NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 I 4.1212 8.0249 121.4507 60.6947 37.8787 175.1119 12 L 3.9477 8.5303 126.8863 53.9990 42.0331 174.9962 13 D 4.9177 9.5911 123.4224 53.9022 45.4252 174.8915 14 I 5.0693 7.7369 118.3677 59.2379 40.9349 174.3395 15 I 4.9999 8.8094 126.2292 59.3944 40.6279 174.1979 16 T 5.1931 8.9610 119.5094 60.0206 72.1715 172.9686 17 L 5.0510 8.7452 122.3841 53.4090 45.5575 176.0223 18 T 4.9090 8.6515 119.6359 62.3984 72.5467 173.0298 19 T 5.1116 8.7601 116.2690 58.2714 73.0799 173.4630 20 D 5.2817 7.8808 118.2946 52.4696 39.2640 177.7490 21 F 4.5071 8.2118 120.9955 59.6848 39.2042 176.8394 22 G 3.9726 8.1824 106.0906 45.2931 0.0000 172.7905 23 T 4.5200 7.9840 105.5622 61.1411 69.4519 174.6063 24 N 4.3258 8.2028 121.1192 55.8730 39.2429 174.0316 25 E 4.3312 7.7614 116.6381 54.7636 32.0316 175.6342 26 G 4.0058 7.5603 105.7839 45.9050 0.0000 174.8367 27 Y 4.2931 7.5290 118.2946 61.1414 38.0628 177.8546 28 V 3.9176 8.4335 117.5838 66.0831 31.8787 177.2724 29 G 3.7300 8.3131 107.8852 48.6705 0.0000 175.7406 30 A 4.1026 8.0744 119.7787 52.7580 17.9970 179.1575 *32 K 4.3214 8.2219 120.8087 57.9421 34.3328 178.7194 33 G 3.5853 8.2579 105.4258 48.2733 0.0000 175.0485 34 R 3.8773 8.5018 122.0229 58.9387 29.8952 178.1032 35 I 3.6411 7.7130 118.4279 64.7620 37.4928 177.8460 36 L 3.9409 8.3197 121.0329 58.1314 41.8276 178.5442 37 N 4.2806 8.4295 117.3068 56.6756 38.4940 176.5969 38 I 3.6661 7.7465 121.0835 64.6767 37.3131 178.2025 39 L 4.0336 8.1299 121.8797 58.6197 41.3583 180.5504 40 K 4.3897 8.0848 122.8359 59.2065 31.4448 180.8132 41 K 4.3299 8.0166 118.1097 58.9238 32.3558 176.9667 42 Y 4.4980 7.8261 113.6117 56.7225 38.6886 174.9859 43 N 4.0555 7.5941 117.2590 54.6623 37.8212 174.6178 44 K 4.4235 8.5218 118.3706 54.5135 33.6110 174.4773 45 D 4.5976 8.6305 126.3750 53.6179 41.9859 174.8932 46 A 4.8327 8.1941 126.2175 50.9264 22.6172 174.9265 47 K 4.5734 8.7239 118.8732 54.8803 34.6072 175.6843 48 I 4.8049 8.3496 125.2473 59.9255 38.7151 175.0352 49 I 4.6555 8.8505 128.1188 59.5290 40.4556 174.2978 50 D 4.8450 8.8069 126.3728 54.0315 41.4227 175.8878 51 I 4.2279 8.2601 124.7418 62.1504 38.2582 176.1405 52 S 4.4141 7.0828 112.3188 57.6099 65.5992 175.1282 53 H 4.9980 8.3576 121.7383 54.2911 30.6366 174.0978 54 E 4.8345 7.8781 116.3044 56.1329 30.4548 176.2838 55 I 3.6069 7.5840 121.4373 60.8260 38.4979 175.9136 56 K 3.8033 9.1107 125.9600 56.3131 32.3566 174.0471 57 P 3.9247 0.0000 0.0000 63.5908 30.8141 176.4472 58 F 3.9410 8.7240 122.0599 57.9884 37.9698 175.6129 59 N 4.5897 8.2645 120.5326 52.7233 38.6483 175.0273 60 I 3.6701 8.0573 123.4081 63.5524 37.8454 177.6657 61 Y 3.9433 7.7529 118.4992 61.1022 37.8527 177.2658 62 H 4.5171 8.6911 119.2962 59.4032 29.9940 177.3258 63 G 3.5019 7.9176 107.0496 47.7980 0.0000 175.1498 64 A 4.2554 8.3677 125.2811 54.4891 18.1874 179.1760 65 Y 4.0405 8.5099 118.1120 60.7967 38.8818 178.2935 66 V 3.7265 8.0925 119.4204 65.8081 31.6405 178.0778 67 L 4.0066 8.1358 119.0126 57.6946 41.2458 179.2184 68 L 4.0614 7.8237 119.3111 58.2849 42.0292 178.7671 69 T 4.1435 7.4492 115.0534 65.5065 68.8884 176.1458 70 A 4.5547 7.9681 122.0458 54.3440 19.7239 179.0378 71 I 3.7163 7.6348 118.3014 64.4770 37.0974 176.7572 72 P 4.2910 0.0000 0.0000 65.1203 31.2279 177.1185 73 Y 4.1653 7.9323 113.3179 57.6846 38.4898 175.6302 74 F 4.5136 8.1391 119.4575 55.7504 40.1863 173.7839 75 P 4.6953 0.0000 0.0000 61.1014 32.6616 173.7982 76 P 3.0063 0.0000 0.0000 63.4221 31.6974 176.3376 77 S 4.4593 7.6510 116.6380 58.2344 66.3757 173.6169 78 V 4.7289 8.6795 120.0848 61.8093 33.6294 174.8270 79 H 5.2710 9.3838 124.1991 52.9495 32.0248 172.4250 80 V 4.6581 8.9571 124.9900 61.6805 33.0041 174.6395 81 A 4.7633 8.7796 129.2493 50.2864 21.4744 175.5972 82 V 3.8495 8.3627 123.7926 61.7518 33.2191 175.0383 83 I 4.4691 7.7597 129.0074 60.6551 