NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.1759 7.8827 121.4507 61.0537 38.7166 174.1365 17 V 4.2000 8.1333 125.8699 62.1731 31.7591 174.4939 18 G 4.2853 8.7319 117.2026 46.7101 0.0000 172.0457 19 G 4.1427 7.8803 106.3620 44.5678 0.0000 173.5979 20 Q 4.6359 8.5386 119.0238 54.7584 31.1975 174.9594 21 E 4.6866 8.3962 119.3533 55.4797 31.2063 177.0513 22 C 4.5662 8.5589 121.4538 56.5211 42.2222 174.3535 23 K 4.1777 9.0289 124.4690 54.7247 33.2091 175.5208 24 D 4.3638 8.4570 119.5176 56.3998 40.5036 177.2961 25 G 3.8023 9.7507 112.9500 45.9215 0.0000 173.7970 26 E 3.9907 8.0277 120.2833 58.0430 30.5045 176.3625 27 C 4.0498 7.2048 115.1295 54.7311 39.9474 173.3417 28 P 3.9538 0.0000 0.0000 63.8008 31.6280 177.9942 29 W 5.0848 6.0124 114.6565 55.7549 28.8958 175.3491 30 Q 4.7136 7.4922 121.5751 56.2701 29.1143 174.8939 31 A 4.9994 9.0521 127.0851 50.0128 23.2391 174.3192 32 L 4.9739 8.6866 120.3627 53.2875 45.8900 175.5479 33 L 4.8514 8.8624 127.0217 53.4496 42.6575 175.1395 34 I 4.8951 8.4210 119.0599 59.3245 39.9600 176.2710 35 N 4.7847 9.0652 124.4461 52.3969 39.5793 174.7485 36 E 3.9461 9.0399 116.4634 60.5597 29.5258 178.1096 37 E 4.2373 8.2635 113.5391 56.4953 29.1408 176.4918 38 N 4.3328 8.0113 114.6248 54.2628 36.6818 173.7871 39 E 4.2971 8.7265 119.3215 55.2133 29.9539 176.6823 40 G 4.0869 8.4823 114.0843 45.3589 0.0000 172.5321 41 F 4.5814 8.7103 122.2617 59.1654 39.1668 174.5376 42 C 4.7191 7.1482 115.5054 56.0576 45.1435 172.1862 43 G 4.3355 8.4140 107.3618 45.0790 0.0000 171.9332 44 G 4.4003 8.5829 105.4024 45.5210 0.0000 172.2779 45 T 5.3948 8.8083 116.6120 61.4977 71.7684 173.9779 46 I 4.2388 9.1568 128.2439 61.4767 37.5684 176.7397 47 L 4.3841 8.8462 127.7773 56.3782 42.2584 176.3253 48 S 4.8478 7.5136 110.2984 58.0797 65.2935 174.6342 49 E 3.8362 9.0752 118.3017 59.2529 29.4265 178.4402 50 F 4.5987 7.8117 113.0796 57.7780 41.8700 175.5309 51 Y 5.3384 7.9683 116.1669 56.4676 40.2091 175.0640 52 I 5.0761 8.9397 124.0557 59.4949 40.8425 174.2031 53 L 4.9569 8.9912 129.1746 54.4509 44.0578 175.1215 54 T 5.1840 8.8988 118.9769 61.1779 71.8300 171.8869 55 A 4.4590 8.4296 125.8413 51.0518 19.8967 178.4444 56 A 3.8844 8.4065 124.3718 55.3332 18.1753 179.8830 57 H 4.1947 7.9392 112.7257 58.7137 28.8907 176.9577 58 C 4.7096 7.7658 119.0423 59.3414 39.6641 175.0820 59 L 4.4239 7.5844 117.6022 55.6601 41.2528 176.9131 60 Y 4.4359 7.9984 118.0809 59.2582 39.4401 177.3494 61 Q 4.2488 8.1751 115.9990 55.4194 28.4748 175.3019 61A A 4.1862 7.1110 116.5635 51.3166 22.5330 177.9146 62 K 4.1945 8.8943 122.8997 59.0740 32.5238 177.7692 63 R 4.5363 7.5299 112.2529 54.8561 31.8804 173.4390 64 F 5.2377 7.4752 113.8401 56.0755 41.6368 172.4748 65 K 4.8592 9.7345 117.4188 54.8875 37.2045 175.7877 66 V 4.8646 8.8786 121.2744 61.4039 33.9246 174.0573 67 R 5.0389 9.0247 129.4872 55.1219 31.8547 175.4250 68 V 4.7342 8.8728 119.1201 60.6742 35.5651 177.0300 69 G 4.0511 9.0888 109.9790 46.4383 0.0000 172.9872 70 D 4.5845 7.8262 119.6278 53.7155 42.0006 175.3750 71 R 4.7721 8.6914 125.0920 56.3011 33.2555 174.2643 72 N 5.4231 8.2616 116.7425 52.5214 40.8246 174.3360 73 T 3.5691 9.3678 127.2757 67.5613 68.6042 175.7501 74 E 4.0780 9.3145 120.8872 58.4710 30.3794 181.0827 75 Q 4.2196 7.9089 118.5970 54.9316 29.5298 178.8560 76 E 5.0573 8.3084 123.6047 53.7891 28.1894 175.3853 77 E 4.0178 8.4072 124.2619 55.9994 30.1766 178.6245 78 G 3.7961 8.4357 110.9294 45.5745 0.0000 175.8311 79 G 3.9692 8.5374 104.7666 46.3135 0.0000 173.5634 80 E 4.6034 8.1362 119.9250 56.1710 31.0599 176.0634 81 A 4.8490 9.1963 125.2251 50.6255 22.7810 175.1678 82 V 4.6526 8.4321 122.8791 62.1347 33.1338 174.8362 83 H 5.0145 9.3529 123.8292 54.0536 32.9127 172.4135 84 E 4.6723 8.6410 120.9705 55.3871 31.4511 175.5324 85 V 4.0543 8.1601 123.7744 63.0370 31.8008 175.0217 86 E 