NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2681 7.8827 121.4581 61.1433 38.9387 173.8073 17 V 4.4578 8.2931 124.0621 61.5293 33.9294 173.6841 18 G 3.8382 9.0766 115.6360 46.4061 0.0000 172.7272 19 G 3.9780 8.3573 113.5809 45.1516 0.0000 172.3429 20 Q 4.5362 8.0073 117.1117 54.4659 31.0700 173.7438 21 E 4.6562 8.2900 118.9379 54.9391 31.5200 177.0663 22 C 4.3224 8.6188 124.4515 57.3795 38.8984 173.7220 23 K 4.3643 9.3121 124.3217 55.3040 33.7739 175.8867 24 D 4.3003 8.3003 122.4216 56.4337 40.2192 177.1992 25 G 3.8652 8.7071 115.7928 45.2647 0.0000 173.1494 26 E 3.8471 8.7246 120.4100 58.8610 30.3307 176.9957 27 C 3.9601 7.2593 115.3940 54.5160 40.5912 172.6759 28 P 4.0218 0.0000 0.0000 63.3165 32.1636 178.3173 29 W 5.0126 5.9884 115.0215 55.6988 29.1855 175.7695 30 Q 4.6337 7.1914 120.2325 56.7198 30.0034 174.6838 31 A 4.9896 8.4278 123.9537 50.4284 23.1534 174.6317 32 L 5.1043 9.1374 122.0114 53.2647 45.7940 175.2501 33 L 5.2779 8.6283 126.9059 53.6775 42.9980 175.6746 34 I 5.1411 9.0424 118.6886 59.3023 40.5473 175.3195 35 N 5.3412 9.0702 122.1476 51.7008 39.7627 175.4088 36 E 4.3219 9.1553 117.7973 60.1266 29.3094 179.0979 37 E 4.0434 8.1787 114.2164 57.0617 29.4713 176.3157 38 N 4.3294 9.0897 117.5371 54.7936 37.9137 173.2328 39 E 4.7027 8.2639 115.3698 53.7851 31.6818 176.1676 40 G 3.9907 8.4789 112.4535 45.7524 0.0000 173.2829 41 F 5.0617 8.0432 115.3075 55.9916 40.1420 173.3645 42 C 4.9541 7.4741 115.3373 57.1082 44.3090 173.6016 43 G 4.3979 8.8238 109.5105 46.2990 0.0000 172.3064 44 G 4.2714 7.9936 105.4636 46.2480 0.0000 173.6200 45 T 4.9941 8.7177 115.9750 61.6412 72.5770 174.1618 46 I 3.8978 8.8620 128.8224 61.9769 37.5680 176.8415 47 L 4.3732 9.1910 127.5716 55.9490 42.9715 176.1615 48 S 4.9094 7.6694 110.6622 56.8760 66.1155 173.7616 49 E 3.9454 9.1229 116.6101 58.8605 29.5795 178.1332 50 F 4.6334 7.8307 114.1249 57.2855 40.5496 174.5349 51 Y 5.4302 7.9856 118.7505 56.1245 41.2026 174.6611 52 I 4.9781 8.6499 124.1264 59.4902 40.4758 174.1543 53 L 5.0793 9.0783 128.8364 53.8775 44.0191 175.1277 54 T 5.2547 8.8185 119.4873 60.3179 72.0784 172.5327 55 A 4.0842 8.4636 127.0590 51.7610 18.9293 178.8036 56 A 3.8502 8.1534 125.1514 54.5176 18.5247 178.6682 57 H 4.0596 7.8791 112.1922 58.2841 28.9110 177.0379 58 C 4.1390 7.1927 116.8908 59.5977 40.3297 174.3639 59 L 3.9430 6.8245 119.3385 54.2632 40.7078 177.1209 60 Y 4.9584 7.3814 112.3610 58.6519 43.2734 175.5575 61 Q 4.3038 7.5554 118.3701 55.3619 29.0143 175.4064 61A A 4.0842 7.1754 115.7757 51.3247 21.7030 177.5950 62 K 4.1491 8.9195 124.8611 59.0970 32.7083 177.1924 63 R 4.7197 7.5839 116.6972 55.0419 32.7991 173.1174 64 F 5.4579 8.4573 118.7902 55.6278 41.8621 173.2490 65 K 4.6592 9.2822 116.9093 54.6667 37.0694 176.0646 66 V 4.7543 8.4963 122.5846 60.3424 33.4022 174.5013 67 R 5.0413 9.6816 127.9158 54.8176 31.6617 175.4948 68 V 4.6060 8.4545 118.9981 59.4779 35.6491 175.1905 69 G 4.2676 8.6444 106.0701 45.7736 0.0000 172.4037 70 D 5.0714 8.2599 118.2807 52.1759 43.4227 175.2847 71 R 4.6695 9.7553 125.0680 56.5708 33.3733 175.1716 72 N 5.4526 8.4732 116.9923 51.9322 41.9787 173.6705 73 T 4.2985 9.1684 119.1370 62.9672 67.8450 174.6252 74 E 5.6935 7.9434 135.0000 57.3832 27.0152 178.6023 75 Q 4.3724 6.8990 118.0104 61.0069 28.9294 178.8240 76 E 3.7133 7.2706 114.3612 57.2909 26.8367 175.1099 77 E 4.0366 9.6264 125.8748 57.2121 29.9285 177.0719 78 G 4.2692 8.9848 109.2683 45.6472 0.0000 175.4068 79 G 3.9528 7.7860 105.4949 45.7544 0.0000 174.4099 80 E 4.5768 7.7651 117.6386 56.8127 30.0981 175.0912 81 A 5.0019 7.5805 130.4800 52.7294 20.6136 175.7366 82 V 4.8342 7.9632 123.1788 61.3503 34.0264 174.4315 83 H 4.9673 8.9952 123.9408 53.9987 32.7596 172.3889 84 E 4.6658 8.5431 121.4776 54.9498 31.1673 175.9287 85 V 3.7996 8.0797 124.4683 63.6246 31.7902 175.1995 86 E 4.2234 10.3727 129.8781 58.6297 29.9261 176.7197 87 V 4.6333 7.5314 111.2628 59.7496 36.5548 173.8164 88 V 4.7528 8.4543 116.3703 59.7184 34.1399 175.3487 89 I 4.3726 8.5075 126.2399 59.6903 38.5999 174.6094 90 K 4.7356 8.5515 128.4236 54.9811 34.2107 175.5430 91 H 4.5417 8.4168 124.7763 55.8331 30.3080 175.4967 92 N 4.3580 9.2027 125.1021 56.8198 38.4376 176.3381 93 R 4.3028 7.6703 114.4304 56.3530 30.5267 176.6071 94 F 4.9528 8.0786 118.5734 57.7545 40.3481 175.3454 