40.3094 174.7116 84 D 4.3950 8.4874 127.2751 52.6080 43.6273 174.9227 85 P 5.1060 0.0000 0.0000 62.4093 30.8660 175.0658 86 T 4.4262 7.1493 127.5682 65.0554 75.8353 178.5574 *91 R 4.3868 8.5763 131.9259 57.2222 30.2654 177.3959 92 K 4.5485 8.5198 121.3002 56.9483 33.0482 174.2026 93 S 5.1915 8.5831 118.1792 56.4049 66.7173 172.9485 94 I 5.2604 9.0436 116.1276 59.1519 41.9408 173.8577 95 V 4.6998 8.6862 120.8048 61.3391 34.2187 174.0991 96 I 4.8839 8.5852 131.1836 60.2367 40.0127 175.0215 97 E 4.6653 8.9459 123.9326 55.0498 32.5392 174.5449 98 T 5.2957 8.1033 120.9312 60.5346 70.5432 176.1451 99 K 3.7795 7.9489 123.8323 60.1895 32.0906 178.7069 100 S 4.3905 8.0609 110.3820 58.9610 62.9139 174.2953 101 G 3.6984 8.3867 108.8338 46.1944 0.0000 173.0648 102 Y 4.6596 7.8650 115.7819 56.2489 40.8010 174.7076 103 Y 5.0063 8.7194 120.7569 56.3029 40.8810 174.7665 104 L 4.6338 8.6092 125.3217 52.9326 43.3046 175.5824 105 V 4.2683 8.8832 125.0810 60.8202 33.3337 176.1269 106 G 3.7932 7.9351 114.9690 43.4495 0.0000 169.8938 107 P 4.9259 0.0000 0.0000 63.0043 32.0038 176.4411 108 D 4.8457 8.3935 120.1273 52.7638 39.5728 175.3957 109 N 4.8898 8.1112 113.2003 51.6698 39.2214 175.8549 110 G 3.9250 8.7925 107.7794 45.4047 0.0000 175.9512 111 L 3.4122 7.8984 121.9099 58.1762 42.0404 178.2992 112 F 4.7431 7.7747 114.1091 57.8099 39.3384 177.3081 113 T 3.8144 8.1012 119.2497 67.5365 68.1450 175.5433 114 Y 4.3573 7.3011 117.4576 61.3351 38.3204 178.9798 115 V 3.6792 7.9960 119.3216 64.5682 31.3669 178.1385 116 A 3.9558 8.7950 124.2618 55.6402 18.0956 179.8587 117 E 3.9171 7.9011 115.2885 61.2372 29.8915 180.5695 118 K 4.1306 7.8367 119.4819 59.6034 31.1868 178.1640 119 L 4.1691 7.8445 116.7652 53.6632 42.0081 174.5038 120 G 4.1226 7.8856 113.8621 45.4339 0.0000 172.7474 121 I 4.3253 8.1769 125.0568 60.5806 37.9485 175.1008 122 K 4.4617 8.9130 127.7592 57.9507 33.4935 176.8560 123 R 4.5924 7.5015 113.1438 55.2076 32.6525 173.9069 124 I 4.6570 8.3908 122.7497 59.8664 39.8375 174.2209 125 I 5.0141 8.5352 128.8038 59.1840 39.4983 175.2094 126 K 4.5337 9.0904 129.8160 56.2519 32.8471 176.3169 127 I 4.3274 8.3791 131.0161 61.7223 37.7192 175.8802 128 D 5.0053 8.6870 125.7804 51.1949 42.0135 174.4503 129 E 4.4834 8.5171 120.7516 55.9186 27.0758 176.6256 130 E 4.8908 7.9483 125.5771 57.1390 32.1282 178.2667 131 R 4.3245 7.8470 121.2408 57.6615 30.1343 177.3603 *141 R 4.3273 8.5387 125.0547 57.3719 31.4670 176.5067 142 D 4.6766 7.6305 116.1477 54.1917 40.8080 178.5503 143 V 3.4936 7.2753 120.9886 66.2239 31.5978 177.1533 144 Y 4.3467 7.4516 115.7799 61.2987 37.6913 178.6443 145 A 4.0184 8.1077 120.6884 55.1949 18.5641 179.5270 146 V 3.4214 7.4400 116.6204 66.2809 31.6728 178.0759 147 V 3.6340 8.1132 118.3830 66.1092 30.9758 178.2055 148 G 3.4999 7.9646 103.8606 47.7111 0.0000 175.2029 149 A 4.1293 8.0303 126.0769 55.3194 18.3188 179.9475 150 E 3.7931 8.4281 117.2422 61.6288 29.7852 181.4013 151 I 4.3155 7.5965 122.0897 63.3120 36.8140 178.7656 152 L 3.9067 7.7315 120.0152 57.7334 41.2862 179.4849 153 I 3.7202 7.4375 117.6037 64.6913 37.1133 177.1461 154 N 4.5017 8.2098 114.3633 53.2633 38.6188 174.4795 155 N 4.0852 7.6414 116.2086 52.3116 38.2483 173.5872 156 G 3.7998 6.4754 104.3308 45.4198 0.0000 170.9788 157 Y 4.9151 7.8424 121.2128 56.5726 41.7728 174.2171 158 D 4.9161 8.1240 123.1131 50.7415 44.0354 175.8665 159 G 3.7891 7.7266 105.5871 46.0039 0.0000 170.9719 160 E 4.1015 8.0368 121.4546 56.0652 30.3793 177.3177 161 E 4.6457 9.0495 129.5413 57.1586 30.3129 176.9626 162 L 4.5664 9.1707 128.1158 53.8012 43.8480 176.0379 163 D 4.5066 9.1911 120.5582 55.4904 41.2747 180.8648 164 E 4.6944 7.4393 119.3538 55.3874 31.0669 178.4405 *166 V 3.9595 8.1562 116.1643 64.3332 32.5136 174.5745 167 K 4.6891 8.2973 124.9163 54.1668 35.4288 176.0686 168 I 3.7424 8.4523 125.1051 61.0139 37.2058 175.4983 169 D 