NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.3473 8.1133 121.1261 56.4928 31.9151 173.9236 3 T 4.8310 8.6310 123.1000 61.5050 70.1603 168.8732 4 V 4.5978 8.7560 120.6980 59.6717 35.4192 176.0809 5 S 4.9652 9.2608 115.3952 57.1214 63.9224 173.6148 6 T 4.9186 7.7024 111.2460 59.4246 72.9611 174.6575 7 V 3.4730 8.7156 121.2749 65.9977 31.4009 178.4392 8 A 3.9553 7.9356 120.0827 55.3512 18.4718 179.3656 9 E 3.9488 8.0738 116.6069 59.2266 29.3390 179.1771 10 L 3.8196 7.8892 120.4603 58.3976 41.9332 179.2761 11 R 3.8938 7.8559 116.6978 59.2334 30.0563 178.7331 12 A 4.0944 7.7248 119.3257 54.1604 18.4815 178.4730 13 A 4.4050 7.5614 116.2574 51.2254 19.7737 176.8088 14 L 4.0502 6.7472 117.0381 52.5964 42.8978 175.2583 15 P 4.3473 0.0000 0.0000 61.8988 32.0635 176.8537 16 R 3.9811 8.3718 117.6200 58.2682 29.7403 175.8281 17 E 4.6232 7.3400 113.9650 54.7308 33.0639 174.6325 18 G 3.8826 8.5163 103.3912 46.6019 0.0000 172.6652 19 V 4.7729 7.8148 119.8659 61.1556 33.4704 174.4223 20 G 4.5989 9.6549 116.0272 44.6285 0.0000 171.8888 21 F 5.8795 9.7311 127.8659 56.5626 42.6973 174.1069 22 V 4.3520 8.9778 126.7372 60.0962 32.7824 171.7126 23 P 4.8618 0.0000 0.0000 61.2415 32.0895 175.2075 24 T 4.2235 8.7481 117.3457 60.8871 72.8405 173.0812 *26 G 3.7991 8.5729 109.9064 45.9934 0.0000 170.2809 27 Y 3.5380 8.9554 115.8373 58.5018 36.7196 170.7753 28 L 3.9525 8.3036 119.7478 55.1255 42.9125 176.8574 29 H 5.0148 8.2171 115.7840 53.1390 31.9728 173.8269 30 R 4.0508 8.7908 116.9536 59.6261 29.4138 179.2309 31 G 3.6858 8.3961 105.0382 48.2433 0.0000 175.3006 32 H 4.1547 7.8112 118.4881 58.4639 28.5902 177.8601 33 L 3.9223 7.8555 120.1582 57.7749 41.4443 179.1956 34 A 3.9018 7.9967 120.6363 55.0146 18.2378 179.8151 35 L 3.9013 7.5487 117.6703 57.8883 41.7914 179.7484 36 V 3.4308 7.8960 118.4015 65.8479 31.2814 177.5089 37 E 3.8451 8.7607 119.5382 59.3944 29.1947 178.9106 38 R 3.8152 7.4871 116.9687 59.2676 30.3585 178.0219 39 A 3.2805 7.3918 120.5583 54.7097 17.7523 179.6201 40 R 3.8543 7.9280 117.4015 59.3278 29.9899 178.2191 41 R 4.0646 7.5245 115.2737 57.1666 30.3410 176.6134 42 E 4.7567 7.6555 116.0123 55.7525 31.5398 175.5920 43 N 5.1518 7.9527 115.6268 50.7679 42.6048 172.9456 44 P 4.5277 0.0000 0.0000 64.8296 32.5146 176.0219 45 F 4.8724 8.5023 123.1985 56.3430 42.8079 173.3331 46 V 4.9700 9.0993 126.3852 61.1073 34.0453 174.2269 47 V 5.1491 9.3976 127.4710 61.1421 34.5613 173.9928 48 A 5.5590 9.2901 128.5661 50.1740 22.7519 174.8848 49 S 5.4099 8.9679 114.7301 56.5629 66.2994 173.3400 50 V 4.7325 8.5971 121.6985 61.5588 34.0944 174.5426 51 F 4.8129 8.7740 130.3712 57.4377 42.2154 174.0130 52 V 3.3636 8.0258 127.5121 62.2283 31.2803 175.3394 53 N 4.3211 8.4178 127.9743 51.5804 38.3776 173.4216 54 P 3.8551 0.0000 0.0000 65.5065 31.0827 178.7640 55 L 3.9541 8.2747 118.6921 57.1218 41.6236 178.0658 56 Q 4.4213 7.9822 114.2066 55.8358 28.9465 175.2721 57 F 4.8721 8.0791 117.6910 56.0409 41.1840 175.7461 58 G 4.0839 9.6766 113.9669 43.4129 0.0000 173.1410 59 P 4.1788 0.0000 0.0000 65.6354 30.9898 177.5588 60 G 4.0310 7.9834 104.5228 45.1239 0.0000 174.0421 61 E 4.5776 7.8722 122.1562 56.0762 31.1534 176.9244 62 D 5.0212 8.8622 121.9323 54.1447 40.2704 177.7725 63 Y 2.8633 8.3960 122.7216 61.7006 38.6871 177.2917 64 H 4.1000 8.0862 115.2461 58.2090 28.8958 176.2453 65 R 4.3266 7.7002 112.4532 55.5766 29.8785 175.6397 66 Y 4.5095 7.7802 119.9421 56.5091 39.1101 174.2101 67 P 3.9121 0.0000 0.0000 63.2151 31.3841 175.7780 68 R 4.7089 7.9602 120.2597 54.7662 33.9218 175.3457 69 D 4.6802 8.3186 117.8498 52.1595 42.8621 175.0573 70 L 3.9996 8.1746 125.8036 57.6745 42.4012 177.8204 71 E 3.9359 8.1316 117.9696 59.4523 29.4114 179.0870 72 R 3.8703 8.4847 118.8019 59.6077 30.2389 178.3056 73 D 4.3425 8.0609 118.5116 57.2635 40.7111 178.9328 74 R 3.9624 8.2617 118.6703 59.0820 30.1242 178.5029 75 A 3.9545 7.9245 120.4524 55.3570 18.4069 179.2234 76 L 3.8385 7.5972 118.0860 58.5992 42.2033 179.3618 77 L 4.0060 8.0574 118.7192 57.4347 41.4822 179.1554 78 Q 3.8914 8.6054 120.0796 59.3636 28.8089 178.2218 79 E 3.9261 8.3541 118.9045 59.0903 29.7598 178.1795 80 A 4.1737 7.6392 119.2886 53.1053 18.3829 178.1295 81 G 3.7601 7.7012 105.3248 45.4838 0.0000 173.9471 82 V 3.6624 7.2947 119.0020 62.6353 32.0743 175.9369 83 D 4.3327 8.3706 126.7388 56.6320 41.5371 176.7530 84 L 4.9155 7.9930 120.1534 53.3627 