NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2923 7.8827 121.4515 61.1977 38.8242 173.7631 17 V 4.3972 8.7111 125.5517 61.8428 32.7793 174.5494 18 G 3.8330 8.5286 114.1329 46.7721 0.0000 173.4241 19 G 4.2662 7.7460 109.9001 44.3057 0.0000 172.7607 20 Y 4.9523 7.8867 117.3188 55.1103 41.8719 175.1458 21 T 4.1667 8.6190 117.3018 64.4177 68.8861 175.6587 22 C 4.1856 8.7646 125.6107 58.9760 35.2083 175.6990 23 G 3.9808 7.7916 102.8370 45.0063 0.0000 172.7375 24 A 4.3880 8.4019 126.0652 53.4829 18.6552 176.9285 25 N 4.3008 8.9061 119.3074 54.5209 35.9892 175.3110 26 T 4.2123 7.6472 107.2951 62.6046 69.8263 175.2442 27 V 4.1120 7.0709 122.3094 60.4260 31.3305 173.5947 28 P 4.4768 0.0000 0.0000 64.1735 32.2184 178.2501 29 Y 4.9767 7.1290 115.9986 57.1590 38.6848 174.5567 30 Q 4.5647 7.4757 123.4973 56.0546 29.8672 175.1517 31 V 4.7399 8.8865 125.7751 61.1954 35.1351 173.7594 32 S 4.9854 8.6981 121.1186 56.6087 64.4348 172.6314 33 L 4.5752 8.3262 127.7477 53.5939 43.1608 175.1972 34 N 5.5751 8.8760 121.9846 49.8334 42.1464 174.7868 *37 S 4.2177 8.3514 120.9507 58.3089 63.9784 174.4069 38 G 3.9360 9.9808 106.7427 45.7105 0.0000 172.0091 39 Y 4.4693 6.5161 114.6973 56.0740 39.8372 172.6288 40 H 4.4440 8.8903 122.1254 56.2788 30.3031 174.7728 41 F 5.0463 7.7336 120.3827 56.9797 39.6861 174.1477 42 C 4.7411 6.8792 114.8141 56.2446 43.1382 173.5767 43 G 4.2466 8.7656 109.5802 45.8503 0.0000 172.0897 44 G 4.5906 8.0718 105.2364 46.4972 0.0000 172.5211 45 S 5.4865 8.7023 115.3931 56.4075 66.5473 173.7622 46 L 4.6731 9.2040 127.6852 54.8768 42.2869 177.0594 47 I 4.4592 8.5140 120.0001 61.1236 39.2236 174.5499 48 N 5.2087 7.7612 116.5576 53.2343 39.3539 174.5026 49 S 4.4548 8.7128 111.2870 60.4255 63.5314 174.3204 50 Q 4.5523 9.1006 121.2739 55.3028 31.0108 174.3075 51 W 5.5428 8.3451 116.5732 55.6360 33.5290 174.2698 52 V 5.1093 9.1563 123.8223 61.0744 34.3145 174.3891 53 V 4.9466 8.6719 126.7515 60.7096 34.0703 175.0819 54 S 5.1394 9.0320 116.4595 57.9442 66.0807 172.0460 55 A 4.8645 8.4969 120.7049 50.4737 20.6131 178.2661 56 A 3.8194 8.3412 124.4742 55.3651 18.4128 179.4099 57 H 4.4875 8.1260 109.5415 57.6757 28.7529 175.5283 58 C 4.6573 7.8560 116.9237 57.6019 40.3163 173.2473 59 Y 4.1903 7.7574 122.3619 57.6936 38.8013 175.0603 60 K 3.9822 6.9420 125.8667 54.9386 35.1176 175.0368 61 S 4.2468 7.9675 117.8191 58.6887 64.1742 173.4301 62 G 3.6392 8.4948 106.7849 46.5147 0.0000 173.5662 63 I 4.2402 7.5990 120.0071 60.0480 39.0670 175.0987 64 Q 4.8738 8.8348 128.8721 54.3939 31.1642 174.1450 65 V 4.4258 8.7751 127.0153 61.6651 33.6380 174.5254 66 R 5.0530 8.9122 127.1849 54.5827 32.5877 174.9992 67 L 4.7964 9.1082 124.5212 52.5784 45.0217 177.4576 *69 G 3.7393 8.2622 107.7170 45.3919 0.0000 172.6655 70 E 4.3550 8.2890 118.7313 55.4748 29.8667 174.1676 71 D 4.8679 7.9572 119.1788 55.4172 44.4261 174.6192 72 N 4.8881 8.6739 121.4517 53.2981 39.1008 176.1505 73 I 3.8340 8.5328 120.2540 62.3057 37.8165 176.3283 74 N 4.7436 8.7337 117.9926 53.0373 39.5417 174.8002 75 V 4.3675 7.2765 116.7207 60.5450 33.9716 174.9413 76 V 4.0505 8.3804 126.5638 62.7446 31.5962 175.2647 77 E 4.5061 9.8733 126.2658 55.4542 31.3723 177.2063 78 G 3.8687 7.9927 105.6148 46.8652 0.0000 173.9474 79 N 4.5291 8.8492 116.6765 52.8817 36.5265 174.2711 80 E 4.5047 7.7104 117.3930 56.3663 30.7158 176.2373 81 Q 4.4663 8.9272 121.0783 54.2233 32.6563 174.0973 82 F 5.5770 8.8072 122.7152 55.9816 41.0980 175.2746 83 I 4.7117 8.8271 124.2904 59.4208 41.1923 175.3330 84 S 4.7094 8.7209 122.2389 58.1879 64.2320 173.3744 85 A 4.4696 8.4630 125.8163 52.2994 18.0900 177.8446 86 S 4.5441 8.8944 117.8311 59.9830 64.4462 174.6538 87 K 4.7484 7.6112 117.3395 55.5073 35.9180 175.1096 88 S 5.1429 8.7588 116.9984 56.9707 66.1557 173.7272 89 I 4.4721 9.2863 125.6350 59.3457 39.1383 174.8218 90 V 4.0489 8.2610 127.3749 62.2928 32.5597 175.1633 91 H 3.8798 8.7683 127.4023 56.2525 29.9310 174.4593 92 P 4.3424 