4.1850 9.4800 130.8869 58.2975 29.6123 176.2200 87 V 4.5077 7.6310 118.5784 60.8327 35.4891 173.8065 88 V 4.5655 8.4532 125.8094 61.4444 33.5826 175.1523 89 I 4.3483 8.9308 131.2650 60.0191 37.7857 175.0484 90 K 4.9103 8.5627 128.2914 54.9475 34.4565 175.3100 91 H 4.6930 8.6575 125.7421 55.6914 30.1526 175.8580 92 N 4.5654 9.4532 123.9658 54.9651 37.1586 175.4899 93 R 4.2209 7.6876 116.4100 55.6489 30.7799 175.8241 94 F 4.8691 7.9654 120.9654 57.8027 40.1580 174.8192 95 T 4.0519 6.9446 122.7750 61.5245 72.3456 175.1565 96 K 3.0166 7.8665 125.4757 58.9668 32.2269 178.7144 97 E 4.0170 7.6932 116.8406 58.2486 29.2721 177.3644 98 T 4.4613 6.8688 105.6655 60.0522 70.7676 174.3392 99 Y 3.8422 7.9449 118.0556 58.7200 36.2362 169.3214 100 D 4.8319 7.4614 118.2203 54.1217 42.5614 175.9449 101 F 4.0598 8.3641 119.9299 58.8135 36.1767 176.2513 102 D 4.7017 8.1666 121.3591 53.3900 39.2621 174.2818 103 I 4.6146 7.3748 121.0909 59.5125 41.9167 172.4059 104 A 5.2315 9.0716 127.7096 51.1519 23.1795 175.1843 105 V 4.8908 9.4073 122.2321 61.1865 34.2009 174.3694 106 L 5.2805 9.3608 127.5539 53.0030 44.8163 175.1271 107 R 4.7486 9.0514 124.2100 54.6278 32.1153 174.9299 108 L 4.9633 8.5942 126.5961 53.5245 42.8389 177.1868 109 K 4.3491 9.1776 122.4166 58.7131 32.6805 177.8055 110 T 4.6755 7.7426 109.1966 58.4562 70.9642 171.8860 111 P 3.4663 0.0000 0.0000 62.5513 31.9809 175.4707 112 I 3.8779 8.0147 124.0571 60.8152 38.6582 175.2040 113 T 3.9712 8.3028 126.6494 62.8426 69.0125 174.5793 114 F 4.8976 8.2837 126.3074 57.4160 39.9778 174.9933 115 R 4.4831 8.6052 120.0650 55.3668 32.1760 173.2851 116 M 4.0424 8.4975 117.4791 57.7668 32.0036 175.8639 117 N 4.2515 9.4662 121.5201 53.3878 36.1509 173.9485 118 V 4.2227 8.2036 118.8613 61.8513 33.3460 173.4335 119 A 4.3835 8.6520 128.3380 49.8497 22.8642 173.8276 120 P 5.0976 0.0000 0.0000 62.5969 32.8086 175.0588 121 A 4.6440 8.4834 121.8022 50.3445 21.3017 176.3968 122 C 4.3952 8.1683 117.8352 59.1399 29.6979 173.1848 123 L 4.8764 8.5568 123.2088 53.0918 43.1198 175.2739 124 P 4.9579 0.0000 0.0000 62.0031 33.1294 174.3910 124A E 4.7454 7.7661 116.3566 54.5899 32.8054 175.5423 125 R 3.8946 8.6982 122.6532 59.8306 30.1797 175.6354 126 D 4.6524 7.7993 117.0613 54.9112 41.6386 176.0169 127 W 3.0986 8.2355 133.7945 55.3883 28.3629 174.0774 128 A 4.3786 7.0605 133.7297 53.1869 20.2045 177.1364 129 E 4.1152 7.7221 123.3382 57.6297 28.6102 176.5479 130 S 4.2209 8.2788 117.1370 59.4330 62.8037 170.1376 131 T 3.2053 8.1414 124.9174 64.0925 67.2708 173.4944 131A L 3.9057 6.5227 119.5142 57.6036 42.1375 179.4494 131B M 3.1207 7.9695 117.2389 57.8419 31.9809 178.3403 132 T 3.7502 7.3583 114.6416 66.1329 68.7790 174.7309 133 Q 4.1975 7.3832 119.7162 56.2396 29.2996 176.4786 134 K 4.5307 8.4883 116.9136 58.2778 34.0740 176.1895 135 T 4.7928 7.7899 115.9760 62.1798 72.7853 172.7559 136 G 3.9614 8.6976 110.7343 44.4482 0.0000 171.2064 137 I 5.1545 8.7381 120.5689 59.2913 40.1385 175.6861 138 V 5.4131 8.6034 124.5369 59.3510 35.1002 174.3131 139 S 4.9590 7.8191 114.8223 57.0706 65.7973 173.5524 140 G 4.0319 7.4545 108.5059 45.8375 0.0000 172.6147 141 F 4.9982 8.2308 118.0033 56.9541 38.7771 175.1952 142 G 4.1753 7.7460 109.8851 42.9861 0.0000 172.4933 143 R 4.3280 8.1078 117.4311 56.5583 30.6034 177.2110 144 T 4.6655 8.3099 115.2283 63.6957 69.5594 175.9582 145 H 4.7506 7.8163 113.8454 56.3107 33.1550 172.6903 *147 E 3.9024 7.9808 120.2515 56.7869 30.4064 175.3249 148 K 3.7553 9.2648 126.5397 56.2887 28.5873 173.7334 149 G 4.0841 7.1835 105.5372 44.8154 0.0000 172.0142 150 R 4.2402 8.2286 117.6201 56.0780 31.5689 175.7577 151 Q 4.6242 8.4652 122.7750 54.7407 29.9547 175.4973 152 S 4.3306 8.2738 121.7425 59.9018 63.2825 174.5655 153 T 4.6073 8.8071 116.5456 63.8754 70.1866 174.2196 154 R 5.1754 7.8882 119.6624 53.8255 33.3908 175.3565 