45.8928 174.5934 85 L 5.1361 9.1320 128.7913 53.3870 44.5510 174.5502 86 F 5.4275 9.6194 129.2923 56.9021 40.9797 173.8055 87 A 5.2243 9.1506 129.7747 48.2668 18.8136 172.9337 88 P 4.6406 0.0000 0.0000 60.5617 33.4859 176.7784 89 G 4.5410 8.2543 109.4043 43.8053 0.0000 174.9695 90 V 3.9228 8.4966 119.1715 65.7894 31.6980 177.1547 91 E 4.1507 8.2159 117.5705 59.1219 29.7305 177.6329 92 E 4.1037 7.6600 118.7000 56.8553 29.2843 176.6540 *94 Y 4.2443 7.5862 114.5357 56.4747 38.2812 172.8412 95 P 4.7372 0.0000 0.0000 61.0438 32.6509 175.5496 96 E 4.2416 8.5196 120.6593 58.0495 29.7836 176.9005 97 G 4.0333 9.1081 114.2442 45.0805 0.0000 173.4633 98 F 4.0229 7.9325 121.9249 58.9562 39.4823 174.6780 99 A 4.5549 7.7557 127.0741 52.1771 20.7593 175.2216 100 T 4.4194 6.4667 113.3354 62.6923 70.1885 174.4334 101 R 4.7992 8.0724 121.8575 54.4790 34.2392 174.8385 102 V 4.5576 8.6615 120.0706 61.1412 34.2972 175.0572 103 Q 4.5874 8.3878 122.8893 54.8056 31.3039 173.7519 104 V 4.0803 8.2918 120.3274 61.6353 32.5196 175.4128 105 E 4.3595 8.6227 126.7007 55.0483 31.5390 175.0007 106 G 3.8528 8.3722 105.4254 44.1616 0.0000 172.2781 107 P 4.1668 0.0000 0.0000 65.3847 30.8115 178.4753 108 L 3.8951 7.8971 118.4119 57.6524 42.2143 178.0372 109 T 4.1112 7.6846 107.0238 62.0669 69.5405 176.0582 110 A 4.1026 7.4725 123.1162 53.3801 19.1804 177.6495 111 L 3.8649 7.4791 117.1937 53.7778 44.6143 181.8629 112 W 3.4140 7.5657 121.2714 57.5866 28.7258 177.5452 113 E 4.3933 7.5594 130.6939 60.3358 28.7877 178.2113 114 G 4.4764 8.7895 106.4565 47.3019 0.0000 175.3285 115 A 4.1853 7.8203 121.8677 54.6692 18.5167 179.4978 116 V 3.9287 7.8603 115.6965 64.3109 33.3524 176.3601 117 R 4.5603 8.2777 118.6962 52.8872 29.8269 172.0713 118 P 4.5208 0.0000 0.0000 63.9489 32.2848 177.7730 119 G 4.0010 9.0128 110.7311 46.0613 0.0000 174.7605 120 H 4.0696 8.1588 119.2788 59.6507 29.6984 177.3198 121 F 4.3120 7.7790 118.6019 60.2581 38.7677 177.3774 122 Q 4.1294 8.2049 119.3998 58.9466 28.9393 178.1993 123 G 3.6823 7.8150 107.9325 47.0397 0.0000 175.9928 124 V 3.5535 7.7517 120.4132 65.7581 31.6089 177.9072 125 A 3.9604 8.3365 120.8707 55.4905 18.2170 179.7486 126 T 3.9349 8.1230 114.3348 66.9029 68.5464 177.3990 127 V 3.8490 7.9210 121.0867 64.8449 31.4146 178.5857 128 V 3.4073 8.2225 119.0735 65.4477 31.3233 177.8802 129 A 3.6947 8.0730 120.7276 54.9444 18.2035 179.6312 130 R 3.9317 8.0723 117.1095 59.7411 30.1930 178.6220 131 L 4.0488 8.3091 119.1577 58.0554 41.6335 179.6718 132 F 4.5576 8.5778 117.9288 60.7081 38.6038 177.7490 133 L 4.5167 8.0796 117.6852 57.5125 41.5053 179.0923 134 L 4.0910 7.9924 118.6165 57.2318 41.7307 178.8292 135 V 3.5700 7.8950 117.0588 62.5716 32.5047 175.6738 136 Q 3.4354 8.2328 117.1092 56.1272 26.6218 171.8699 137 P 4.5388 0.0000 0.0000 62.5646 33.0933 176.1713 138 Q 4.2647 9.0025 121.2617 58.2229 30.4438 175.8398 139 R 5.0906 7.9440 115.8892 54.2044 34.8761 174.1841 140 A 5.3203 8.8453 123.9110 50.4044 22.4155 174.3637 141 Y 5.1328 9.0609 120.0229 56.2872 40.0145 175.4884 142 F 4.8885 9.4987 122.5367 55.4214 43.2918 174.8724 143 G 4.2256 8.8295 108.4699 46.2596 0.0000 173.7245 144 E 4.4372 9.0335 120.8713 57.7018 29.5852 178.1270 145 K 3.9974 7.7079 121.0331 59.3491 33.0133 177.7882 146 D 4.9006 7.8578 120.1531 52.8322 37.4996 176.0453 147 Y 4.0767 7.8780 124.7813 60.9603 39.3717 176.9854 148 Q 3.9376 8.3482 119.8030 59.2646 29.1570 177.8065 149 Q 4.0508 8.2771 120.0959 59.0794 29.1765 177.7953 150 L 3.6182 7.8778 121.3244 58.1656 42.0320 179.0681 151 L 3.8130 7.5984 118.8258 57.4671 41.2288 179.6806 152 V 3.3573 7.4373 117.7290 65.8417 31.5217 177.9141 153 V 3.5681 7.4409 116.7793 66.0304 31.5036 177.8007 154 R 4.0750 7.7944 117.7143 59.1110 29.8141 179.6141 155 R 4.0493 7.8829 115.1407 57.1092 29.8286 178.1146 *157 V 4.3593 7.7166 118.5374 62.6241 33.3419 177.4505 158 R 3.9214 8.3953 118.7988 59.6654 30.0864 177.3308 159 D 4.5306 8.4344 116.6401 57.6018 40.8470 178.2561 160 L 4.0452 7.9045 117.0274 56.0866 41.8929 177.8594 161 G 3.8407 8.1837 106.2760 45.7365 0.0000 173.5433 162 F 4.1030 8.3095 118.6851 56.6750 39.7901 175.0126 163 P 4.6498 0.0000 0.0000 62.4626 30.1170 176.1332 164 V 4.4611 7.2710 117.0281 61.6214 35.0098 175.0599 165 E 4.3225 8.9432 129.1446 54.9908 30.7478 175.1409 166 V 4.4002 8.3470 128.4823 62.1295 32.2728 175.0005 167 V 4.2065 8.7377 129.8790 61.2358 33.1694 