4.3349 9.0829 128.0641 55.7563 41.1057 176.0268 170 E 4.7715 8.8797 121.6016 55.9335 30.4337 173.0478 171 T 4.2228 9.0789 112.0019 64.0976 69.5303 175.1509 172 K 4.3442 7.9805 123.1282 54.4946 33.2944 175.7780 173 K 4.3462 8.5466 126.5454 56.6507 33.1701 176.3239 174 R 4.8085 8.1701 119.8604 55.0505 33.4679 173.7108 175 V 3.6992 8.6501 119.9039 63.0686 31.5279 176.4931 176 I 3.7793 8.6054 129.9481 64.0386 38.1578 175.1915 177 H 4.4334 7.3959 119.0873 55.1338 33.3353 171.8272 178 I 4.5114 7.0029 122.0440 58.9479 39.8537 175.5944 179 D 4.5169 8.3675 125.3594 53.9197 41.3576 177.6832 180 R 3.8591 8.0977 116.2239 58.9117 29.6724 177.7693 181 F 4.3537 7.7267 116.0511 58.2187 39.5384 176.8987 182 G 4.0881 7.9421 109.5551 44.9256 0.0000 172.8246 183 N 4.7307 8.0044 117.1702 53.2285 40.1191 174.5043 184 I 4.3806 8.5797 124.4000 60.1199 38.1493 174.6044 185 I 4.3188 8.3708 129.5434 60.8097 38.3525 176.1763 186 T 4.7099 8.3530 122.1603 60.8596 68.9899 174.6032 187 N 4.4821 8.6618 120.7400 56.6783 38.8786 176.3039 188 I 3.7517 7.6410 119.6645 61.4752 37.2118 175.5765 189 K 4.6821 8.8755 125.3537 54.5994 33.7287 177.7773 190 K 3.7307 8.4985 124.4227 60.6473 31.9657 178.9772 191 D 4.5759 8.0083 113.4857 54.5026 39.5571 177.8556 192 E 4.6150 8.2604 117.1571 56.6324 30.8656 176.0044 193 V 4.3752 7.4711 119.7126 59.4416 33.8980 176.8108 194 T 4.1722 7.9675 113.9491 61.0659 68.2768 175.1647 *197 Y 4.5003 8.3621 116.5317 59.0993 38.6185 174.6180 198 Y 3.9166 9.2063 120.1373 59.0311 36.3535 169.6031 199 D 4.8765 7.7612 119.5371 54.1103 43.1530 175.4829 200 T 4.8253 8.3989 116.5825 62.4713 69.5230 174.3626 201 I 4.3086 8.4985 134.2991 60.8799 40.3246 175.1013 *203 I 4.2304 8.1916 125.8726 62.1855 38.8740 174.5526 204 K 4.8326 9.0151 128.8268 54.8895 34.4390 175.0030 205 I 4.9123 9.1263 130.1118 60.2129 40.9352 174.9828 206 R 4.9634 8.5612 127.8205 55.2302 31.9147 172.4751 207 H 5.3787 9.0423 121.5263 53.2204 29.6612 176.6987 208 K 3.9479 8.7265 120.4563 60.1825 32.2321 177.6121 209 N 4.5466 8.0354 114.0560 53.3627 38.7849 174.7493 210 G 4.0983 8.2549 109.6762 46.3497 0.0000 175.6528 211 I 3.8672 7.7465 117.4215 59.7349 36.1137 177.9198 212 E 5.2470 8.6515 124.8918 53.6639 32.1558 174.9798 213 K 4.6853 9.3266 125.9898 54.6099 35.4709 174.9413 214 I 5.0134 8.4646 125.4363 59.4632 39.3577 174.7884 215 I 4.7454 8.5844 119.4373 59.0172 41.2501 174.6824 216 K 4.7887 8.6826 121.0221 55.0699 34.1895 175.7146 217 C 5.4492 9.1173 122.5806 57.1209 32.4007 173.0963 218 K 5.0079 8.3791 118.8838 54.4501 34.7421 175.5068 219 F 5.5920 8.9372 128.5025 58.5889 40.2113 174.1381 220 V 4.3420 8.3022 123.2001 60.3783 34.5608 175.4943 221 K 4.0443 8.6115 120.2050 55.1484 33.6684 171.6591 222 S 4.6729 7.6415 110.5649 56.4165 66.0464 174.5589 223 Y 4.2791 8.4456 120.1568 61.3827 37.7546 177.7263 *224 F 4.0852 7.5355 115.9585 57.2807 38.2777 179.4276 225 E 4.3035 7.3934 118.1717 56.3362 31.0723 175.2808 226 E 3.7268 8.4581 116.2425 56.6763 27.2129 177.6680 227 K 3.8250 8.0110 119.5738 59.6655 32.4117 178.4989 228 N 4.3992 8.0626 115.0750 55.0139 38.7104 173.6059 229 N 4.9730 7.5746 114.6266 50.9152 42.1882 173.1429 230 F 4.7811 8.4750 117.5348 57.5594 40.0213 174.9504 231 I 5.2524 9.4905 115.9262 59.2943 41.5056 173.8904 232 C 6.0010 9.1394 116.8966 55.8070 33.0137 172.9053 233 L 5.3554 8.4494 120.6270 54.8248 44.4415 174.0908 234 I 4.7988 8.4560 119.9616 60.0967 38.3638 176.3960 235 N 4.8176 9.0918 125.6580 51.4534 38.7994 175.9871 236 S 4.3022 8.7866 110.3473 60.0108 62.6017 174.3652 237 E 4.5679 8.6295 119.0109 56.0536 30.5183 176.5330 238 G 3.7706 8.8638 107.9291 45.6785 0.0000 172.9659 239 F 5.3685 8.0855 117.1278 54.9188 42.7114 174.5118 240 L 4.7489 8.9661 124.6415 54.6547 43.0824 175.2842 241 E 5.2236 8.9656 126.4271 54.5068 33.3746 174.0083 242 I 4.8837 8.7535 127.3506 60.1463 39.2850 174.8125 243 S 5.2348 