155 L 3.0898 8.2846 125.1658 54.7137 43.0234 175.8786 156 K 5.0829 8.2233 125.8558 54.7900 35.4383 175.0324 157 M 5.2819 8.8017 119.6295 53.8562 35.5283 174.0061 158 L 4.6556 8.3004 118.4118 54.2207 46.4025 173.4435 159 E 4.6562 9.0321 126.3815 56.0582 30.3732 176.2138 160 V 4.2810 8.4911 119.5010 58.4372 34.2822 174.0310 161 P 4.6762 0.0000 0.0000 62.7145 32.7426 175.1468 162 Y 4.6310 8.3718 120.4556 58.1427 38.3623 175.2165 163 V 4.2749 8.1306 124.6276 60.7181 33.2999 175.4256 164 D 4.4296 8.4971 127.1831 52.9651 40.3466 176.7771 165 R 3.8759 8.8810 122.2618 60.0292 29.8711 178.3914 166 N 4.3170 8.0780 115.2008 56.6253 38.6611 177.4491 167 S 4.1826 8.1914 116.1836 61.5192 62.8685 175.6771 168 C 4.1946 8.2336 121.2233 59.9587 43.1377 175.9061 169 K 3.9794 8.0906 118.6063 59.6058 31.7592 179.1753 170 L 4.1623 8.0101 118.2962 57.3081 41.5190 179.0444 171 S 4.4633 7.8563 113.3996 59.2657 63.3544 174.8407 172 S 4.8327 7.7449 117.4539 57.0576 62.6685 174.9885 173 S 4.0788 8.8715 124.0583 60.2498 62.7990 174.2268 174 F 4.9649 7.1113 118.6646 54.8933 41.1854 175.1883 175 I 3.7267 8.4822 123.0418 61.4834 37.9583 175.7554 176 I 4.3433 8.3310 129.7530 59.9334 36.5081 175.6104 177 T 4.2722 8.1792 116.2658 60.9476 69.5711 175.5062 178 Q 4.1813 8.4534 119.5013 57.8371 28.9998 176.7605 179 N 4.7873 7.8231 114.9521 53.1842 38.5747 173.7823 180 M 5.5174 7.4474 117.6200 53.9287 36.6273 174.4427 181 F 4.8261 8.3301 111.0193 56.5775 41.6764 172.7809 182 C 5.1336 8.7007 118.3668 56.4413 41.5322 172.5313 183 A 4.8426 8.2603 122.1519 50.1359 22.6815 177.2703 184 G 4.1724 6.8227 109.7143 45.5090 0.0000 171.0894 185 Y 4.9327 8.1037 116.9591 56.2865 40.8867 175.5180 185A D 4.2154 9.0833 122.4744 56.9587 41.9524 177.8007 185B T 4.1943 7.9087 112.4596 64.6751 70.3557 175.0545 186 K 3.7063 8.1166 121.0081 57.1239 32.6763 177.5075 187 Q 4.4073 8.3170 127.2797 54.9326 27.0518 174.9005 188 E 4.9328 7.3709 116.5893 54.5122 34.0424 175.5109 189 D 4.6416 8.4041 121.8167 53.6595 45.8033 175.6098 190 A 4.6490 8.7447 125.6611 52.8183 20.0243 175.9547 191 C 4.6739 8.8633 116.1702 56.1576 46.1186 172.5464 192 Q 4.3447 8.5337 118.1502 57.7583 28.6150 177.5632 193 G 4.0167 9.1819 110.7608 45.4319 0.0000 173.5628 194 D 4.7144 7.9475 118.2844 54.2333 41.9086 176.7123 195 S 4.4409 7.9006 116.5670 60.4395 63.2351 175.3350 196 G 3.9336 9.4898 114.1768 45.1193 0.0000 173.7265 197 G 4.0665 8.0429 107.4442 45.5977 0.0000 171.2594 198 P 4.9813 0.0000 0.0000 62.5914 33.5846 174.7687 199 H 4.9316 9.3794 122.2807 54.4848 31.4423 172.6529 200 V 4.7532 8.6750 125.0858 60.4194 34.3540 175.1245 201 T 4.8542 8.8482 118.0044 61.8274 72.1932 173.1107 202 R 4.0936 8.5653 127.1294 55.3788 31.1928 175.3853 203 F 4.5351 8.9470 128.2174 57.0569 40.1478 172.9605 204 K 3.9267 8.1771 129.4396 56.4458 30.4168 176.6939 205 D 4.7007 7.5559 118.8249 54.4085 45.4519 175.6156 206 T 4.6313 7.6503 116.5842 62.3174 71.2809 173.1866 207 Y 4.8546 8.0982 120.4691 56.2402 41.0013 174.5523 208 F 5.3235 9.0203 123.1925 55.4727 42.1210 175.1823 209 V 4.0635 8.7949 124.4179 63.5392 31.3014 175.4352 210 T 4.4398 8.9413 119.2342 63.1925 71.0283 174.4951 211 G 5.3329 7.7557 107.1282 46.6797 0.0000 172.1089 212 I 5.2107 8.0853 112.7318 58.4086 41.1350 174.4878 213 V 3.2035 8.9481 125.5060 64.3631 31.7743 175.2129 214 S 4.9014 8.4167 123.2043 58.6163 62.5630 174.6478 215 W 4.8481 7.3368 113.8390 56.0985 31.9929 172.4052 216 G 4.1085 8.5188 105.1382 46.3358 0.0000 173.9327 217 E 4.4515 8.6304 120.9177 55.4192 28.6592 177.5190 218 G 3.8832 8.2132 113.8468 44.4486 0.0000 171.1457 218 C 4.4732 8.2032 123.6468 57.5486 25.8329 170.8457 221 A 3.7820 8.9061 125.4429 52.7967 16.6928 177.0045 222 R 3.8877 7.7536 119.3114 57.1202 30.4825 175.7883 223 K 4.2650 8.5354 127.0987 58.4294 32.3140 176.5899 223A G 4.0495 9.2924 115.9866 44.7756 