0.0000 0.0000 65.2312 31.4195 177.2178 93 S 4.6644 8.0111 112.0338 58.0474 62.9988 173.2231 94 Y 4.2773 7.7974 122.3906 58.2549 38.8732 175.1914 95 N 4.4756 8.3635 126.0879 51.4547 39.7570 175.2515 96 S 3.8678 7.8558 120.7874 60.1910 63.6554 175.2104 97 N 4.3752 8.2613 119.1849 55.5539 38.4706 176.0850 98 T 4.0066 7.7503 105.4161 60.6995 69.8634 174.8086 99 L 3.7763 7.6977 120.4433 55.4624 40.0681 173.9568 100 N 4.4527 7.7622 117.3429 54.7073 39.5067 174.5459 101 N 4.6782 8.6605 119.8628 54.3546 35.6260 175.5907 102 D 4.6615 7.9110 118.0064 52.8161 40.0532 174.4267 103 I 4.7323 7.1616 121.0886 59.3348 42.1188 172.5196 104 M 5.4334 9.2708 127.5933 54.0192 36.2731 173.3755 105 L 5.4472 9.1931 124.6266 53.1920 44.9423 175.4220 106 I 4.9842 9.1747 123.5387 59.4224 40.6739 174.3407 107 K 3.6005 8.5849 128.9729 54.9210 33.3654 175.7406 108 L 4.4708 8.2708 128.0441 54.1011 41.9390 177.0689 109 K 4.1208 8.8608 125.1297 59.1303 32.6090 176.7424 110 S 4.6340 7.7084 111.0767 55.8788 66.2527 172.9727 111 A 4.4307 8.3328 122.5664 51.6743 18.7020 177.5298 112 A 4.2503 8.8573 124.0975 52.0158 19.4869 177.6856 113 S 4.3792 8.9058 117.5866 58.0066 63.2011 174.5277 114 L 4.5088 8.4961 125.5779 54.3479 42.6939 176.1353 115 N 4.5293 8.4592 117.6759 52.6702 40.3953 175.1443 116 S 4.2570 8.8917 111.9878 61.0544 63.0237 175.0117 117 R 4.3587 8.4466 118.1388 55.8711 30.9275 176.1850 118 V 4.4420 7.7702 116.4196 61.0600 33.7298 173.6180 119 A 5.0356 8.4723 128.0849 50.3972 23.2222 175.4614 120 S 4.8550 8.8104 115.7756 58.6185 64.4559 172.9778 121 I 4.5651 8.2791 123.0260 59.0442 39.8573 175.2757 122 S 4.3612 8.3693 123.0906 58.0383 63.5589 173.4378 123 L 4.2541 8.3923 126.2925 53.5776 42.3122 175.2774 124 P 4.4818 0.0000 0.0000 63.0640 32.3349 176.3414 125 T 4.1435 8.2370 108.9355 62.4662 69.8835 174.5206 *127 S 4.9525 7.5542 114.9278 58.0086 64.0606 173.9157 128 C 4.4056 8.3655 117.5860 56.6075 40.6149 173.7441 129 A 4.3531 7.9558 125.0504 51.5886 19.3490 177.8493 130 S 4.1495 8.1428 116.0358 58.0484 63.8956 173.5939 *132 A 4.3346 8.2345 124.7859 53.5277 19.2890 176.9392 133 G 4.0157 9.1391 110.7817 45.4056 0.0000 174.4276 134 T 3.9160 7.6400 117.2019 63.9256 69.4054 173.2500 135 Q 4.7578 8.5809 127.4202 55.5836 30.3687 175.2248 136 C 5.2712 9.1716 122.3358 55.1795 46.5403 172.2913 137 L 5.2866 8.9569 122.7700 53.5088 44.0466 175.1004 138 I 5.1368 9.1094 127.0582 58.7782 40.2616 174.7633 139 S 4.8549 8.3356 119.0569 56.7203 66.4801 173.0124 140 G 3.7723 7.6009 108.1712 46.2140 0.0000 173.1263 141 W 4.9455 8.7743 117.0137 56.2994 29.3990 177.2060 142 G 4.1629 8.2371 109.1479 44.3256 0.0000 173.4736 143 N 3.9531 8.7626 118.5980 54.3005 38.9286 174.8061 144 T 5.0384 8.3669 113.9467 60.6695 69.6148 174.3707 145 K 4.5717 7.7019 121.9788 54.5513 34.1800 176.4037 146 S 4.2507 8.8545 119.8658 61.0723 62.9717 174.5350 147 S 4.6084 7.9665 112.4996 59.7084 65.3458 174.9874 148 G 4.0963 7.6376 113.1160 45.2519 0.0000 172.0939 149 T 4.7140 8.2472 111.2824 59.9702 71.6015 174.3859 150 S 4.4122 9.1279 119.7947 57.5158 65.8168 171.9685 151 Y 4.9768 8.6442 125.7631 55.9328 38.9382 174.2782 152 P 4.6661 0.0000 0.0000 62.4254 32.8377 176.1200 153 D 4.5463 8.8002 119.0127 56.7099 41.1781 176.9772 154 V 5.3825 7.4309 109.5630 58.3832 34.8431 175.4244 155 L 3.3047 8.3195 123.4299 54.7875 42.9727 175.9257 156 K 4.8654 8.0602 124.5980 54.9950 35.1181 174.6139 157 C 5.2392 8.5080 119.1271 55.2147 42.9464 173.0668 158 L 4.9292 8.6319 122.8796 53.8109 45.4565 174.7034 159 K 5.0876 9.0440 125.6582 55.7065 33.4587 176.0378 160 A 4.7824 8.8641 125.5639 49.8327 23.1205 173.6611 161 P 4.9128 0.0000 0.0000 62.0806 33.6986 175.4654 162 I 4.3865 8.5258 123.2868 61.5874 37.9787 175.7829 163 L 4.8032 8.7295 127.4075 53.2889 43.2845 177.0471 164 S 4.3176 8.4910 115.1263 58.2582 63.9283 174.9446 165 D 4.4543 8.9173 122.3234 57.9000 40.5046 179.5297 166 S 4.1636 8.0185 114.0659 61.5682 63.2026 176.5496 167 S 