10.0683 121.6301 56.7062 66.8742 172.3563 244 K 4.8208 8.5180 123.1222 53.6909 34.6458 176.4310 245 F 4.1071 8.9898 134.7861 58.0779 39.4680 173.3858 *247 D 4.3778 7.7295 118.7023 54.0199 42.2083 173.8106 248 N 5.1908 8.4067 113.8407 49.3632 39.2202 174.3872 249 A 4.2401 8.6276 126.0030 55.0001 18.5300 178.7515 250 S 4.0621 8.5908 114.1011 62.4119 62.2543 177.4502 251 K 4.0919 8.5910 125.1055 59.7046 31.5000 180.7207 252 L 4.4217 8.0960 119.0523 57.0960 41.6867 178.5787 253 L 4.4217 8.1435 116.4021 53.2945 42.5588 175.7161 254 N 4.1217 7.9593 116.4344 54.4144 37.7692 173.7476 255 V 4.2657 7.8040 115.6439 61.2981 32.8482 173.9655 256 D 5.0048 9.6502 126.5554 51.7173 44.1203 174.3337 257 Y 3.8906 8.4699 118.7394 59.7771 38.0572 177.5138 258 L 3.7368 8.4799 121.8406 54.6740 40.7162 174.7417 259 D 4.4986 7.5013 119.9383 54.2511 42.1717 175.6819 260 E 4.5436 8.7229 122.3834 56.5147 30.5793 175.8302 261 I 4.8837 8.2683 125.3091 59.6132 39.8280 175.3422 262 E 4.4333 9.0515 126.9829 54.9421 32.1862 174.5382 263 I 4.4973 8.2666 127.9713 60.3542 38.9728 176.1926 264 E 4.6031 8.3266 120.6268 57.4318 28.7954 176.4162 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 11 I 8.02 4.12 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 1.07 0.91 0.00 0.00 12 L 8.53 3.95 0.00 1.69 1.60 0.89 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 13 D 9.59 4.92 0.00 2.76 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 14 I 7.74 5.07 1.94 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 1.42 0.83 0.96 0.00 0.00 15 I 8.81 5.00 1.83 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 1.25 1.60 0.93 0.00 0.00 16 T 8.96 5.19 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 0.75 0.00 0.00 17 L 8.75 5.05 0.00 1.60 1.58 0.96 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 18 T 8.65 4.91 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 19 T 8.76 5.11 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 0.64 0.00 0.00 20 D 7.88 5.28 0.00 2.63 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 F 8.21 4.51 0.00 3.08 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 22 G 8.18 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 23 T 7.98 4.52 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 1.22 0.00 0.00 24 N 8.20 4.33 0.00 2.69 2.85 0.00 0.00 6.99 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 E 7.76 4.33 0.00 1.48 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 1.62 1.89 0.00 26 G 7.56 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 27 Y 7.53 4.29 0.00 2.95 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 28 V 8.43 3.92 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 0.59 0.00 0.00 0.92 0.00 0.00 29 G 8.31 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 A 8.07 4.10 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 *32 K 8.22 4.32 0.00 2.04 1.93 0.00 1.69 0.00 0.00 1.84 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.45 1.68 7.81 33 G 8.26 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 R 8.50 3.88 0.00 1.91 1.91 0.00 3.19 0.00 0.00 3.17 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 35 I 7.71 3.64 2.02 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 1.66 0.42 0.90 0.00 0.00 36 L 8.32 3.94 0.00 2.10 1.76 0.93 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 37 N 8.43 4.28 0.00 3.01 2.92 0.00 0.00 7.15 7.76 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 38 I 7.75 3.67 1.93 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.84 0.57 0.00 0.00 39 L 8.13 4.03 0.00 1.98 1.81 0.89 0.83 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 40 K 8.08 4.39 0.00 1.80 1.82 0.00 1.81 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.31 7.81 41 K 8.02 4.33 0.00 1.97 2.41 0.00 1.83 0.00 0.00 2.00 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.45 7.81 42 Y 7.83 4.50 0.00 2.87 