0.0000 172.8708 224 K 4.4236 7.3836 117.7287 54.5880 34.9694 174.5481 225 Y 4.9266 7.9871 116.8813 56.0869 42.0914 175.3413 226 G 3.9204 8.5093 107.9695 45.5944 0.0000 172.7926 227 I 4.7207 7.8323 117.8375 59.0202 40.4112 174.1985 228 Y 4.8563 8.2397 121.4167 56.0977 42.4996 174.5835 229 T 4.6284 8.7278 118.2116 63.2249 70.2401 174.8597 230 K 4.6297 9.2470 128.0142 55.6488 31.6882 177.1790 231 V 3.9370 8.6572 126.7035 66.1664 31.3410 177.4185 232 T 3.8772 8.1683 114.9047 66.8502 68.1060 175.8424 233 A 3.9634 7.8119 119.9414 53.7098 18.5000 177.9510 234 F 4.8830 8.1494 115.2670 57.1521 40.1546 177.1562 235 L 4.1140 7.9852 123.1651 58.4277 41.3688 179.7001 236 K 4.0528 8.1917 117.3510 59.1975 31.9208 179.1138 237 W 4.1416 8.3768 128.2664 60.4791 30.7613 177.8464 238 I 3.7593 8.4710 121.5484 63.9439 36.5778 178.1261 239 D 4.2488 8.1731 119.5696 57.2083 40.4116 178.4858 240 R 3.7419 7.8063 118.4357 59.7411 30.1609 178.4932 241 S 3.8858 7.7592 113.8837 61.4101 62.5504 176.1556 242 M 2.5997 7.4201 121.4277 56.8456 31.7512 177.7612 243 K 4.3703 7.5998 116.2805 55.1370 32.7164 172.9006 244 T 3.3034 7.7872 122.9147 63.8059 66.9968 171.8750 245 R 4.0556 8.0670 125.1776 57.0757 30.2003 173.8589 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 4.18 1.85 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 1.28 0.87 0.93 0.00 0.00 17 V 8.13 4.20 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.99 0.00 0.00 18 G 8.73 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.88 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 0.00 0.00 0.00 0.00 20 Q 8.54 4.64 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.79 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 21 E 8.40 4.69 0.00 1.81 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.29 0.00 22 C 8.56 4.57 0.00 2.83 2.88 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 23 K 9.03 4.18 0.00 1.85 1.71 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.52 7.81 24 D 8.46 4.36 0.00 2.62 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 9.75 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 26 E 8.03 3.99 0.00 2.02 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 2.19 0.00 27 C 7.20 4.05 0.00 2.61 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 3.95 0.00 2.03 1.99 0.00 2.20 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.41 0.00 29 W 6.01 5.08 0.00 3.55 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.49 4.71 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.73 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 31 A 9.05 5.00 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 32 L 8.69 4.97 0.00 1.76 1.54 0.96 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.86 4.85 0.00 0.54 0.63 0.38 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 34 I 8.42 4.90 1.83 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 1.51 1.31 0.86 0.00 0.00 35 N 9.07 4.78 0.00 2.98 2.98 0.00 0.00 6.68 7.18 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 36 E 9.04 3.95 0.00 1.98 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 2.33 2.43 0.00 37 E 8.26 4.24 0.00 2.22 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 2.32 2.34 0.00 38 N 8.01 4.33 0.00 2.91 2.93 0.00 0.00 6.88 7.44 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 39 E 8.73 4.30 0.00 2.21 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 2.32 2.29 0.00 40 G 8.48 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.71 4.58 0.00 3.09 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 42 C 7.15 4.72 0.00 2.11 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 43 G 8.41 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 0.00 0.00 0.00 0.00 44 G 8.58 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 45 T 8.81 5.39 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 