90 0.00 0.00 38 R 9.12 5.05 0.00 1.13 0.92 0.00 2.48 0.00 0.00 2.86 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.37 0.00 39 Q 9.13 5.66 0.00 2.38 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.70 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 40 S 8.46 5.02 0.00 3.92 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 41 P 0.00 4.47 0.00 2.10 2.07 0.00 3.68 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 2.08 2.13 0.00 42 G 9.12 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 K 7.31 4.20 0.00 1.87 1.92 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.48 1.41 7.81 44 G 8.02 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 45 L 8.54 4.83 0.00 1.77 1.81 0.93 0.88 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 46 E 9.35 4.80 0.00 2.04 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 47 W 9.32 4.59 0.00 3.53 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 48 V 7.95 3.97 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 1.07 0.00 0.00 0.95 0.00 0.00 49 A 6.71 4.36 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.84 5.31 0.00 2.78 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.72 0.00 51 I 8.63 4.92 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 1.17 1.38 0.93 0.00 0.00 52 R 8.52 3.59 0.00 1.17 0.66 0.00 2.65 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.07 0.00 52A N 7.78 4.53 0.00 3.00 3.21 0.00 0.00 5.58 7.50 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 52B K 8.69 3.38 0.00 1.77 1.81 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.43 1.38 7.81 52C A 8.02 4.05 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 53 N 8.17 4.81 0.00 2.76 2.65 0.00 0.00 6.52 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 N 8.21 4.00 0.00 2.81 2.82 0.00 0.00 7.17 7.42 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 55 H 8.50 4.32 0.00 3.27 3.28 0.00 5.70 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 7.34 4.26 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.38 5.03 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 58 K 8.54 4.83 0.00 1.96 1.94 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.36 1.61 7.81 59 Y 8.67 5.11 0.00 2.81 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 60 T 8.33 4.42 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 1.13 0.00 0.00 61 E 9.37 3.93 0.00 2.14 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 2.41 0.00 62 S 8.08 4.30 0.00 3.95 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 63 V 7.61 3.85 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 0.15 0.00 0.00 0.84 0.00 0.00 64 K 7.41 3.70 0.00 1.68 1.70 0.00 1.76 0.00 0.00 1.78 0.00 0.00 3.25 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.56 1.63 7.81 65 G 8.68 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 0.00 0.00 0.00 66 R 7.98 4.45 0.00 1.78 2.29 0.00 3.25 0.00 0.00 3.13 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.51 0.00 67 F 7.97 5.51 0.00 2.64 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 68 T 9.05 4.74 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 69 I 9.24 5.18 2.06 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.33 0.84 0.00 0.00 70 S 8.98 5.00 0.00 4.03 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 R 8.44 5.09 0.00 2.10 1.97 0.00 2.96 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.67 0.00 72 D 9.35 4.76 0.00 2.91 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 73 D 8.91 4.69 0.00 2.85 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 74 S 8.05 4.25 0.00 3.99 4.02 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 75 K 7.82 4.35 0.00 1.73 1.79 0.00 2.04 0.00 0.00 1.76 0.00 0.00 2.98 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.36 1.47 7.81 76 S 7.59 2.79 0.00 3.68 3.22 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 77 S 7.08 4.87 0.00 3.45 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 V 8.14 4.78 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 1.24 0.00 0.00 1.20 0.00 0.00 79 Y 9.41 5.53 0.00 2.93 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 L 8.93 4.52 0.00 0.27 0.36 0.83 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 9.11 4.51 0.00 2.10 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.54 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 82 M 9.07 4.49 0.00 0.91 1.37 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.81 0.00 82A N 8.69 5.15 0.00 2.75 2.68 0.00 0.00 7.22 7.73 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 82B S 8.55 3.69 0.00 3.99 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 82C L 7.90 4.33 0.00 1.73 1.62 0.81 1.04 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 83 R 9.15 4.88 0.00 1.84 1.83 0.00 3.12 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.73 0.00 84 A 8.48 4.07 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 85 E 8.13 4.24 0.00 2.12 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 0.00 2.30 2.35 0.00 86 D 8.01 4.81 0.00 2.96 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 87 T 7.96 4.24 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 88 G 8.02 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 89 I 7.66 4.67 1.62 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 1.22 1.00 0.30 0.00 0.00 90 Y 9.13 4.91 0.00 2.89 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 91 Y 9.50 5.42 0.00 3.04 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 C 9.42 4.28 0.00 1.96 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 93 T 