95 T 4.1475 6.8242 114.5342 59.5532 69.3806 174.2356 96 K 3.7050 8.0442 127.6639 59.6212 32.2530 178.1108 97 E 4.0459 7.8760 116.6594 58.4380 29.7935 178.2886 98 T 4.2773 8.0818 106.1660 61.3280 71.3473 172.9308 99 Y 3.8307 7.9979 117.8480 59.1948 35.7275 169.3644 100 D 4.7120 7.7642 118.7335 54.3676 42.2139 176.3050 101 F 3.9515 8.7451 124.0667 58.7714 35.8737 175.8945 102 D 4.7634 8.0290 121.1781 53.2515 39.0123 173.5185 103 I 4.6181 7.1954 119.8860 59.4580 41.9813 172.4959 104 A 5.1189 9.5005 129.8325 50.8836 23.8210 175.0559 105 V 4.9455 9.0581 118.4092 61.5384 34.9054 174.4702 106 L 4.7763 9.0145 128.3082 54.1155 43.5102 175.7000 107 R 4.7483 8.5989 122.6552 54.4953 32.2312 175.1007 108 L 4.4185 8.6880 127.1832 54.4116 42.1189 177.2756 109 K 4.5223 8.5601 123.4228 58.5729 32.8809 177.4033 110 T 4.6614 7.6901 108.5371 58.4957 71.3159 171.6104 111 P 3.4403 0.0000 0.0000 63.0514 32.0282 175.6387 112 I 3.9845 7.9176 124.3608 61.0130 38.1528 175.5903 113 T 4.1434 8.2720 123.6976 61.8055 69.3256 174.8112 114 F 4.8014 8.2444 126.7515 57.5801 39.7696 175.0645 115 R 4.5396 8.9596 120.8946 55.2167 32.0901 173.5375 116 M 4.0990 8.6946 116.7352 57.6857 32.4838 175.3966 117 N 3.9638 8.6461 118.7894 53.5006 36.6979 174.6684 118 V 4.4248 7.6460 114.9124 62.8573 33.2442 170.9718 119 A 4.2729 8.3853 128.0768 49.8258 22.9401 173.2197 120 P 4.8107 0.0000 0.0000 62.2003 32.6345 175.6087 121 A 4.2324 8.3673 124.3280 51.2335 19.9436 177.2201 122 C 4.3928 7.9008 117.0294 59.6270 29.7904 172.8276 123 L 5.0299 8.4783 121.0674 52.5075 43.2162 175.3365 124 P 4.6349 0.0000 0.0000 61.8584 33.5783 174.5448 124A E 4.5878 8.5292 117.9274 55.8568 31.3860 175.6216 125 R 3.5114 8.5939 124.1981 59.9219 30.4244 177.3100 126 D 4.3041 9.3781 118.2021 57.3100 41.2674 178.9438 127 W 4.0338 9.1588 128.5578 60.5640 30.6889 177.7565 128 A 3.2411 8.5474 120.8217 55.0592 17.5225 179.4934 129 E 3.6586 7.7338 116.1232 58.9674 29.5188 179.1407 130 S 4.0616 7.3378 112.2793 60.9365 62.6884 175.3794 131 T 3.9424 7.1640 116.3429 64.3933 69.3164 175.9502 131A L 3.8221 6.7962 119.6683 56.3798 42.3839 177.5785 131B M 3.9414 7.5272 116.3007 55.1475 32.8834 177.2641 132 T 3.8521 7.2715 106.5136 61.6817 69.3320 174.1011 133 Q 4.1789 7.0393 122.9627 56.3836 29.7445 175.9932 134 K 4.2944 8.5689 118.1697 58.4768 32.5635 176.5732 135 T 4.8794 7.4678 106.5285 60.6672 72.1927 172.9894 136 G 3.9633 8.5013 106.7953 45.0740 0.0000 172.0330 137 I 5.0514 9.4470 122.7686 59.7345 39.5859 175.4751 138 V 5.3183 8.7851 124.7548 59.5906 34.7339 174.2429 139 S 4.9576 9.0228 117.7580 56.4864 66.9063 172.8468 140 G 4.2801 7.4749 105.2096 47.2946 0.0000 173.5471 141 F 4.8801 8.6084 118.0606 57.0165 39.4758 176.1330 142 G 3.9219 8.1181 110.0945 44.6643 0.0000 173.7859 143 R 4.9230 8.2032 117.5831 56.5039 30.4065 177.4576 144 T 5.0837 8.3923 109.7478 62.3050 69.8769 174.1547 145 H 4.7218 7.6144 121.2740 54.5973 33.1095 172.9829 *147 E 4.2853 8.6703 124.7024 55.6763 31.0581 176.2513 148 K 4.6725 7.9845 116.3305 55.9610 33.5570 176.1847 149 G 4.2798 8.1071 109.3667 45.3640 0.0000 173.8845 150 R 4.5854 8.3557 117.2021 53.8805 32.0810 178.0663 151 Q 4.8990 8.5783 124.3803 55.0161 30.7840 177.8780 152 S 4.6239 8.5469 108.3435 57.3264 65.1521 174.5724 153 T 4.7965 8.4800 117.3869 63.1016 70.2719 174.4438 154 R 5.0965 7.9340 120.4317 54.3072 32.0320 176.2012 155 L 3.4506 9.2095 126.6527 54.7775 43.1133 175.9012 156 K 5.0615 8.8009 125.5026 54.7088 36.4120 174.9163 157 M 5.1096 8.4540 118.7832 53.6840 34.5468 173.7349 158 L 4.8847 9.5057 125.6240 53.1827 45.5090 175.0389 159 E 4.7845 8.8586 126.7246 55.2322 29.6092 174.5676 160 V 4.0376 8.5283 121.0392 58.9036 33.1716 174.2380 161 P 4.6904 0.0000 0.0000 62.4940 33.0868 175.4226 162 Y 4.6557 8.2968 119.0873 58.3355 38.9807 175.0370 163 V 4.4618 8.2808 122.6897 60.6362 33.8312 174.9700 164 D 4.3458 8.5248 126.0791 54.6229 41.7804 177.4113 165 R 3.9305 8.4792 124.9480 59.2897 30.1345 178.5149 166 N 4.3897 8.1809 116.0195 56.0702 38.8154 177.4211 167 S 4.2612 8.7940 117.0676 61.8127 62.9702 175.1890 168 C 3.9415 8.0952 120.9766 60.0458 42.9942 175.7054 169 K 3.9186 8.2510 120.0703 59.7637 31.9349 179.1676 170 L 4.1841 8.3275 118.5026 57.7033 41.5867 179.4106 171 S 4.3436 8.4938 114.0780 60.7164 63.3116 174.4480 172 S 4.6298 7.7114 