4.1194 8.0145 118.3571 61.2124 62.6376 175.8395 168 C 4.3119 8.3577 121.2247 59.8512 42.0912 175.9373 169 K 3.9764 8.3272 120.0135 59.4859 31.3243 179.6224 170 S 4.1727 8.1727 114.9011 61.3877 62.7712 176.1745 171 A 4.0189 7.9120 122.8820 53.9529 19.7009 177.4259 172 Y 4.8789 7.7913 113.3331 55.4738 38.4364 172.9470 173 P 4.6276 0.0000 0.0000 63.2868 32.3610 177.5724 174 G 3.9984 9.0571 110.0472 46.0460 0.0000 173.6523 175 Q 4.5602 8.2316 116.1433 55.2393 30.1537 175.1331 176 I 4.4753 7.8530 119.8519 59.7563 38.6378 175.5635 177 T 4.5023 8.2279 116.0783 59.8202 70.6855 175.3520 178 S 4.3436 8.5412 114.8658 60.2879 63.0772 174.3082 179 N 4.9995 8.0772 119.1682 53.3597 38.5413 173.8245 180 M 5.5844 7.8586 117.3579 53.6732 36.0629 174.6503 181 F 5.1393 8.8322 115.7629 55.6035 42.2101 172.7542 182 C 5.4417 8.9342 116.2584 56.0428 40.8640 172.6373 183 A 5.0110 9.3341 122.4188 51.0880 22.3841 174.4081 184A G 3.7844 7.4058 106.0849 44.4286 0.0000 174.3957 184 Y 4.5956 8.5106 121.1911 56.1787 41.3195 176.1201 185 L 4.1339 8.6887 125.7859 57.3202 42.0256 178.7722 186 E 4.1116 8.2024 114.9957 57.0296 29.8498 177.6732 187 G 3.9204 7.7064 105.2162 46.0418 0.0000 173.7247 188A G 3.9528 9.8711 107.2878 44.7218 0.0000 173.3870 188 K 4.8759 7.3779 117.7338 55.3402 35.5137 174.9718 189 D 4.7238 8.8285 123.4609 53.4156 45.5354 174.9093 190 S 4.9146 8.1617 114.8829 58.5192 64.8673 171.5763 191 C 4.7146 9.2462 118.7126 55.3626 45.5958 172.1111 192 Q 4.2748 8.6311 121.3428 58.1846 28.6068 177.4384 193 G 4.2344 9.2800 113.5365 45.6452 0.0000 173.8360 194 D 4.6492 8.4824 118.8114 55.7486 41.5641 176.5114 195 S 4.3981 8.0093 114.8848 60.0903 63.5397 175.3115 196 G 4.0138 8.9129 113.3611 46.4213 0.0000 173.7083 197 G 4.5131 7.8669 107.4378 44.6409 0.0000 171.1322 198 P 4.9353 0.0000 0.0000 62.5120 33.2195 175.6479 199 V 4.5881 8.7965 122.7373 61.4204 33.7204 174.1087 200 V 4.8671 8.6909 128.8591 61.2902 34.1053 173.7115 201 C 5.1470 8.9346 124.9398 55.3305 43.7291 174.6089 202 S 3.3074 9.7860 120.4803 59.3952 61.3815 173.1264 203 G 3.9245 8.2794 104.7394 46.2643 0.0000 173.0950 204 K 4.7316 7.6109 118.3141 53.1865 35.0554 175.4098 *209 L 4.3526 8.2532 123.2059 55.4297 41.9183 175.7247 210 Q 4.4476 8.8260 125.8110 56.7909 30.5281 175.8563 211 G 5.2269 8.0512 104.5531 45.6522 0.0000 171.4167 212 I 5.1824 8.2119 119.9801 58.7977 41.0746 175.1678 213 V 3.7340 8.8401 126.9522 64.1634 31.8226 174.4209 214 S 4.7954 8.4088 120.8429 58.5606 64.1059 173.6807 215 W 4.9184 7.5822 114.1754 55.9677 31.9193 172.1413 216 G 4.0153 8.4131 105.9541 46.0632 0.0000 173.3679 217 S 4.6486 8.8186 117.0372 57.3565 63.1996 173.7689 *219 G 4.3704 8.0731 115.6926 45.5849 0.0000 171.2568 220 C 4.9063 8.1102 115.9972 56.4173 41.9497 173.9838 221A A 3.9720 9.3054 126.4629 53.2561 16.3668 177.3814 221 Q 4.4635 7.3697 117.8555 56.4347 29.5689 175.9954 222 K 4.0359 8.4480 121.9121 58.1197 32.5697 176.3259 223 N 4.3081 9.2950 121.9945 53.9974 36.8059 175.3126 224 K 4.2163 7.5370 117.7989 53.5459 32.3910 173.8638 225 P 4.5943 0.0000 0.0000 62.0671 32.9961 177.1968 226 G 3.6227 8.4078 106.2386 46.1254 0.0000 172.8059 227 V 4.4493 7.5314 121.6810 60.7015 34.4443 174.0702 228 Y 4.8325 7.9437 123.3727 56.0374 42.4020 174.8483 229 T 4.3305 8.5234 120.5285 63.6189 70.0140 174.1717 230 K 4.7245 9.3644 128.2596 55.5366 31.7869 177.3642 231 V 3.9602 8.8249 127.2518 65.7784 31.4122 174.9355 232 C 4.6175 8.3647 112.7173 58.1459 41.4337 174.7792 233 N 4.2868 8.0596 117.3276 54.3805 38.5620 174.9575 234 Y 4.7384 8.1594 117.5004 57.4056 39.4881 177.6769 235 V 3.7140 7.9737 121.6685 66.1131 31.5849 178.0488 236 S 4.1546 8.0911 113.6461 60.9825 62.9104 176.0761 237 W 4.1092 8.3096 131.6047 60.2696 30.4478 177.8397 238 I 3.2559 8.3004 119.9778 64.2121 36.5860 178.5110 239 K 3.7587 8.0417 119.2295 59.6880 31.6829 179.5346 240 Q 3.9003 7.9463 117.1283 59.0045 28.7247 178.6569 241 T 3.6831 7.5840 117.0563 66.5403 68.3900 176.9000 