8.28 5.21 2.69 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 -0.40 0.00 0.00 94 S 8.09 4.94 0.00 4.02 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 95 V 8.90 4.74 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 0.95 0.00 0.00 1.12 0.00 0.00 96 P 0.00 4.42 0.00 2.29 2.18 0.00 3.64 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.49 0.00 97 Q 7.55 4.42 0.00 2.09 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 7.03 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 98 L 8.26 3.71 0.00 1.45 1.47 0.70 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 99 G 8.57 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 R 7.75 3.80 0.00 1.77 1.83 0.00 3.32 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 100A G 7.74 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 100B F 8.12 5.07 0.00 3.23 2.52 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 0.00 101 A 8.24 3.98 0.55 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 0.00 102 Y 7.35 5.13 0.00 2.77 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 W 8.79 5.22 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 0.00 104 G 8.59 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 0.00 105 Q 8.70 4.19 0.00 2.15 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.43 0.00 0.00 0.00 0.00 0.00 2.44 2.36 0.00 106 G 9.59 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 0.00 0.00 0.00 107 T 8.53 4.65 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 1.28 0.00 0.00 108 L 8.54 4.60 0.00 1.80 1.50 0.98 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 109 V 9.09 4.68 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 0.86 0.00 0.00 0.53 0.00 0.00 110 T 8.77 4.76 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 111 V 8.56 4.67 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 1.01 0.00 0.00 112 S 8.74 4.76 0.00 4.07 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 0.00 113 A 8.81 4.28 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 A 7.61 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 115 S 7.92 4.91 0.00 4.01 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 0.00 116 T 8.44 4.52 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 1.30 0.00 0.00 117 T 9.54 4.90 4.39 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 1.29 0.00 0.00 118 P 0.00 4.99 0.00 2.10 2.10 0.00 3.82 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 2.02 2.00 0.00 119 P 0.00 4.99 0.00 2.02 2.00 0.00 3.68 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.75 0.00 120 S 8.88 4.70 0.00 3.66 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 0.00 121 V 7.84 4.60 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 0.68 0.00 0.00 0.78 0.00 0.00 122 Y 8.91 5.05 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 0.00 123 P 0.00 4.80 0.00 2.17 2.12 0.00 3.90 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.09 0.00 124 L 9.31 4.77 0.00 1.71 1.63 0.98 0.60 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 0.00 125 A 8.46 4.90 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 0.00 126 P 0.00 4.31 0.00 2.17 2.03 0.00 3.61 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.12 0.00 127 G 8.41 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 S 7.76 4.43 0.00 4.02 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 0.00 129 G 8.39 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 0.00 130 G 8.73 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 A 8.43 3.31 1.41 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 0.00 128 G 7.78 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 0.00 129 S 8.37 4.68 0.00 3.65 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 0.00 130 M 8.68 4.18 0.00 1.87 1.81 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.41 0.00 131 V 8.22 3.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.93 0.00 0.00 139 T 8.45 4.69 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 0.00 140 L 8.54 4.58 0.00 1.04 1.20 -0.01 -0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 141 G 8.78 4.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 C 9.73 5.49 0.00 2.94 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 0.00 143 L 9.30 5.10 0.00 1.88 1.83 1.02 0.78 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 0.00 144 V 9.27 4.95 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 0.70 0.00 0.00 0.88 0.00 0.00 145 K 8.98 5.14 0.00 1.92 1.98 0.00 1.58 0.00 0.00 1.89 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.54 1.53 7.81 146 G 9.10 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 0.00 147 Y 7.40 5.02 0.00 2.93 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 0.00 148 F 8.99 5.03 0.00 3.20 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 0.00 149 P 0.00 3.82 0.00 1.76 1.47 0.00 3.85 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 1.84 1.89 0.00 150 E 8.28 4.22 0.00 1.73 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 0.00 1.47 1.55 0.00 151 P 0.00 4.81 0.00 2.10 1.99 0.00 3.64 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 1.84 1.91 0.00 152 V 7.81 4.60 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 -0.29 0.00 0.00 0.60 0.00 0.00 153 T 8.58 4.61 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 1.16 0.00 0.00 154 V 8.27 5.28 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 0.99 0.00 0.00 0.83 0.00 0.00 *156 T 8.26 4.96 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 1.22 0.00 0.00 157 W 8.41 4.82 0.00 3.49 