115.5629 58.4931 62.6770 173.3746 173 S 4.4966 8.6584 114.0340 57.6933 64.2010 174.1556 174 F 4.8430 8.5166 118.4523 55.2566 42.8929 174.5361 175 I 3.8750 8.4308 123.4173 61.9492 37.3425 176.8156 176 I 4.4796 8.0322 125.8589 59.3094 36.4619 175.4295 177 T 4.1484 8.0876 115.3023 60.9217 69.5019 174.9523 178 Q 4.0134 8.5754 120.2386 58.9687 29.1978 177.9921 179 N 4.7005 7.0475 116.2125 51.3306 37.5440 173.6824 180 M 4.9779 7.2536 115.5036 55.1561 36.8162 175.9354 181 F 4.8741 8.1389 113.2192 56.4211 41.4442 172.9846 182 C 5.0758 8.9939 118.3043 56.9408 36.2044 172.7112 183 A 4.5645 8.3726 119.1242 51.5495 22.5155 174.1813 184 G 3.8900 7.7165 107.8431 44.4041 0.0000 174.3524 185 Y 5.1229 8.1186 122.1266 56.3127 42.2147 174.7360 185A D 4.0653 9.0934 122.1121 57.0410 41.8152 178.1220 185B T 4.1846 7.7359 106.3695 62.4895 70.3745 175.1444 186 K 3.7292 7.9268 122.4829 56.5366 32.7982 177.6131 187 Q 4.4432 8.3532 126.5617 55.3516 26.5379 175.3657 188 E 5.2749 7.3508 116.2447 54.6498 34.1485 175.5453 189 D 4.5535 8.4834 122.9393 53.6618 44.6946 175.3297 190 A 4.4647 8.6433 124.8553 52.8586 19.9443 176.1038 191 C 4.6511 8.5978 115.1439 56.3224 40.9496 172.3768 192 Q 4.2557 8.6151 119.0622 58.2089 28.8778 178.5538 193 G 4.1441 9.0572 112.0840 45.8082 0.0000 173.4072 194 D 4.7711 7.9112 118.5593 54.1828 42.1452 176.8210 195 S 4.4919 7.8969 116.2494 60.2285 63.2887 175.2148 196 G 4.2687 8.6712 112.6622 46.4581 0.0000 174.2829 197 G 4.1306 7.9684 107.4375 45.9494 0.0000 171.4027 198 P 4.9935 0.0000 0.0000 62.1755 33.5469 174.9400 199 H 4.9034 9.0603 121.0825 54.7999 31.3815 172.3256 200 V 4.9371 8.9060 119.1441 59.7283 34.8937 174.9305 201 T 4.6096 8.5516 119.2422 61.8233 71.3935 173.2465 202 R 4.1673 8.3700 126.1790 55.0940 31.9141 176.1620 203 F 4.5459 9.2746 128.6150 57.9397 40.9446 173.7700 204 K 3.5523 8.5410 129.9000 57.7444 28.2808 175.9931 205 D 4.5772 8.0755 111.4938 55.3096 39.2440 174.0739 206 T 4.8242 7.4721 113.8601 62.0562 72.0754 172.4175 207 Y 5.0661 8.6259 122.9584 56.2465 40.8038 174.5269 208 F 4.8566 8.9133 122.1045 55.5584 42.4660 175.5514 209 V 4.3861 9.0630 123.8217 62.5926 30.1308 175.5753 210 T 4.6726 9.6364 120.4098 58.8296 69.5762 174.3229 211 G 4.9003 7.6634 111.8124 46.5788 0.0000 172.1203 212 I 4.9241 7.8173 123.7469 58.8331 39.9936 175.0653 213 V 3.6924 8.7816 127.4825 64.3006 31.7603 174.3260 214 S 5.2041 8.9879 121.7031 57.7852 63.9811 174.4236 215 W 5.2576 8.6513 114.5216 56.0633 32.2377 172.6450 216 G 4.0986 8.6655 104.4167 46.1094 0.0000 174.1382 217 E 4.5595 9.1260 122.0792 54.4547 28.6229 177.4573 218 G 3.6096 8.0119 110.2662 44.0820 0.0000 170.4709 218 C 4.1996 8.0019 120.0662 57.1820 25.5486 170.1709 221 A 3.7283 8.3540 127.6426 53.1028 16.5550 177.3746 222 R 4.1964 7.7294 117.9987 56.7921 31.0682 176.7804 223 K 4.8003 7.9831 120.9767 57.5257 32.4935 177.1189 223A G 3.8322 9.2509 110.1487 45.7506 0.0000 173.4562 224 K 4.4985 7.4806 117.4554 54.4215 35.0733 174.8612 225 Y 4.8061 8.2826 118.7252 56.2051 41.6819 174.3513 226 G 3.8434 8.4979 106.6961 44.9028 0.0000 172.8908 227 I 4.1050 8.0482 127.4629 60.2057 38.4860 175.1079 228 Y 4.7795 8.1291 124.9678 56.2966 41.2816 174.8480 229 T 4.5418 8.7859 117.8037 62.8958 70.3461 175.2308 230 K 5.1407 8.8879 127.4792 54.8929 31.1814 176.7624 231 V 3.8702 8.7204 124.2247 66.2328 31.3212 177.0168 232 T 3.5477 8.1669 106.9935 65.0426 68.2811 175.3890 233 A 4.0033 8.2369 122.2471 53.5867 18.7431 178.3139 234 F 4.8800 8.5959 115.6357 58.6229 40.2266 177.7887 235 L 3.6632 7.7603 116.1899 56.9940 41.6546 178.6287 236 K 3.8911 8.3379 118.3615 59.7620 32.3571 179.0566 237 W 4.1360 8.9852 128.6107 60.6338 30.7606 177.9485 238 I 3.7299 8.3279 119.3204 64.6207 36.3329 177.7692 239 D 4.2782 8.0565 118.3247 57.4612 40.9046 178.7286 240 R 3.9099 8.0592 117.0262 58.2832 30.2907 177.4081 241 S 4.2086 7.3794 113.3986 60.1724 63.4753 174.7458 242 M 3.1605 7.2410 120.0609 54.8064 32.1560 176.7502 243 K 4.3990 7.0290 114.9678 55.0001 34.4610 172.3752 244 T 3.3984 8.4156 125.2820 63.0834 69.1251 171.9989 245 R 4.0583 8.2126 124.9015 56.9846 29.9173 173.9895 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 4.27 1.88 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 1.38 0.93 0.94 0.00 0.00 17 V 8.29 4.46 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 