174.6426 168 G 4.4043 8.7389 115.4171 45.1020 0.0000 172.7394 169 V 4.6519 8.8767 125.0404 60.0715 34.0001 173.2359 170 P 4.8233 0.0000 0.0000 63.2617 32.0025 176.2395 171 T 4.0351 8.5138 119.6355 63.7798 69.3417 173.9820 172 V 4.0957 8.3463 125.3236 61.6273 32.8520 174.9741 173 R 4.9181 7.9882 124.3457 53.9869 33.7626 174.8289 174 E 4.2911 8.7008 119.9940 55.6460 30.3047 178.2728 175 E 3.9608 8.5748 119.3253 59.5157 29.4552 178.1440 176 D 4.5198 7.9311 115.5554 53.6484 39.8918 176.8874 177 G 3.7846 7.9768 109.0417 45.1507 0.0000 173.9770 178 L 3.8586 8.3042 122.7785 54.7812 42.3522 175.8572 179 A 4.4299 8.3590 128.3743 51.8548 18.9848 176.9364 180 L 4.0777 8.2712 122.8652 54.9909 42.4959 176.7734 181 S 4.5938 8.2250 115.5564 56.1968 65.3436 175.2970 182 S 4.3004 9.1942 122.5708 61.9804 62.6181 176.9092 183 R 3.1317 7.7463 118.9544 57.6606 29.7640 178.1762 184 N 4.3124 8.2120 117.5431 55.8997 38.2263 177.2217 185 V 3.6300 7.1357 119.8718 64.8729 31.5328 177.7102 186 Y 4.4576 7.8929 117.5351 59.5574 37.7246 176.0234 187 L 4.4412 7.5507 120.7971 54.4970 42.2956 177.8501 188 S 4.4585 8.6227 118.4756 57.2256 65.0810 173.7019 189 P 4.1901 0.0000 0.0000 65.7659 30.9993 178.6067 190 E 4.0804 8.0047 116.8814 59.7645 29.4814 179.3781 191 T 3.5696 7.8422 115.8102 66.3393 68.1801 176.6471 192 R 3.7655 7.9010 120.1555 59.4798 30.0539 178.4531 193 K 4.0976 7.5701 117.0850 58.6822 32.3379 178.7456 194 K 4.2469 7.6845 117.5012 57.9188 32.5188 178.3419 195 A 4.2373 7.9281 121.4534 54.7789 18.1834 177.2955 196 P 4.5395 0.0000 0.0000 64.0996 31.3234 178.6037 197 V 3.6214 7.8666 119.3988 64.5959 31.1132 178.2306 198 L 3.6952 7.2882 118.1332 57.9364 41.4511 178.9052 199 Y 4.2012 7.9602 118.7387 60.5993 38.7202 177.8491 200 R 3.6912 8.0981 119.5683 59.2483 29.9579 178.3781 201 A 3.9332 8.0417 119.8368 55.1229 18.4507 179.2610 202 L 4.0299 7.5836 116.3785 57.9431 41.9790 179.4752 203 L 3.9497 7.8565 118.9847 57.3485 41.4213 179.9051 204 A 4.0570 7.7873 117.6612 52.8722 18.1089 179.0341 *206 R 4.1010 7.9585 122.8895 57.8186 32.1217 177.0231 207 E 3.8379 8.5337 118.4936 59.3962 29.4592 178.7143 208 V 3.5872 7.7805 117.7055 66.2106 31.5234 177.8592 209 A 3.7088 8.0240 119.7623 55.1132 17.9774 179.7520 210 G 3.5145 7.9776 103.0180 47.5194 0.0000 174.9815 211 Q 4.3705 7.7728 117.7225 55.7961 28.9320 176.7164 212 G 3.9089 7.8356 108.8109 45.2081 0.0000 174.2932 213 G 3.8979 7.9998 108.7939 44.8370 0.0000 174.5672 214 S 4.7233 9.2853 116.2062 57.3406 65.3497 175.6362 215 V 2.6228 7.6167 120.8699 65.7572 31.0869 177.7682 216 A 3.9051 7.7226 119.8987 55.3113 18.2994 179.3211 217 E 3.9603 8.2218 116.8621 59.4168 29.5190 179.4884 218 A 4.1148 8.4625 121.3496 55.1180 18.4030 179.6631 219 L 3.9664 8.2057 117.7529 57.9539 41.5953 179.9396 220 R 3.8984 8.0893 117.7550 59.2090 30.0292 178.8550 221 A 4.0910 8.0484 120.5943 55.1523 18.4668 179.9370 222 G 3.5312 8.1821 104.0729 47.9951 0.0000 175.6955 223 E 4.0035 8.4704 121.7137 59.0441 29.2686 179.0190 224 E 3.8957 8.2662 118.1114 59.2272 30.0263 178.3374 225 A 4.1408 7.9764 120.6553 55.3906 18.4817 179.6367 226 L 3.9931 7.8563 117.0652 57.9348 41.4802 179.6865 227 R 4.1188 7.7933 116.2633 58.0700 30.0493 178.0865 228 A 4.4393 7.8409 119.8502 52.7360 19.5224 177.6762 229 V 4.3427 7.8690 117.5013 59.7409 31.7955 173.9244 230 P 4.4344 0.0000 0.0000 64.8707 31.6042 178.4350 231 E 4.0411 8.2904 117.7284 58.4478 29.6178 176.3833 232 F 3.7854 7.9682 121.2467 56.9721 39.0933 175.3461 233 R 4.0989 7.8560 129.6387 54.1388 30.6113 176.0247 234 K 3.7797 8.0501 125.8850 56.9557 32.4962 176.0263 235 D 4.7652 9.2410 127.8258 56.4611 42.6479 175.8931 236 Y 5.0004 7.0882 113.4425 56.3828 41.2673 173.3202 237 L 5.0963 8.5751 121.9461 54.1438 45.0888 174.4236 238 A 4.5662 8.8673 126.6429 51.1722 23.7925 174.6248 239 I 4.8854 8.1863 119.0079 59.8725 40.1130 175.5590 240 V 4.9784 8.7927 119.9273 59.0405 36.3180 174.6560 241 H 4.6182 9.1607 122.8332 55.6451 30.0162 174.6776 242 P 4.4417 0.0000 0.0000 65.1459 31.3751 176.7116 243 E 4.5474 8.5071 117.1566 57.3927 31.0396 176.7693 244 T 4.2315 8.1176 106.3726 61.1101 69.8521 175.2124 245 L 3.9733 8.3079 120.4578 55.4969 39.8738 174.0516 246 L 4.5842 7.6329 119.1163 53.4419 43.0089 174.8154 247 P 4.8254 0.0000 0.0000 63.1977 31.9273 175.7320 248 L 4.6977 8.4345 123.7676 53.6313 42.7488 176.8883 249 S 4.4472 8.5890 115.3980 58.6962 64.4167 