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 43 N 7.59 4.06 0.00 2.76 2.84 0.00 0.00 6.86 6.61 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 44 K 8.52 4.42 0.00 1.70 1.82 0.00 1.74 0.00 0.00 1.64 0.00 0.00 3.20 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.33 1.37 7.81 45 D 8.63 4.60 0.00 2.69 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 46 A 8.19 4.83 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 K 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.22 0.76 0.00 0.00 56 K 9.11 3.80 0.00 1.80 1.76 0.00 1.73 0.00 0.00 1.88 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.59 1.64 7.81 57 P 0.00 3.92 0.00 2.00 1.60 0.00 3.73 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 58 F 8.72 3.94 0.00 3.25 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 59 N 8.26 4.59 0.00 2.66 2.64 0.00 0.00 6.86 7.36 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 60 I 8.06 3.67 1.50 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 -0.36 0.75 0.00 0.00 61 Y 7.75 3.94 0.00 3.31 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 H 8.69 4.52 0.00 3.06 3.35 0.00 5.62 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 G 7.92 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.37 4.26 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 Y 8.51 4.04 0.00 3.27 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 66 V 8.09 3.73 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 0.99 0.00 0.00 1.06 0.00 0.00 67 L 8.14 4.01 0.00 1.89 1.76 0.59 0.35 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 68 L 7.82 4.06 0.00 1.79 1.83 0.97 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 69 T 7.45 4.14 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 70 A 7.97 4.55 1.52 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 71 I 7.63 3.72 1.96 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 1.11 0.43 0.75 0.00 0.00 72 P 0.00 4.29 0.00 1.82 1.94 0.00 3.82 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.09 0.00 73 Y 7.93 4.17 0.00 3.10 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 F 8.14 4.51 0.00 3.34 3.17 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 75 P 0.00 4.70 0.00 2.18 2.12 0.00 4.04 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 2.08 2.05 0.00 76 P 0.00 3.01 0.00 1.75 1.67 0.00 3.61 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.79 0.00 77 S 7.65 4.46 0.00 3.90 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 78 V 8.68 4.73 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 0.97 0.00 0.00 0.88 0.00 0.00 79 H 9.38 5.27 0.00 3.01 3.17 0.00 5.67 0.00 0.00 0.00 0.00 6.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 V 8.96 4.66 2.13 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 1.44 1.01 7.81 93 S 8.58 5.19 0.00 4.18 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 94 I 9.04 5.26 1.92 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 1.21 0.87 0.97 0.00 0.00 95 V 8.69 4.70 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 0.99 0.00 0.00 0.46 0.00 0.00 96 I 8.59 4.88 1.60 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.44 0.80 0.00 0.00 97 E 8.95 4.67 0.00 1.61 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 2.13 2.12 0.00 98 T 8.10 5.30 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 99 K 7.95 3.78 0.00 1.86 1.89 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.42 7.81 100 S 8.06 4.39 0.00 4.11 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 0.00 101 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.20 0.00 118 K 7.84 4.13 0.00 1.84 2.02 0.00 1.61 0.00 0.00 1.68 0.00 0.00 3.07 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.48 7.81 119 L 7.84 4.17 0.00 1.57 1.43 -0.04 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 120 G 7.89 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 0.00 0.00 0.00 