242 I 2.6974 7.3225 121.7210 63.8844 36.7322 178.3800 243 A 4.0691 7.8205 120.7828 53.9970 18.1807 178.7112 244 S 4.6486 7.3007 110.9320 58.2633 63.5063 174.0683 245 N 4.6644 7.9923 125.1412 53.9385 39.4496 174.0415 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 16 I 7.88 4.29 1.80 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 1.39 0.83 0.87 0.00 0.00 17 V 8.71 4.40 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 0.97 0.00 0.00 0.93 0.00 0.00 18 G 8.53 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 19 G 7.75 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 0.00 0.00 0.00 0.00 20 Y 7.89 4.95 0.00 2.92 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 21 T 8.62 4.17 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 22 C 8.76 4.19 0.00 2.73 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 23 G 7.79 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 0.00 0.00 0.00 24 A 8.40 4.39 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 25 N 8.91 4.30 0.00 2.90 2.94 0.00 0.00 7.15 7.54 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 26 T 7.65 4.21 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 1.23 0.00 0.00 27 V 7.07 4.11 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 0.31 0.00 0.00 0.76 0.00 0.00 28 P 0.00 4.48 0.00 2.37 2.28 0.00 3.71 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.00 0.00 29 Y 7.13 4.98 0.00 3.27 3.40 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 30 Q 7.48 4.56 0.00 1.76 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.67 0.00 0.00 0.00 0.00 0.00 1.92 2.46 0.00 31 V 8.89 4.74 2.21 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 0.89 0.00 0.00 1.00 0.00 0.00 32 S 8.70 4.99 0.00 3.06 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 33 L 8.33 4.58 0.00 0.37 0.74 0.77 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.88 5.58 0.00 2.37 2.43 0.00 0.00 6.78 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *37 S 8.35 4.22 0.00 3.84 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 38 G 9.98 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Y 6.52 4.47 0.00 3.02 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 H 8.89 4.44 0.00 2.83 3.15 0.00 5.86 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.73 5.05 0.00 3.02 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 42 C 6.88 4.74 0.00 2.32 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 43 G 8.77 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 0.00 0.00 0.00 0.00 44 G 8.07 4.59 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 45 S 8.70 5.49 0.00 3.84 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 46 L 9.20 4.67 0.00 1.87 1.69 1.05 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.51 4.46 1.90 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 1.55 0.90 0.96 0.00 0.00 48 N 7.76 5.21 0.00 3.00 3.02 0.00 0.00 6.50 7.64 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 49 S 8.71 4.45 0.00 4.21 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 50 Q 9.10 4.55 0.00 2.11 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.80 0.00 0.00 0.00 0.00 0.00 1.99 2.21 0.00 51 W 8.35 5.54 0.00 3.43 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 52 V 9.16 5.11 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 1.02 0.00 0.00 0.98 0.00 0.00 53 V 8.67 4.95 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 0.77 0.00 0.00 1.01 0.00 0.00 54 S 9.03 5.14 0.00 3.88 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 55 A 8.50 4.86 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.34 3.82 0.40 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 57 H 8.13 4.49 0.00 3.36 3.55 0.00 5.56 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.86 4.66 0.00 3.21 3.33 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 59 Y 7.76 4.19 0.00 3.00 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 60 K 6.94 3.98 0.00 1.19 1.15 0.00 1.11 0.00 