173.5430 250 D 4.4507 7.3087 118.4478 51.8095 44.1065 174.5304 251 W 4.3183 8.0545 123.6305 57.0389 29.8388 176.1837 252 V 4.5854 8.1254 113.0257 59.2550 35.2433 174.6050 253 A 4.4168 8.7081 126.0328 54.1068 18.4891 178.2080 254 G 4.0255 9.5366 112.2334 43.5774 0.0000 173.3181 255 A 4.1019 7.9394 121.4307 52.4558 19.5992 176.4546 256 R 4.7161 9.2387 123.6302 54.3867 32.5234 175.0065 257 G 4.3344 9.2124 114.9368 45.4299 0.0000 172.5546 258 I 5.3272 8.8404 118.1812 59.2683 41.4690 174.6244 259 V 5.0030 8.6493 121.6778 61.0869 35.0396 172.7491 260 A 4.8754 7.5693 121.6935 51.3001 23.1939 176.0408 261 G 3.4250 8.0900 105.9555 46.2361 0.0000 172.0877 262 R 5.2020 7.4212 114.9524 54.6174 33.2222 174.5593 263 F 5.1592 9.3999 119.3515 55.2163 41.6922 175.1170 264 P 4.2534 0.0000 0.0000 65.6031 31.0573 177.5511 265 E 4.3776 8.1016 112.0868 56.3165 30.6082 175.3877 266 A 4.6788 7.8957 121.3443 51.5327 22.5322 174.9035 267 R 4.9753 8.6984 120.8098 54.5491 32.0926 175.4120 268 L 5.2178 8.7544 124.3306 53.0342 45.6647 175.4078 269 I 5.1306 8.0700 113.1930 59.9794 41.1261 173.3534 270 D 4.7939 8.9163 121.1141 54.1604 45.1160 173.5711 271 N 5.3428 8.5770 118.2454 52.3583 40.3948 173.1383 272 L 4.5070 8.6346 120.1061 53.8012 46.3398 173.6060 273 E 4.5051 8.7887 126.5403 56.4881 30.3257 176.9879 274 V 4.3647 8.7167 119.9410 61.5766 32.8463 175.5301 275 Y 4.4221 7.5240 121.2882 55.3367 41.7148 172.4143 276 P 2.9700 0.0000 0.0000 62.4772 31.3775 176.0533 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 R 8.11 4.35 0.00 1.95 1.93 0.00 3.15 0.00 0.00 3.39 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 3 T 8.63 4.83 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 4 V 8.76 4.60 2.29 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 0.87 0.00 0.00 1.17 0.00 0.00 5 S 9.26 4.97 0.00 3.98 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 6 T 7.70 4.92 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 7 V 8.72 3.47 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.06 0.00 0.00 8 A 7.94 3.96 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.07 3.95 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 10 L 7.89 3.82 0.00 1.50 1.57 0.61 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 11 R 7.86 3.89 0.00 1.75 1.92 0.00 3.16 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.53 0.00 12 A 7.72 4.09 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 A 7.56 4.40 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 14 L 6.75 4.05 0.00 1.67 1.42 0.80 0.85 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 15 P 0.00 4.35 0.00 1.81 1.74 0.00 2.79 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.36 0.00 16 R 8.37 3.98 0.00 1.87 2.00 0.00 2.93 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 17 E 7.34 4.62 0.00 2.02 1.92 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 2.13 2.26 0.00 18 G 8.52 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 0.00 0.00 0.00 19 V 7.81 4.77 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 1.15 0.00 0.00 0.78 0.00 0.00 20 G 9.65 4.60 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 0.00 0.00 0.00 21 F 9.73 5.88 0.00 3.01 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 V 8.98 4.35 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 0.83 0.00 0.00 0.85 0.00 0.00 23 P 0.00 4.86 0.00 1.97 1.57 0.00 2.72 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.12 0.00 24 T 8.75 4.22 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 *26 G 8.57 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 27 Y 8.96 3.54 0.00 3.20 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 28 L 8.30 3.95 0.00 1.55 1.46 0.85 0.89 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 29 H 8.22 5.01 0.00 3.27 3.39 0.00 5.67 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 30 R 8.79 4.05 0.00 1.87 2.03 0.00 3.11 0.00 0.00 3.31 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 31 G 8.40 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 H 7.81 4.15 0.00 3.28 3.30 0.00 5.82 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 7.86 3.92 0.00 1.90 1.69 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.00 3.90 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 L 7.55 3.90 0.00 1.82 1.68 0.90 0.80 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 36 V 7.90 3.43 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 