46 I 9.16 4.24 2.01 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.83 1.12 0.00 0.00 47 L 8.85 4.38 0.00 1.97 1.84 1.03 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 48 S 7.51 4.85 0.00 4.18 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 9.08 3.84 0.00 1.81 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.87 0.00 50 F 7.81 4.60 0.00 2.59 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 7.97 5.34 0.00 3.11 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 52 I 8.94 5.08 1.99 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.01 1.04 0.00 0.00 53 L 8.99 4.96 0.00 1.88 1.63 1.10 0.76 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 54 T 8.90 5.18 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 1.29 0.00 0.00 55 A 8.43 4.46 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 56 A 8.41 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 7.94 4.19 0.00 3.45 3.44 0.00 5.57 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.77 4.71 0.00 3.04 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 7.58 4.42 0.00 1.77 1.66 0.94 0.66 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 60 Y 8.00 4.44 0.00 3.30 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 61 Q 8.18 4.25 0.00 1.82 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.75 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 61A A 7.11 4.19 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 K 8.89 4.19 0.00 1.75 1.87 0.00 1.76 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.41 7.81 63 R 7.53 4.54 0.00 1.77 1.77 0.00 2.99 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.61 0.00 64 F 7.48 5.24 0.00 3.44 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 9.73 4.86 0.00 1.72 1.85 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.40 7.81 66 V 8.88 4.86 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 1.07 0.00 0.00 1.09 0.00 0.00 67 R 9.02 5.04 0.00 1.89 1.72 0.00 3.04 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 1.51 1.59 0.00 68 V 8.87 4.73 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 0.67 0.00 0.00 1.02 0.00 0.00 69 G 9.09 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 0.00 0.00 0.00 70 D 7.83 4.58 0.00 2.59 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 R 8.69 4.77 0.00 1.92 1.89 0.00 3.27 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 72 N 8.26 5.42 0.00 2.76 2.89 0.00 0.00 7.19 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 73 T 9.37 3.57 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 1.05 0.00 0.00 74 E 9.31 4.08 0.00 1.94 1.71 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 2.26 2.12 0.00 75 Q 7.91 4.22 0.00 2.07 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 7.23 0.00 0.00 0.00 0.00 0.00 2.28 1.91 0.00 76 E 8.31 5.06 0.00 1.97 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 2.30 2.26 0.00 77 E 8.41 4.02 0.00 1.98 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 2.31 2.36 0.00 78 G 8.44 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 79 G 8.54 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 8.14 4.60 0.00 1.92 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 2.47 2.54 0.00 81 A 9.20 4.85 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 82 V 8.43 4.65 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 0.85 0.00 0.00 0.93 0.00 0.00 83 H 9.35 5.01 0.00 3.01 3.12 0.00 5.66 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 E 8.64 4.67 0.00 1.92 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 2.35 2.29 0.00 85 V 8.16 4.05 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 0.81 0.00 0.00 0.92 0.00 0.00 86 E 9.48 4.18 0.00 2.04 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 0.00 2.28 2.23 0.00 87 V 7.63 4.51 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 1.04 0.00 