0.00 1.35 0.00 0.00 2.44 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.98 1.07 7.81 61 S 7.97 4.25 0.00 3.96 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 62 G 8.49 3.64 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 0.00 63 I 7.60 4.24 1.87 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 1.44 0.87 0.91 0.00 0.00 64 Q 8.83 4.87 0.00 2.01 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.09 2.22 0.00 65 V 8.78 4.43 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 0.98 0.00 0.00 0.89 0.00 0.00 66 R 8.91 5.05 0.00 1.59 1.67 0.00 2.62 0.00 0.00 2.49 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 1.15 0.00 67 L 9.11 4.80 0.00 1.67 1.67 0.97 0.68 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 *69 G 8.26 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 0.00 0.00 0.00 70 E 8.29 4.35 0.00 2.15 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 0.00 2.33 2.01 0.00 71 D 7.96 4.87 0.00 2.79 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.67 4.89 0.00 2.85 2.87 0.00 0.00 7.18 7.94 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 73 I 8.53 3.83 1.44 0.00 0.00 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 1.09 0.55 -0.43 0.00 0.00 74 N 8.73 4.74 0.00 2.80 2.89 0.00 0.00 6.65 7.48 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 75 V 7.28 4.37 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 0.78 0.00 0.00 0.99 0.00 0.00 76 V 8.38 4.05 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 0.85 0.00 0.00 0.97 0.00 0.00 77 E 9.87 4.51 0.00 1.95 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 2.25 2.41 0.00 78 G 7.99 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 0.00 0.00 0.00 79 N 8.85 4.53 0.00 2.97 3.04 0.00 0.00 7.01 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.71 4.50 0.00 1.54 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 2.53 2.47 0.00 81 Q 8.93 4.47 0.00 2.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 82 F 8.81 5.58 0.00 2.77 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 83 I 8.83 4.71 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.71 0.89 0.00 0.00 84 S 8.72 4.71 0.00 3.75 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 85 A 8.46 4.47 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 S 8.89 4.54 0.00 3.80 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 87 K 7.61 4.75 0.00 1.83 1.89 0.00 1.43 0.00 0.00 1.84 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.25 1.48 7.81 88 S 8.76 5.14 0.00 4.08 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 89 I 9.29 4.47 2.05 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.99 1.06 0.00 0.00 90 V 8.26 4.05 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 0.67 0.00 0.00 0.73 0.00 0.00 91 H 8.77 3.88 0.00 2.82 3.07 0.00 5.65 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.34 0.00 2.09 2.14 0.00 3.29 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 2.16 2.23 0.00 93 S 8.01 4.66 0.00 3.91 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 94 Y 7.80 4.28 0.00 2.86 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 95 N 8.36 4.48 0.00 2.60 2.47 0.00 0.00 6.55 7.77 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 96 S 7.86 3.87 0.00 3.94 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 97 N 8.26 4.38 0.00 2.75 2.79 0.00 0.00 6.89 7.08 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 98 T 7.75 4.01 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 99 L 7.70 3.78 0.00 1.57 1.85 0.76 0.89 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 0.00 100 N 7.76 4.45 0.00 2.83 2.65 0.00 0.00 7.26 6.03 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 0.00 101 N 8.66 4.68 0.00 3.02 2.61 0.00 0.00 7.21 8.06 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 0.00 102 D 7.91 4.66 0.00 3.06 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.16 4.73 1.44 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 1.29 1.05 0.09 0.00 