121 I 8.18 4.33 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 1.27 0.59 0.90 0.00 0.00 122 K 8.91 4.46 0.00 1.74 1.83 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.35 7.81 123 R 7.50 4.59 0.00 2.05 1.96 0.00 2.99 0.00 0.00 3.36 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 124 I 8.39 4.66 1.89 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 1.35 1.03 0.94 0.00 0.00 125 I 8.54 5.01 2.12 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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7.28 3.49 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 0.96 0.00 0.00 0.76 0.00 0.00 144 Y 7.45 4.35 0.00 3.09 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 A 8.11 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 0.00 146 V 7.44 3.42 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 0.96 0.00 0.00 0.92 0.00 0.00 147 V 8.11 3.63 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.97 0.00 0.00 148 G 7.96 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 A 8.03 4.13 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 0.00 150 E 8.43 3.79 0.00 1.94 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.24 0.00 151 I 7.60 4.32 1.79 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.85 0.20 0.00 0.00 152 L 7.73 3.91 0.00 1.87 1.66 0.88 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 153 I 7.44 3.72 1.77 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.53 1.06 0.00 0.00 154 N 8.21 4.50 0.00 2.89 2.85 0.00 0.00 7.18 8.38 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 0.00 155 N 7.64 4.09 0.00 2.76 2.83 0.00 0.00 6.98 7.86 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 0.00 156 G 6.48 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 0.00 0.00 0.00 157 Y 7.84 4.92 0.00 2.53 2.75 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 0.00 158 D 8.12 4.92 0.00 2.68 2.36 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 0.00 159 G 7.73 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 E 8.04 4.10 0.00 2.08 1.88 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 2.40 2.36 0.00 161 E 9.05 4.65 0.00 1.91 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 2.33 2.27 0.00 162 L 9.17 4.57 0.00 1.32 1.40 0.92 0.98 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 0.00 163 D 9.19 4.51 0.00 2.69 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 E 7.44 4.69 0.00 1.93 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 2.10 1.81 0.00 *166 V 8.16 3.96 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 0.94 0.00 0.00 1.07 0.00 0.00 167 K 8.30 4.69 0.00 1.75 1.68 0.00 1.83 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.43 7.81 168 I 8.45 3.74 1.86 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.33 1.22 0.00 0.00 169 D 9.08 4.33 0.00 2.70 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 0.00 170 E 8.88 4.77 0.00 2.01 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.83 0.00 171 T 9.08 4.22 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 1.25 0.00 0.00 172 K 7.98 4.34 0.00 1.75 1.78 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.45 7.81 173 K 8.55 4.35 0.00 1.83 1.72 0.00 1.85 0.00 0.00 1.90 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.38 7.81 174 R 8.17 4.81 0.00 1.94 1.98 0.00 2.89 0.00 0.00 3.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 175 V 8.65 3.70 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 0.65 0.00 0.00 0.86 0.00 0.00 176 I 8.61 3.78 1.67 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.79 0.63 0.00 0.00 177 H 7.40 4.43 0.00 2.88 2.23 0.00 5.86 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 I 7.00 4.51 1.53 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 -0.01 0.80 0.00 0.00 179 D 8.37 4.52 0.00 2.84 2.75 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 0.00 180 R 8.10 3.86 0.00 1.63 1.81 0.00 2.56 0.00 0.00 2.