0.92 0.00 0.00 0.88 0.00 0.00 37 E 8.76 3.85 0.00 2.01 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 2.27 2.29 0.00 38 R 7.49 3.82 0.00 1.86 1.92 0.00 3.46 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.81 0.00 39 A 7.39 3.28 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 R 7.93 3.85 0.00 1.99 1.87 0.00 3.14 0.00 0.00 3.10 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 41 R 7.52 4.06 0.00 1.78 1.96 0.00 3.15 0.00 0.00 3.21 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 42 E 7.66 4.76 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.47 0.00 43 N 7.95 5.15 0.00 2.79 2.94 0.00 0.00 6.97 9.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 P 0.00 4.53 0.00 2.16 2.23 0.00 3.90 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.02 0.00 45 F 8.50 4.87 0.00 3.13 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 46 V 9.10 4.97 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 0.91 0.00 0.00 0.89 0.00 0.00 47 V 9.40 5.15 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 1.07 0.00 0.00 1.24 0.00 0.00 48 A 9.29 5.56 1.26 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 0.00 0.00 49 S 8.97 5.41 0.00 4.23 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 V 8.60 4.73 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 1.01 0.00 0.00 0.96 0.00 0.00 51 F 8.77 4.81 0.00 2.89 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 52 V 8.03 3.36 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 0.45 0.00 0.00 0.82 0.00 0.00 53 N 8.42 4.32 0.00 3.02 2.93 0.00 0.00 6.88 7.71 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 54 P 0.00 3.86 0.00 1.81 1.38 0.00 3.91 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.07 0.00 55 L 8.27 3.95 0.00 1.90 1.75 0.66 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 56 Q 7.98 4.42 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.68 0.00 0.00 0.00 0.00 0.00 2.51 1.91 0.00 57 F 8.08 4.87 0.00 3.03 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 58 G 9.68 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 P 0.00 4.18 0.00 2.20 2.22 0.00 3.78 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 60 G 7.98 4.03 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 0.00 0.00 0.00 61 E 7.87 4.58 0.00 2.38 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 2.39 2.31 0.00 62 D 8.86 5.02 0.00 3.02 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 63 Y 8.40 2.86 0.00 2.04 2.67 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 64 H 8.09 4.10 0.00 3.16 3.25 0.00 5.74 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 R 7.70 4.33 0.00 1.82 1.95 0.00 2.65 0.00 0.00 2.96 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.47 0.00 66 Y 7.78 4.51 0.00 3.09 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 67 P 0.00 3.91 0.00 0.49 1.04 0.00 2.33 0.00 0.00 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 1.24 0.00 68 R 7.96 4.71 0.00 1.75 1.84 0.00 3.16 0.00 0.00 3.10 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.87 0.00 69 D 8.32 4.68 0.00 2.82 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 L 8.17 4.00 0.00 1.81 1.67 0.94 0.95 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 71 E 8.13 3.94 0.00 2.02 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 2.41 2.32 0.00 72 R 8.48 3.87 0.00 2.02 1.96 0.00 2.95 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 73 D 8.06 4.34 0.00 2.93 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 74 R 8.26 3.96 0.00 2.00 1.97 0.00 3.16 0.00 0.00 3.34 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.94 0.00 75 A 7.92 3.95 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 76 L 7.60 3.84 0.00 1.84 1.86 0.84 1.10 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 77 L 8.06 4.01 0.00 1.84 1.68 0.93 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 8.61 3.89 0.00 2.13 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 79 E 8.35 3.93 0.00 2.04 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 2.30 2.45 0.00 80 A 7.64 4.17 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 81 G 7.70 3.76 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 82 V 7.29 3.66 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 0.84 0.00 0.00 0.92 0.00 0.00 83 D 8.37 4.33 0.00 1.58 1.60 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 84 L 7.99 4.92 0.00 1.93 1.67 1.10 