0.00 104 M 9.27 5.43 0.00 2.20 1.81 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.63 0.00 105 L 9.19 5.45 0.00 1.83 1.88 1.03 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 0.00 106 I 9.17 4.98 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.93 0.89 0.00 0.00 107 K 8.58 3.60 0.00 0.79 1.16 0.00 1.46 0.00 0.00 1.38 0.00 0.00 2.60 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.73 0.21 7.81 108 L 8.27 4.47 0.00 1.47 1.56 0.96 0.83 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 0.00 109 K 8.86 4.12 0.00 1.83 1.81 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.36 7.81 110 S 7.71 4.63 0.00 3.92 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 0.00 111 A 8.33 4.43 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.86 4.25 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 0.00 113 S 8.91 4.38 0.00 3.77 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 0.00 114 L 8.50 4.51 0.00 1.66 1.62 0.96 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.46 4.53 0.00 2.89 2.91 0.00 0.00 6.77 7.24 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 0.00 116 S 8.89 4.26 0.00 4.01 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 0.00 117 R 8.45 4.36 0.00 1.91 2.01 0.00 3.25 0.00 0.00 3.16 7.30 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.55 4.95 0.00 4.00 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 0.00 128 C 8.37 4.41 0.00 2.94 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 0.00 129 A 7.96 4.35 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.14 4.15 0.00 3.85 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 *132 A 8.23 4.33 1.24 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 0.00 0.00 0.00 133 G 9.14 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 0.00 0.00 0.00 134 T 7.64 3.92 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 135 Q 8.58 4.76 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 136 C 9.17 5.27 0.00 2.90 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 0.00 137 L 8.96 5.29 0.00 1.76 1.56 0.98 1.03 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 0.00 138 I 9.11 5.14 1.87 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 0.74 1.32 0.96 0.00 0.00 139 S 8.34 4.85 0.00 3.51 3.58 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 0.00 140 G 7.60 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 0.00 141 W 8.77 4.95 0.00 3.04 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 0.00 142 G 8.24 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.76 3.95 0.00 2.34 2.65 0.00 0.00 7.14 7.32 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 0.00 144 T 8.37 5.04 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 1.25 0.00 0.00 145 K 7.70 4.57 0.00 1.91 1.71 0.00 1.78 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.31 1.36 7.81 146 S 8.85 4.25 0.00 3.85 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 0.00 147 S 7.97 4.61 0.00 3.82 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 0.00 148 G 7.64 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 0.00 149 T 8.25 4.71 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 1.22 0.00 0.00 150 S 9.13 4.41 0.00 3.81 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 0.00 151 Y 8.64 4.98 0.00 2.97 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 0.00 152 P 0.00 4.67 0.00 2.45 2.10 0.00 4.18 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.05 0.00 153 D 8.80 4.55 0.00 2.81 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 V 7.43 5.38 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 1.07 0.00 0.00 0.96 0.00 0.00 155 L 8.32 3.30 0.00 1.31 1.24 -0.79 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.06 4.87 0.00 1.56 1.51 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.48 7.81 157 C 8.51 5.24 0.00 1.59 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 0.00 158 L 8.63 4.93 0.00 1.69 1.46 1.03 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.04 