0.00 0.92 0.00 0.00 88 V 8.45 4.57 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 1.03 0.00 0.00 0.97 0.00 0.00 89 I 8.93 4.35 1.94 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 1.12 0.54 0.81 0.00 0.00 90 K 8.56 4.91 0.00 1.87 1.81 0.00 1.81 0.00 0.00 1.74 0.00 0.00 3.17 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.46 1.46 7.81 91 H 8.66 4.69 0.00 2.87 3.18 0.00 5.65 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 N 9.45 4.57 0.00 2.93 3.05 0.00 0.00 6.18 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 7.69 4.22 0.00 0.67 0.66 0.00 2.98 0.00 0.00 2.93 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.76 0.00 94 F 7.97 4.87 0.00 3.18 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 95 T 6.94 4.05 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 1.01 0.00 0.00 96 K 7.87 3.02 0.00 1.47 1.59 0.00 1.32 0.00 0.00 1.61 0.00 0.00 2.60 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.13 1.01 7.81 97 E 7.69 4.02 0.00 1.82 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 2.21 2.14 0.00 98 T 6.87 4.46 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 1.20 0.00 0.00 99 Y 7.94 3.84 0.00 2.78 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 D 7.46 4.83 0.00 2.67 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 0.00 101 F 8.36 4.06 0.00 3.24 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 0.00 102 D 8.17 4.70 0.00 3.15 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 0.00 103 I 7.37 4.61 1.18 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.88 -0.27 0.00 0.00 104 A 9.07 5.23 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 0.00 105 V 9.41 4.89 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 1.14 0.00 0.00 0.97 0.00 0.00 106 L 9.36 5.28 0.00 1.70 1.68 1.17 0.90 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 0.00 107 R 9.05 4.75 0.00 1.93 1.74 0.00 3.08 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.78 0.00 108 L 8.59 4.96 0.00 1.54 1.61 0.98 0.79 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 0.00 109 K 9.18 4.35 0.00 1.64 1.90 0.00 1.64 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.47 1.47 7.81 110 T 7.74 4.68 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 111 P 0.00 3.47 0.00 1.60 1.10 0.00 3.69 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.82 0.00 112 I 8.01 3.88 1.59 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.77 0.88 0.00 0.00 113 T 8.30 3.97 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 0.00 114 F 8.28 4.90 0.00 3.04 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 0.00 115 R 8.61 4.48 0.00 1.98 2.05 0.00 2.80 0.00 0.00 3.10 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 116 M 8.50 4.04 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.62 0.00 117 N 9.47 4.25 0.00 2.94 2.91 0.00 0.00 6.50 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 8.20 4.22 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 1.17 0.00 0.00 0.96 0.00 0.00 119 A 8.65 4.38 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 5.10 0.00 2.16 2.03 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 1.77 1.64 0.00 121 A 8.48 4.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 C 8.17 4.40 0.00 2.43 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 0.00 123 L 8.56 4.88 0.00 1.72 1.69 0.99 1.14 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 0.00 124 P 0.00 4.96 0.00 2.43 2.11 0.00 3.85 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 124A E 7.77 4.75 0.00 2.19 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 2.22 2.15 0.00 125 R 8.70 3.89 0.00 1.84 1.95 0.00 3.15 0.00 0.00 3.31 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 126 D 7.80 4.65 0.00 2.72 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 W 8.24 3.10 0.00 3.36 3.27 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 