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 *162 N 8.28 4.58 0.00 2.99 2.92 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 0.00 163 S 10.40 3.85 0.00 3.95 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 0.00 164 G 8.51 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 0.00 0.00 0.00 165 A 7.92 4.02 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 L 7.83 4.62 0.00 1.97 1.64 0.93 0.79 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 0.00 167 S 8.49 4.56 0.00 3.92 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 0.00 168 S 8.13 4.10 0.00 3.96 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 0.00 169 G 7.52 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 *171 V 7.80 4.35 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 0.99 0.00 0.00 0.82 0.00 0.00 172 H 9.04 4.70 0.00 2.95 2.39 0.00 5.63 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 T 8.36 4.90 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 174 F 8.96 4.57 0.00 2.99 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 0.00 175 P 0.00 4.34 0.00 2.14 2.06 0.00 3.90 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.15 0.00 176 A 8.50 4.58 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 0.00 177 V 9.08 4.56 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.00 0.00 0.00 178 L 8.41 4.97 0.00 1.19 1.36 0.18 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 179 Q 8.10 4.43 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.55 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 180 S 8.75 3.79 0.00 3.95 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 0.00 181 D 7.68 4.63 0.00 2.70 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *184 L 7.45 4.31 0.00 1.73 1.72 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 185 Y 8.02 4.75 0.00 1.69 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 0.00 0.00 0.00 0.00 186 T 9.12 5.26 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 1.30 0.00 0.00 187 L 9.68 5.37 0.00 1.86 1.68 1.02 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 188 S 8.82 5.42 0.00 3.97 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 0.00 189 S 9.21 5.56 0.00 4.06 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 0.00 190 S 9.75 5.51 0.00 3.97 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 0.00 191 V 8.21 4.48 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 -0.63 0.00 0.00 0.41 0.00 0.00 192 T 8.35 5.25 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 1.21 0.00 0.00 193 V 8.05 4.58 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.93 0.00 0.00 194 P 0.00 4.70 0.00 2.09 1.98 0.00 3.61 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 2.09 0.00 195 S 8.86 4.39 0.00 4.04 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 0.00 196 S 7.86 4.37 0.00 4.03 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 *198 T 7.77 4.65 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 199 W 7.69 4.90 0.00 3.22 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 0.00 200 P 0.00 3.19 0.00 1.48 0.49 0.00 3.49 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.30 0.00 *202 S 7.92 4.38 0.00 3.87 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 0.00 203 Q 8.23 4.63 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.84 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 204 T 8.45 4.28 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 1.30 0.00 0.00 205 V 8.83 4.78 2.32 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 1.29 0.00 0.00 1.17 0.00 0.00 206 T 9.53 5.29 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 1.25 0.00 0.00 *208 C 8.48 4.18 0.00 2.15 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 N 8.47 5.53 0.00 2.58 2.66 0.00 0.00 6.28 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 0.00 210 V 8.87 4.79 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.73 0.00 0.00 211 A 8.73 5.00 1.14 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 0.00 212 H 9.14 4.78 0.00 2.98 3.10 0.00 5.64 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 P 0.00 4.12 0.00 2.13 2.05 0.00 3.72 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 2.06 2.05 0.00 214 A 7.88 3.91 1.14 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 0.00 215 S 7.68 4.58 0.00 4.02 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 0.00 216 S 7.66 3.74 0.00 4.05 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 0.00 217 T 7.50 4.51 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 1.18 0.00 0.00 218 Q 8.41 4.93 0.00 1.83 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.70 0.00 0.00 0.00 0.00 0.00 2.20 2.29 0.00 219 V 8.98 4.43 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 0.84 0.00 0.00 0.86 0.00 0.00 220 D 8.72 5.35 0.00 2.56 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 K 8.70 4.54 0.00 1.57 1.67 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.27 1.58 7.81 222 K 8.75 4.58 0.00 1.83 1.76 0.00 1.83 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.60 7.81 223 I 8.84 4.25 2.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.34 0.85 0.00 0.00 *226 V 8.11 4.72 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 1.16 0.00 0.00 1.04 0.00 0.00 227 P 0.00 4.71 0.00 2.00 1.93 0.00 3.66 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 1.66 1.29 0.00 228 K 8.78 4.25 0.00 1.91 1.86 0.00 1.65 0.00 0.00 1.78 0.00 0.00 3.06 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.52 1.48 7.81 * Residues marked with a * may have inaccurate shift predictions.