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.50 0.00 181 F 7.73 4.35 0.00 3.07 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 G 7.94 4.09 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 0.00 183 N 8.00 4.73 0.00 3.02 2.92 0.00 0.00 7.00 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 I 8.58 4.38 1.82 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.71 0.79 0.00 0.00 185 I 8.37 4.32 1.65 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.57 0.83 0.00 0.00 186 T 8.35 4.71 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 1.35 0.00 0.00 187 N 8.66 4.48 0.00 2.66 2.92 0.00 0.00 7.01 7.31 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 0.00 188 I 7.64 3.75 1.90 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.73 0.89 0.00 0.00 189 K 8.88 4.68 0.00 1.73 1.51 0.00 1.54 0.00 0.00 1.24 0.00 0.00 2.83 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.89 1.30 7.81 190 K 8.50 3.73 0.00 1.79 1.78 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.47 7.81 191 D 8.01 4.58 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 0.00 192 E 8.26 4.62 0.00 1.94 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 2.20 2.16 0.00 193 V 7.47 4.38 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 0.61 0.00 0.00 0.57 0.00 0.00 194 T 7.97 4.17 4.21 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 1.17 0.00 0.00 *197 Y 8.36 4.50 0.00 2.73 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 0.00 0.00 0.00 198 Y 9.21 3.92 0.00 3.10 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 0.00 199 D 7.76 4.88 0.00 2.93 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 0.00 200 T 8.40 4.83 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 0.00 201 I 8.50 4.31 1.90 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.83 0.88 0.00 0.00 *203 I 8.19 4.23 1.80 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 1.19 0.56 0.85 0.00 0.00 204 K 9.02 4.83 0.00 1.89 1.67 0.00 1.70 0.00 0.00 1.65 0.00 0.00 3.24 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.37 7.81 205 I 9.13 4.91 1.74 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.42 0.73 0.00 0.00 206 R 8.56 4.96 0.00 1.49 1.78 0.00 3.26 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.44 0.00 207 H 9.04 5.38 0.00 3.26 3.25 0.00 5.80 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 K 8.73 3.95 0.00 1.86 1.96 0.00 1.60 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.43 7.81 209 N 8.04 4.55 0.00 2.74 2.90 0.00 0.00 7.16 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 G 8.25 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 0.00 0.00 0.00 211 I 7.75 3.87 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 1.30 0.70 0.91 0.00 0.00 212 E 8.65 5.25 0.00 1.93 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 2.15 2.27 0.00 213 K 9.33 4.69 0.00 1.62 1.63 0.00 1.86 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.50 7.81 214 I 8.46 5.01 1.86 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 1.38 0.58 0.90 0.00 0.00 215 I 8.58 4.75 1.73 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.57 0.71 0.00 0.00 216 K 8.68 4.79 0.00 1.68 1.80 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.35 1.45 7.81 217 C 9.12 5.45 0.00 2.91 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 K 8.38 5.01 0.00 1.73 1.78 0.00 2.10 0.00 0.00 1.80 0.00 0.00 2.84 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.44 7.81 219 F 8.94 5.59 0.00 3.08 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 0.00 220 V 8.30 4.34 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.92 0.00 0.00 221 K 8.61 4.04 0.00 1.75 1.69 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.26 0.96 7.81 222 S 7.64 4.67 0.00 3.91 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 Y 8.45 4.28 0.00 3.02 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 *224 