0.00 128 A 7.06 4.38 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 0.00 129 E 7.72 4.12 0.00 2.01 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.20 0.00 130 S 8.28 4.22 0.00 3.86 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 0.00 131 T 8.14 3.21 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 131A L 6.52 3.91 0.00 1.28 1.40 -0.08 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 131B M 7.97 3.12 0.00 1.28 1.67 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 132 T 7.36 3.75 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 133 Q 7.38 4.20 0.00 2.31 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.81 0.00 0.00 0.00 0.00 0.00 2.57 2.51 0.00 134 K 8.49 4.53 0.00 1.83 2.06 0.00 1.50 0.00 0.00 1.82 0.00 0.00 2.84 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.47 7.81 135 T 7.79 4.79 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 1.22 0.00 0.00 136 G 8.70 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 8.74 5.15 2.01 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.24 1.02 0.00 0.00 138 V 8.60 5.41 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 1.11 0.00 0.00 1.18 0.00 0.00 139 S 7.82 4.96 0.00 3.89 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 0.00 140 G 7.45 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 0.00 141 F 8.23 5.00 0.00 2.99 3.01 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 0.00 142 G 7.75 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 0.00 0.00 0.00 0.00 143 R 8.11 4.33 0.00 1.82 1.96 0.00 3.14 0.00 0.00 3.11 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.81 0.00 144 T 8.31 4.67 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 1.14 0.00 0.00 145 H 7.82 4.75 0.00 3.10 3.24 0.00 5.75 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 *147 E 7.98 3.90 0.00 1.92 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 2.21 2.36 0.00 148 K 9.26 3.76 0.00 1.97 1.90 0.00 1.85 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.43 7.81 149 G 7.18 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 0.00 150 R 8.23 4.24 0.00 1.81 1.89 0.00 3.14 0.00 0.00 3.28 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.65 0.00 151 Q 8.47 4.62 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.88 0.00 0.00 0.00 0.00 0.00 2.48 2.37 0.00 152 S 8.27 4.33 0.00 4.04 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 0.00 153 T 8.81 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 1.34 0.00 0.00 154 R 7.89 5.18 0.00 1.64 1.77 0.00 3.39 0.00 0.00 3.21 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 155 L 8.28 3.09 0.00 0.96 1.22 0.38 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.22 5.08 0.00 1.58 1.67 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.29 1.42 7.81 157 M 8.80 5.28 0.00 1.94 2.13 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.40 0.00 158 L 8.30 4.66 0.00 1.74 1.55 1.11 1.35 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 E 9.03 4.66 0.00 1.97 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 2.33 2.38 0.00 160 V 8.49 4.28 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 0.84 0.00 0.00 0.82 0.00 0.00 161 P 0.00 4.68 0.00 1.95 1.99 0.00 2.83 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.33 0.00 162 Y 8.37 4.63 0.00 2.85 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 0.00 163 V 8.13 4.27 1.81 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 0.07 0.00 0.00 0.35 0.00 0.00 164 D 8.50 4.43 0.00 2.89 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 R 8.88 3.88 0.00 1.87 1.98 0.00 3.17 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.77 0.00 166 N 8.08 4.32 0.00 2.97 2.85 0.00 0.00 7.10 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 8.19 4.18 0.00 3.90 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 0.00 168 C 8.23 4.19 