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 85 L 9.13 5.14 0.00 1.82 1.55 1.02 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 86 F 9.62 5.43 0.00 3.04 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 A 9.15 5.22 1.19 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 88 P 0.00 4.64 0.00 1.64 1.25 0.00 3.02 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.47 0.00 89 G 8.25 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 V 8.50 3.92 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 1.07 0.00 0.00 1.12 0.00 0.00 91 E 8.22 4.15 0.00 2.19 2.24 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 2.38 2.27 0.00 92 E 7.66 4.10 0.00 1.86 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.57 0.00 *94 Y 7.59 4.24 0.00 3.05 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 95 P 0.00 4.74 0.00 2.29 2.05 0.00 4.09 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.31 0.00 96 E 8.52 4.24 0.00 1.95 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 97 G 9.11 4.03 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 0.00 0.00 0.00 98 F 7.93 4.02 0.00 3.28 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 99 A 7.76 4.55 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 0.00 100 T 6.47 4.42 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 1.15 0.00 0.00 101 R 8.07 4.80 0.00 1.73 1.79 0.00 3.35 0.00 0.00 3.24 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 102 V 8.66 4.56 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 1.03 0.00 0.00 103 Q 8.39 4.59 0.00 2.18 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.54 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 104 V 8.29 4.08 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 0.78 0.00 0.00 0.91 0.00 0.00 105 E 8.62 4.36 0.00 1.98 1.87 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 2.24 2.29 0.00 106 G 8.37 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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1.26 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 0.00 132 F 8.58 4.56 0.00 3.05 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 0.00 133 L 8.08 4.52 0.00 1.93 1.83 1.09 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 134 L 7.99 4.09 0.00 1.60 1.46 0.88 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 135 V 7.89 3.57 1.67 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 0.48 0.00 0.00 0.19 0.00 0.00 136 Q 8.23 3.44 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.73 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 137 P 0.00 4.54 0.00 2.41 2.07 0.00 3.72 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.93 0.00 138 Q 9.00 4.26 0.00 2.15 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 139 R 7.94 5.09 0.00 1.86 1.45 0.00 3.25 0.00 0.00 3.32 7.20 0.00 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7.72 4.36 2.29 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 1.10 0.00 0.00 1.11 0.00 0.00 158 R 8.40 3.92 0.00 1.96 2.10 0.00 3.33 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 159 D 8.43 4.53 0.00 2.78 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 L 7.90 4.05 0.00 1.79 1.62 1.10 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 161 G 8.18 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 0.00 162 F 8.31 4.10 0.00 3.13 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 P 0.00 4.65 0.00 2.18 2.11 0.00 3.82 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.95 0.00 164 V 7.27 4.46 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 0.31 0.00 0.00 0.67 0.00 0.00 165 E 8.94 4.32 0.00 2.04 1.74 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.39 0.00 174 E 8.70 4.29 0.00 2.06 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 2.39 2.37 0.00 175 E 8.57 3.96 0.00 1.93 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 176 D 7.93 4.52 0.00 2.77 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 0.00 177 G 7.98 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 L 8.30 3.86 0.00 1.75 1.60 0.97 0.95 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 0.00 179 A 8.36 4.43 1.19 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 0.00 180 L 8.27 4.08 0.00 1.33 1.16 0.85 0.59 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 0.00 181 S 8.23 4.59 0.00 3.87 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 S 9.19 4.30 0.00 3.97 