1.05 0.00 0.00 0.97 0.00 0.00 18 G 9.08 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 19 G 8.36 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 20 Q 8.01 4.54 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.20 6.73 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 21 E 8.29 4.66 0.00 1.95 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 2.17 2.29 0.00 22 C 8.62 4.32 0.00 2.89 2.89 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 0.00 0.00 0.00 23 K 9.31 4.36 0.00 1.73 1.67 0.00 1.69 0.00 0.00 1.54 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.64 1.50 7.81 24 D 8.30 4.30 0.00 2.58 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 25 G 8.71 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 26 E 8.72 3.85 0.00 1.75 1.86 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 2.25 2.32 0.00 27 C 7.26 3.96 0.00 2.62 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 28 P 0.00 4.02 0.00 2.02 1.95 0.00 2.20 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.41 0.00 29 W 5.99 5.01 0.00 3.52 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.19 4.63 0.00 2.16 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.74 0.00 0.00 0.00 0.00 0.00 2.28 2.42 0.00 31 A 8.43 4.99 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 32 L 9.14 5.10 0.00 1.89 1.63 1.11 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.63 5.28 0.00 0.74 1.27 0.71 0.61 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 34 I 9.04 5.14 1.94 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 1.59 1.01 0.87 0.00 0.00 35 N 9.07 5.34 0.00 2.87 2.99 0.00 0.00 7.04 7.26 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 36 E 9.16 4.32 0.00 1.99 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 2.36 2.34 0.00 37 E 8.18 4.04 0.00 2.33 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 38 N 9.09 4.33 0.00 2.72 2.92 0.00 0.00 7.01 7.53 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 39 E 8.26 4.70 0.00 2.18 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 2.26 2.36 0.00 40 G 8.48 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.04 5.06 0.00 2.94 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 C 7.47 4.95 0.00 2.35 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 43 G 8.82 4.40 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 0.00 44 G 7.99 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 45 T 8.72 4.99 4.34 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 1.29 0.00 0.00 46 I 8.86 3.90 1.96 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 1.31 0.78 1.10 0.00 0.00 47 L 9.19 4.37 0.00 1.86 1.80 1.02 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 48 S 7.67 4.91 0.00 4.17 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 49 E 9.12 3.95 0.00 1.80 1.73 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 2.42 2.13 0.00 50 F 7.83 4.63 0.00 3.03 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 51 Y 7.99 5.43 0.00 2.91 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 I 8.65 4.98 1.98 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 1.18 1.35 1.00 0.00 0.00 53 L 9.08 5.08 0.00 1.82 1.75 1.12 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.82 5.25 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 55 A 8.46 4.08 1.30 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 0.00 0.00 56 A 8.15 3.85 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 7.88 4.06 0.00 3.26 3.38 0.00 5.29 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.19 4.14 0.00 3.10 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 59 L 6.82 3.94 0.00 1.29 1.28 0.83 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 60 Y 7.38 4.96 0.00 3.07 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 61 Q 7.56 4.30 0.00 1.72 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.69 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 61A A 7.18 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 K 8.92 4.15 0.00 1.74 2.01 0.00 1.83 0.00 0.00 1.64 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.45 7.81 63 R 7.58 4.72 0.00 1.81 1.98 0.00 3.24 0.00 0.00 3.29 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 64 F 8.46 5.46 0.00 3.52 3.24 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 65 K 9.28 4.66 0.00 