F 7.54 4.09 0.00 2.26 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 0.00 0.00 0.00 0.00 225 E 7.39 4.30 0.00 1.90 1.75 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 2.15 2.16 0.00 226 E 8.46 3.73 0.00 2.03 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 2.19 2.22 0.00 227 K 8.01 3.82 0.00 1.50 1.70 0.00 1.26 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.30 1.05 7.81 228 N 8.06 4.40 0.00 2.67 2.84 0.00 0.00 6.61 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 0.00 229 N 7.57 4.97 0.00 2.66 2.72 0.00 0.00 7.25 6.90 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 0.00 230 F 8.48 4.78 0.00 3.08 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 0.00 231 I 9.49 5.25 1.95 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.15 0.96 0.00 0.00 232 C 9.14 6.00 0.00 3.16 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 0.00 233 L 8.45 5.36 0.00 1.70 1.72 0.36 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 234 I 8.46 4.80 2.04 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.57 0.98 0.00 0.00 235 N 9.09 4.82 0.00 3.15 3.16 0.00 0.00 6.30 7.16 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 0.00 236 S 8.79 4.30 0.00 4.07 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 0.00 237 E 8.63 4.57 0.00 2.46 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 0.00 2.13 2.31 0.00 238 G 8.86 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 0.00 0.00 0.00 239 F 8.09 5.37 0.00 3.13 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 0.00 240 L 8.97 4.75 0.00 1.76 1.59 0.89 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 241 E 8.97 5.22 0.00 2.17 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 242 I 8.75 4.88 1.86 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.53 0.88 0.00 0.00 243 S 10.07 5.23 0.00 3.96 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 K 8.52 4.82 0.00 1.83 1.69 0.00 1.52 0.00 0.00 0.73 0.00 0.00 2.68 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.11 1.39 7.81 245 F 8.99 4.11 0.00 2.95 3.19 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 *247 D 7.73 4.38 0.00 2.79 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 0.00 248 N 8.41 5.19 0.00 2.73 2.66 0.00 0.00 7.54 7.74 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 0.00 249 A 8.63 4.24 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 250 S 8.59 4.06 0.00 3.94 4.09 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 0.00 251 K 8.59 4.09 0.00 1.86 1.71 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.39 1.35 7.81 252 L 8.10 4.42 0.00 2.00 2.01 1.01 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 253 L 8.14 4.42 0.00 1.60 1.63 0.49 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 254 N 7.96 4.12 0.00 2.84 2.81 0.00 0.00 7.02 7.01 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 0.00 255 V 7.80 4.27 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 0.82 0.00 0.00 0.88 0.00 0.00 256 D 9.65 5.00 0.00 2.73 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 257 Y 8.47 3.89 0.00 2.90 2.78 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 0.00 258 L 8.48 3.74 0.00 1.75 1.75 0.68 -0.03 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 0.00 259 D 7.50 4.50 0.00 2.46 2.58 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 0.00 260 E 8.72 4.54 0.00 1.92 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 2.31 2.27 0.00 261 I 8.27 4.88 1.84 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.79 0.87 0.00 0.00 262 E 9.05 4.43 0.00 1.95 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 2.18 2.26 0.00 263 I 8.27 4.50 1.83 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 1.35 0.63 0.86 0.00 0.00 264 E 8.33 4.60 0.00 2.02 1.85 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 2.00 2.10 0.00 * Residues marked with a * may have inaccurate shift predictions.