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 0.00 183 R 7.75 3.13 0.00 1.72 1.65 0.00 3.23 0.00 0.00 3.48 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.65 0.00 184 N 8.21 4.31 0.00 2.79 2.84 0.00 0.00 6.59 8.54 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 0.00 185 V 7.14 3.63 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 0.40 0.00 0.00 0.99 0.00 0.00 186 Y 7.89 4.46 0.00 3.08 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 L 7.55 4.44 0.00 1.65 1.53 0.89 1.14 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 0.00 188 S 8.62 4.46 0.00 4.16 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 0.00 189 P 0.00 4.19 0.00 2.02 2.14 0.00 3.66 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 2.01 2.17 0.00 190 E 8.00 4.08 0.00 2.01 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 2.38 2.44 0.00 191 T 7.84 3.57 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 0.31 0.00 0.00 192 R 7.90 3.77 0.00 1.77 2.15 0.00 3.26 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 193 K 7.57 4.10 0.00 1.89 1.83 0.00 1.73 0.00 0.00 1.68 0.00 0.00 3.16 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.65 7.81 194 K 7.68 4.25 0.00 1.75 1.96 0.00 1.67 0.00 0.00 2.04 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.47 7.81 195 A 7.93 4.24 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 P 0.00 4.54 0.00 2.19 2.32 0.00 3.70 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.22 0.00 197 V 7.87 3.62 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 0.74 0.00 0.00 0.86 0.00 0.00 198 L 7.29 3.70 0.00 1.74 1.69 0.66 0.72 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 0.00 199 Y 7.96 4.20 0.00 3.14 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 0.00 200 R 8.10 3.69 0.00 2.04 2.04 0.00 3.13 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 1.58 1.61 0.00 201 A 8.04 3.93 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 0.00 202 L 7.58 4.03 0.00 1.68 1.67 1.04 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 203 L 7.86 3.95 0.00 1.51 1.50 0.65 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 204 A 7.79 4.06 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 *206 R 7.96 4.10 0.00 1.83 2.06 0.00 3.15 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 207 E 8.53 3.84 0.00 2.02 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 2.35 0.00 208 V 7.78 3.59 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 1.18 0.00 0.00 0.97 0.00 0.00 209 A 8.02 3.71 0.64 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 0.00 0.00 210 G 7.98 3.51 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 0.00 0.00 0.00 211 Q 7.77 4.37 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.73 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 212 G 7.84 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 0.00 213 G 8.00 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 0.00 0.00 0.00 214 S 9.29 4.72 0.00 3.99 4.06 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 0.00 215 V 7.62 2.62 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 0.76 0.00 0.00 -0.69 0.00 0.00 216 A 7.72 3.91 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 0.00 217 E 8.22 3.96 0.00 2.37 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 2.36 2.35 0.00 218 A 8.46 4.11 1.67 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 0.00 219 L 8.21 3.97 0.00 1.86 1.73 0.87 1.16 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 0.00 220 R 8.09 3.90 0.00 2.04 1.99 0.00 3.14 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 221 A 8.05 4.09 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 0.00 222 G 8.18 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 E 8.47 4.00 0.00 2.16 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.49 0.00 224 E 8.27 3.90 0.00 2.07 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 0.00 2.33 2.49 0.00 225 A 7.98 4.14 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 0.00 226 L 7.86 3.99 0.00 1.96 1.87 1.05 0.71 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 0.00 227 R 7.79 4.12 0.00 1.99 2.01 0.00 3.18 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.87 0.00 228 A 7.84 4.44 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 0.00 229 V 7.87 4.34 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 1.37 0.00 0.00 1.00 0.00 0.00 230 P 0.00 4.43 0.00 2.25 2.21 0.00 3.89 