1.71 1.75 0.00 1.64 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.29 1.35 7.81 66 V 8.50 4.75 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 0.80 0.00 0.00 0.98 0.00 0.00 67 R 9.68 5.04 0.00 1.75 1.81 0.00 3.00 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.79 0.00 68 V 8.45 4.61 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 0.76 0.00 0.00 1.02 0.00 0.00 69 G 8.64 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 70 D 8.26 5.07 0.00 2.59 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 71 R 9.76 4.67 0.00 1.76 1.94 0.00 3.25 0.00 0.00 3.00 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.52 0.00 72 N 8.47 5.45 0.00 2.83 2.66 0.00 0.00 6.99 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 T 9.17 4.30 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 0.80 0.00 0.00 74 E 7.94 5.69 0.00 2.20 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 0.00 2.16 2.05 0.00 75 Q 6.90 4.37 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.56 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 76 E 7.27 3.71 0.00 1.96 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 2.25 2.41 0.00 77 E 9.63 4.04 0.00 2.04 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 2.35 2.30 0.00 78 G 8.98 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 79 G 7.79 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 80 E 7.77 4.58 0.00 1.99 1.95 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 2.33 2.34 0.00 81 A 7.58 5.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 V 7.96 4.83 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 0.84 0.00 0.00 0.92 0.00 0.00 83 H 9.00 4.97 0.00 3.03 3.09 0.00 5.66 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 E 8.54 4.67 0.00 1.87 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 2.30 2.25 0.00 85 V 8.08 3.80 1.72 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 0.70 0.00 0.00 0.51 0.00 0.00 86 E 10.37 4.22 0.00 2.00 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 2.27 2.26 0.00 87 V 7.53 4.63 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 0.73 0.00 0.00 0.94 0.00 0.00 88 V 8.45 4.75 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 0.79 0.00 0.00 0.99 0.00 0.00 89 I 8.51 4.37 2.02 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 0.77 0.87 0.00 0.00 90 K 8.55 4.74 0.00 1.77 1.75 0.00 1.51 0.00 0.00 1.34 0.00 0.00 2.63 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.30 7.81 91 H 8.42 4.54 0.00 2.76 3.07 0.00 5.67 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 92 N 9.20 4.36 0.00 2.71 2.93 0.00 0.00 7.16 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 93 R 7.67 4.30 0.00 0.67 1.28 0.00 3.11 0.00 0.00 3.10 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.34 0.00 94 F 8.08 4.95 0.00 3.05 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 95 T 6.82 4.15 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 1.20 0.00 0.00 96 K 8.04 3.70 0.00 1.78 1.93 0.00 1.43 0.00 0.00 1.55 0.00 0.00 2.69 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.23 1.24 7.81 97 E 7.88 4.05 0.00 2.04 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 2.24 2.16 0.00 98 T 8.08 4.28 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 1.12 0.00 0.00 99 Y 8.00 3.83 0.00 2.64 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 0.00 100 D 7.76 4.71 0.00 2.73 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 0.00 101 F 8.75 3.95 0.00 3.38 2.76 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 0.00 102 D 8.03 4.76 0.00 3.25 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.20 4.62 1.43 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.82 -0.39 0.00 0.00 104 A 9.50 5.12 1.23 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 0.00 105 V 9.06 4.95 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 1.06 0.00 0.00 1.13 0.00 0.00 106 L 9.01 4.78 0.00 1.78 1.64 1.21 0.68 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 0.00 107 R 8.60 4.75 0.00 1.95 1.95 0.00 2.34 0.00 0.00 2.95 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.49 0.00 108 L 8.69 4.42 0.00 1.51 1.56 0.76 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.56 4.52 0.00 1.80 1.83 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.46 1.39 7.81 110 T 7.69 4.66 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 