5.09 0.00 1.83 1.82 0.00 1.90 0.00 0.00 1.77 0.00 0.00 2.79 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.63 7.81 160 A 8.86 4.78 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 0.00 161 P 0.00 4.91 0.00 2.03 2.24 0.00 3.02 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 1.88 1.74 0.00 162 I 8.53 4.39 1.90 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.51 0.82 0.00 0.00 163 L 8.73 4.80 0.00 1.56 1.60 0.93 1.11 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 0.00 164 S 8.49 4.32 0.00 4.00 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 0.00 165 D 8.92 4.45 0.00 2.80 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 0.00 166 S 8.02 4.16 0.00 4.06 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 S 8.01 4.12 0.00 4.04 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 0.00 168 C 8.36 4.31 0.00 3.21 3.32 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 0.00 169 K 8.33 3.98 0.00 1.97 1.90 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.53 1.55 7.81 170 S 8.17 4.17 0.00 3.96 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 0.00 171 A 7.91 4.02 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 0.00 0.00 0.00 0.00 0.00 172 Y 7.79 4.88 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 0.00 173 P 0.00 4.63 0.00 2.08 2.03 0.00 3.89 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 2.05 2.21 0.00 174 G 9.06 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 0.00 175 Q 8.23 4.56 0.00 2.32 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.80 6.58 0.00 0.00 0.00 0.00 0.00 2.26 2.54 0.00 176 I 7.85 4.48 1.97 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.98 0.99 0.00 0.00 177 T 8.23 4.50 4.28 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 0.00 0.00 0.00 1.24 0.00 0.00 178 S 8.54 4.34 0.00 4.01 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 0.00 179 N 8.08 5.00 0.00 3.00 3.10 0.00 0.00 6.64 7.51 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 0.00 180 M 7.86 5.58 0.00 1.80 2.13 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.57 0.00 181 F 8.83 5.14 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 0.00 182 C 8.93 5.44 0.00 2.99 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 0.00 183 A 9.33 5.01 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 184A G 7.41 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 0.00 184 Y 8.51 4.60 0.00 2.99 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 0.00 185 L 8.69 4.13 0.00 1.74 1.73 0.92 0.86 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 0.00 186 E 8.20 4.11 0.00 2.10 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 2.31 2.26 0.00 187 G 7.71 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 188A G 9.87 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 K 7.38 4.88 0.00 1.37 1.63 0.00 1.44 0.00 0.00 0.62 0.00 0.00 2.26 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.20 1.23 7.81 189 D 8.83 4.72 0.00 2.84 2.50 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 0.00 190 S 8.16 4.91 0.00 4.07 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 0.00 191 C 9.25 4.71 0.00 2.96 3.12 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 0.00 192 Q 8.63 4.27 0.00 2.22 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.16 0.00 0.00 0.00 0.00 0.00 2.70 2.55 0.00 193 G 9.28 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.48 4.65 0.00 2.97 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 0.00 195 S 8.01 4.40 0.00 4.00 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 0.00 196 G 8.91 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 0.00 197 G 7.87 4.51 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 0.00 198 P 0.00 4.94 0.00 2.37 2.41 0.00 3.85 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 2.19 2.17 0.00 199 V 8.80 4.59 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 0.83 0.00 0.00 0.55 0.00 0.00 200 V 8.69 