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 2.04 2.03 0.00 231 E 8.29 4.04 0.00 2.35 2.34 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 2.43 2.46 0.00 232 F 7.97 3.79 0.00 2.53 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 R 7.86 4.10 0.00 1.47 1.67 0.00 3.26 0.00 0.00 2.96 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.60 0.00 234 K 8.05 3.78 0.00 1.74 1.63 0.00 1.83 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.59 7.81 235 D 9.24 4.77 0.00 2.46 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 236 Y 7.09 5.00 0.00 3.22 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 0.00 237 L 8.58 5.10 0.00 1.65 1.73 0.97 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 238 A 8.87 4.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 239 I 8.19 4.89 1.73 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.99 0.88 0.00 0.00 240 V 8.79 4.98 2.34 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 0.73 0.00 0.00 0.93 0.00 0.00 241 H 9.16 4.62 0.00 3.25 3.24 0.00 5.60 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 242 P 0.00 4.44 0.00 2.32 2.48 0.00 3.37 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 1.85 2.13 0.00 243 E 8.51 4.55 0.00 2.12 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 0.00 2.29 2.36 0.00 244 T 8.12 4.23 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 1.15 0.00 0.00 245 L 8.31 3.97 0.00 2.04 2.28 1.09 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 246 L 7.63 4.58 0.00 1.61 1.62 0.91 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 247 P 0.00 4.83 0.00 2.00 2.10 0.00 3.75 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.62 0.00 248 L 8.43 4.70 0.00 1.34 1.63 0.97 0.74 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 0.00 249 S 8.59 4.45 0.00 3.89 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 0.00 250 D 7.31 4.45 0.00 2.51 2.45 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 0.00 0.00 0.00 0.00 251 W 8.05 4.32 0.00 2.77 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 0.00 0.00 0.00 252 V 8.13 4.59 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.99 0.00 0.00 253 A 8.71 4.42 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 254 G 9.54 4.03 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 0.00 0.00 0.00 255 A 7.94 4.10 1.61 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 0.00 0.00 256 R 9.24 4.72 0.00 1.70 1.61 0.00 2.85 0.00 0.00 2.52 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 1.25 0.00 257 G 9.21 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 0.00 258 I 8.84 5.33 1.92 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.63 0.80 0.00 0.00 259 V 8.65 5.00 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 0.67 0.00 0.00 0.99 0.00 0.00 260 A 7.57 4.88 0.60 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 0.00 0.00 261 G 8.09 3.42 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 0.00 262 R 7.42 5.20 0.00 1.89 1.91 0.00 2.66 0.00 0.00 3.09 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.50 0.00 263 F 9.40 5.16 0.00 3.19 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 264 P 0.00 4.25 0.00 2.10 2.17 0.00 3.88 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 265 E 8.10 4.38 0.00 2.06 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 2.30 2.50 0.00 266 A 7.90 4.68 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 0.00 267 R 8.70 4.98 0.00 1.81 1.89 0.00 3.18 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.86 0.00 268 L 8.75 5.22 0.00 1.79 1.60 1.12 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 269 I 8.07 5.13 1.96 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.73 1.03 0.00 0.00 270 D 8.92 4.79 0.00 2.75 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 271 N 8.58 5.34 0.00 2.73 2.76 0.00 0.00 5.79 7.79 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 0.00 272 L 8.63 4.51 0.00 1.82 1.49 1.03 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 273 E 8.79 4.51 0.00 2.06 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 274 V 8.72 4.36 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 1.28 0.00 0.00 275 Y 7.52 4.42 0.00 2.70 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 0.00 276 P 0.00 2.97 0.00 1.76 1.31 0.00 3.73 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.75 0.00 * Residues marked with a * may have inaccurate shift predictions.