1.19 0.00 0.00 111 P 0.00 3.44 0.00 1.62 1.69 0.00 3.50 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.34 0.00 112 I 7.92 3.98 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.47 1.04 0.00 0.00 113 T 8.27 4.14 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 1.15 0.00 0.00 114 F 8.24 4.80 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 0.00 115 R 8.96 4.54 0.00 1.93 2.06 0.00 3.10 0.00 0.00 3.13 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.71 0.00 116 M 8.69 4.10 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.63 0.00 117 N 8.65 3.96 0.00 2.92 2.75 0.00 0.00 6.48 7.68 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 0.00 118 V 7.65 4.42 2.35 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 1.15 0.00 0.00 1.03 0.00 0.00 119 A 8.39 4.27 1.06 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 0.00 0.00 120 P 0.00 4.81 0.00 2.23 1.88 0.00 3.04 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.57 0.00 121 A 8.37 4.23 0.72 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 0.00 0.00 122 C 7.90 4.39 0.00 2.44 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 0.00 123 L 8.48 5.03 0.00 1.69 1.68 1.01 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 124 P 0.00 4.63 0.00 2.23 1.97 0.00 3.89 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.00 0.00 124A E 8.53 4.59 0.00 2.00 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 2.31 2.27 0.00 125 R 8.59 3.51 0.00 1.90 1.80 0.00 3.37 0.00 0.00 3.40 8.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.71 0.00 126 D 9.38 4.30 0.00 3.04 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 W 9.16 4.03 0.00 3.37 3.24 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 0.00 128 A 8.55 3.24 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 0.00 129 E 7.73 3.66 0.00 1.80 1.83 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 2.18 2.51 0.00 130 S 7.34 4.06 0.00 3.68 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 0.00 131 T 7.16 3.94 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 131A L 6.80 3.82 0.00 1.05 1.37 0.10 0.29 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 131B M 7.53 3.94 0.00 1.17 1.57 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 1.98 0.00 132 T 7.27 3.85 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 133 Q 7.04 4.18 0.00 2.35 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.98 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 134 K 8.57 4.29 0.00 1.85 1.86 0.00 1.73 0.00 0.00 1.90 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.39 7.81 135 T 7.47 4.88 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 136 G 8.50 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 I 9.45 5.05 2.10 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 1.41 1.28 1.02 0.00 0.00 138 V 8.79 5.32 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 1.16 0.00 0.00 1.22 0.00 0.00 139 S 9.02 4.96 0.00 3.94 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 0.00 140 G 7.47 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 0.00 0.00 0.00 0.00 141 F 8.61 4.88 0.00 3.05 3.13 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 0.00 142 G 8.12 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 0.00 143 R 8.20 4.92 0.00 1.87 2.15 0.00 3.22 0.00 0.00 3.18 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.71 0.00 144 T 8.39 5.08 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 1.25 0.00 0.00 145 H 7.61 4.72 0.00 3.18 3.15 0.00 5.89 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *147 E 8.67 4.29 0.00 2.07 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 2.20 2.42 0.00 148 K 7.98 4.67 0.00 1.78 1.77 0.00 1.81 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.41 7.81 149 G 8.11 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 0.00 0.00 0.00 0.00 150 R 8.36 4.59 0.00 1.93 2.12 0.00 3.00 0.00 0.00 3.29 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 151 Q 8.58 4.90 0.00 2.12 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.71 0.00 0.00 0.00 0.00 0.00 2.41 2.86 0.00 152 S 8.55 4.62 0.00 4.00 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 0.00 153 T 8.48 4.80 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 1.24 0.00 0.00 154 R 7.93 5.10 0.00 1.75 1.92 0.00 3.55 0.00 