4.87 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 0.85 0.00 0.00 0.67 0.00 0.00 201 C 8.93 5.15 0.00 2.79 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 0.00 202 S 9.79 3.31 0.00 4.04 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 0.00 203 G 8.28 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 0.00 204 K 7.61 4.73 0.00 1.72 1.65 0.00 1.90 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.40 7.81 *209 L 8.25 4.35 0.00 1.52 1.65 1.02 0.78 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 0.00 210 Q 8.83 4.45 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.42 0.00 0.00 0.00 0.00 0.00 2.44 2.35 0.00 211 G 8.05 5.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.21 5.18 1.92 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 1.29 0.75 1.00 0.00 0.00 213 V 8.84 3.73 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 1.03 0.00 0.00 1.22 0.00 0.00 214 S 8.41 4.80 0.00 3.91 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 0.00 215 W 7.58 4.92 0.00 3.33 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 0.00 216 G 8.41 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 0.00 0.00 0.00 217 S 8.82 4.65 0.00 4.10 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 *219 G 8.07 4.37 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 0.00 220 C 8.11 4.91 0.00 2.95 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 221A A 9.31 3.97 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 0.00 221 Q 7.37 4.46 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.92 0.00 0.00 0.00 0.00 0.00 2.49 2.47 0.00 222 K 8.45 4.04 0.00 1.70 1.72 0.00 1.97 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.53 7.81 223 N 9.30 4.31 0.00 2.81 2.83 0.00 0.00 6.80 7.52 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 0.00 224 K 7.54 4.22 0.00 1.65 1.77 0.00 1.67 0.00 0.00 1.31 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.50 7.81 225 P 0.00 4.59 0.00 2.13 2.10 0.00 3.58 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.00 0.00 226 G 8.41 3.62 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 0.00 0.00 0.00 227 V 7.53 4.45 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 0.48 0.00 0.00 -0.62 0.00 0.00 228 Y 7.94 4.83 0.00 1.43 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 0.00 0.00 0.00 0.00 229 T 8.52 4.33 4.28 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 0.00 0.00 0.00 1.18 0.00 0.00 230 K 9.36 4.72 0.00 2.13 1.93 0.00 1.79 0.00 0.00 1.77 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.62 7.81 231 V 8.82 3.96 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.12 0.00 0.00 232 C 8.36 4.62 0.00 3.16 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 N 8.06 4.29 0.00 2.46 2.40 0.00 0.00 6.77 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 0.00 234 Y 8.16 4.74 0.00 3.18 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 V 7.97 3.71 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 1.11 0.00 0.00 1.03 0.00 0.00 236 S 8.09 4.15 0.00 4.12 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 W 8.31 4.11 0.00 3.48 3.60 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 0.00 238 I 8.30 3.26 2.05 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.07 0.78 0.00 0.00 239 K 8.04 3.76 0.00 1.83 1.78 0.00 1.64 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.42 7.81 240 Q 7.95 3.90 0.00 1.90 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 241 T 7.58 3.68 3.49 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 0.72 0.00 0.00 242 I 7.32 2.70 1.40 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.05 0.42 0.00 0.00 243 A 7.82 4.07 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 0.00 244 S 7.30 4.65 0.00 3.95 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 0.00 245 N 7.99 4.66 0.00 3.04 3.02 0.00 0.00 6.74 8.16 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 * Residues marked with a * may have inaccurate shift predictions.