0.00 3.20 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 155 L 9.21 3.45 0.00 0.97 1.33 0.18 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.80 5.06 0.00 1.63 1.71 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.31 1.48 7.81 157 M 8.45 5.11 0.00 1.95 2.11 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 158 L 9.51 4.88 0.00 1.71 1.55 1.10 0.65 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 0.00 159 E 8.86 4.78 0.00 2.05 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 2.24 2.32 0.00 160 V 8.53 4.04 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 0.69 0.00 0.00 0.87 0.00 0.00 161 P 0.00 4.69 0.00 2.11 2.18 0.00 2.87 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.04 0.00 162 Y 8.30 4.66 0.00 2.86 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 0.00 163 V 8.28 4.46 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 -0.11 0.00 0.00 0.63 0.00 0.00 164 D 8.52 4.35 0.00 2.74 2.46 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 0.00 165 R 8.48 3.93 0.00 1.86 1.86 0.00 3.18 0.00 0.00 3.30 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 166 N 8.18 4.39 0.00 2.91 2.83 0.00 0.00 7.18 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 0.00 167 S 8.79 4.26 0.00 3.75 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 0.00 168 C 8.10 3.94 0.00 3.14 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 K 8.25 3.92 0.00 1.92 1.90 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.69 7.81 170 L 8.33 4.18 0.00 1.71 1.76 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 171 S 8.49 4.34 0.00 4.35 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 0.00 172 S 7.71 4.63 0.00 4.04 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 0.00 173 S 8.66 4.50 0.00 3.33 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 F 8.52 4.84 0.00 2.89 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 I 8.43 3.88 1.92 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.76 0.95 0.00 0.00 176 I 8.03 4.48 1.94 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.92 0.97 0.00 0.00 177 T 8.09 4.15 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 178 Q 8.58 4.01 0.00 1.90 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.60 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 179 N 7.05 4.70 0.00 2.60 3.02 0.00 0.00 6.88 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 0.00 180 M 7.25 4.98 0.00 1.91 2.17 0.00 0.00 0.00 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.69 0.00 181 F 8.14 4.87 0.00 3.04 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 C 8.99 5.08 0.00 2.77 2.84 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 0.00 183 A 8.37 4.56 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 G 7.72 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 185 Y 8.12 5.12 0.00 3.10 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 185A D 9.09 4.07 0.00 2.77 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185B T 7.74 4.18 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 1.20 0.00 0.00 186 K 7.93 3.73 0.00 1.18 0.99 0.00 1.06 0.00 0.00 1.03 0.00 0.00 2.86 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.18 1.18 7.81 187 Q 8.35 4.44 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.44 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 188 E 7.35 5.27 0.00 2.24 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 0.00 2.25 2.11 0.00 189 D 8.48 4.55 0.00 2.84 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 0.00 190 A 8.64 4.46 1.28 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 0.00 0.00 0.00 191 C 8.60 4.65 0.00 2.97 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 0.00 192 Q 8.62 4.26 0.00 2.18 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.42 0.00 0.00 0.00 0.00 0.00 2.51 2.45 0.00 193 G 9.06 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 7.91 4.77 0.00 3.03 2.76 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 0.00 195 S 7.90 4.49 0.00 3.94 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 0.00 196 G 8.67 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 0.00 197 G 7.97 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 0.00 0.00 0.00 198 P 0.00 4.99 0.00 2.28 2.34 0.00 3.88 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.01 0.00 199 H 9.06 4.90 0.00 2.95 3.24 0.00 5.55 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 V 8.91 4.94 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 0.38 0.00 0.00 1.18 0.00 0.00 201 T 8.55 4.61 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 1.29 0.00 0.00 202 R 8.37 4.17 0.00 0.67 1.48 0.00 3.08 0.00 0.00 3.02 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.72 0.00 203 F 9.27 4.55 0.00 3.08 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 0.00 204 K 8.54 3.55 0.00 1.65 1.69 0.00 1.48 0.00 0.00 1.48 0.00 0.00 2.31 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.93 0.25 7.81 205 D 8.08 4.58 0.00 2.84 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 0.00 206 T 7.47 4.82 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 207 Y 8.63 5.07 0.00 1.85 2.42 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 0.00 208 F 8.91 4.86 0.00 2.98 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 0.00 209 V 9.06 4.39 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 0.83 0.00 0.00 0.88 0.00 0.00 210 T 9.64 4.67 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 211 G 7.66 4.90 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 0.00 212 I 7.82 4.92 1.94 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.80 1.00 0.00 0.00 213 V 8.78 3.69 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.23 0.00 0.00 214 S 8.99 5.20 0.00 3.98 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 0.00 215 W 8.65 5.26 0.00 3.43 3.46 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 0.00 216 G 8.67 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 0.00 217 E 9.13 4.56 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.74 0.00 218 G 8.01 3.61 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 0.00 218 C 8.00 4.20 0.00 2.80 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 0.00 221 A 8.35 3.73 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 0.00 222 R 7.73 4.20 0.00 1.86 1.83 0.00 3.46 0.00 0.00 3.34 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.76 0.00 223 K 7.98 4.80 0.00 1.71 1.72 0.00 1.91 0.00 0.00 2.35 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.39 7.81 223A G 9.25 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 0.00 224 K 7.48 4.50 0.00 1.76 1.66 0.00 1.62 0.00 0.00 1.68 0.00 0.00 3.12 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.64 1.49 7.81 225 Y 8.28 4.81 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 0.00 226 G 8.50 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 0.00 227 I 8.05 4.11 0.56 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.40 0.00 0.00 228 Y 8.13 4.78 0.00 1.43 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.79 4.54 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 1.33 0.00 0.00 230 K 8.89 5.14 0.00 2.05 1.81 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.59 1.49 7.81 231 V 8.72 3.87 2.28 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 1.25 0.00 0.00 1.11 0.00 0.00 232 T 8.17 3.55 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 233 A 8.24 4.00 1.02 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 0.00 234 F 8.60 4.88 0.00 3.26 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 0.00 235 L 7.76 3.66 0.00 1.75 1.67 1.10 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 236 K 8.34 3.89 0.00 1.91 1.99 0.00 1.71 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.59 1.59 7.81 237 W 8.99 4.14 0.00 3.53 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 0.00 238 I 8.33 3.73 2.15 0.00 0.00 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 1.86 0.74 0.95 0.00 0.00 239 D 8.06 4.28 0.00 2.82 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 240 R 8.06 3.91 0.00 1.80 1.92 0.00 3.18 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 241 S 7.38 4.21 0.00 3.50 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 0.00 242 M 7.24 3.16 0.00 1.44 1.77 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 1.86 0.00 243 K 7.03 4.40 0.00 1.59 1.71 0.00 1.85 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.30 7.81 244 T 8.42 3.40 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 245 R 8.21 4.06 0.00 1.64 1.58 0.00 3.19 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.51 0.00 * Residues marked with a * may have inaccurate shift predictions.