0.00 3.02 3.28 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 0.00 169 K 8.09 3.98 0.00 1.93 1.91 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.22 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.72 7.81 170 L 8.01 4.16 0.00 1.96 1.78 0.94 0.84 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 0.00 171 S 7.86 4.46 0.00 4.21 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 S 7.74 4.83 0.00 4.11 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 0.00 173 S 8.87 4.08 0.00 3.08 3.43 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 0.00 0.00 0.00 0.00 174 F 7.11 4.96 0.00 3.31 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 I 8.48 3.73 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 1.51 0.82 1.01 0.00 0.00 176 I 8.33 4.34 1.95 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.04 0.95 0.00 0.00 177 T 8.18 4.27 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 1.32 0.00 0.00 178 Q 8.45 4.18 0.00 2.02 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.44 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 179 N 7.82 4.79 0.00 2.86 2.95 0.00 0.00 6.63 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 7.45 5.52 0.00 1.78 2.09 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.58 0.00 181 F 8.33 4.83 0.00 3.02 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 0.00 182 C 8.70 5.13 0.00 2.81 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 0.00 183 A 8.26 4.84 1.08 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 0.00 184 G 6.82 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 Y 8.10 4.93 0.00 3.12 2.90 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 185A D 9.08 4.22 0.00 2.91 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 185B T 7.91 4.19 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 1.21 0.00 0.00 186 K 8.12 3.71 0.00 1.54 1.27 0.00 1.43 0.00 0.00 0.61 0.00 0.00 2.81 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.90 1.22 7.81 187 Q 8.32 4.41 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.46 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 188 E 7.37 4.93 0.00 1.64 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 2.33 2.10 0.00 189 D 8.40 4.64 0.00 2.88 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 A 8.74 4.65 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 0.00 191 C 8.86 4.67 0.00 2.96 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 8.53 4.34 0.00 2.19 2.06 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 2.48 2.39 0.00 193 G 9.18 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 0.00 194 D 7.95 4.71 0.00 2.99 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 0.00 195 S 7.90 4.44 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 0.00 196 G 9.49 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 0.00 0.00 0.00 197 G 8.04 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 4.98 0.00 2.25 2.32 0.00 3.84 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.22 0.00 199 H 9.38 4.93 0.00 3.00 3.33 0.00 5.57 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 V 8.68 4.75 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 0.87 0.00 0.00 0.52 0.00 0.00 201 T 8.85 4.85 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 1.32 0.00 0.00 202 R 8.57 4.09 0.00 0.67 1.53 0.00 3.05 0.00 0.00 3.02 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.10 0.00 203 F 8.95 4.54 0.00 3.25 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 0.00 204 K 8.18 3.93 0.00 1.77 1.68 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.72 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.84 0.21 7.81 205 D 7.56 4.70 0.00 2.61 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 0.00 206 T 7.65 4.63 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 0.77 0.00 0.00 207 Y 8.10 4.85 0.00 2.12 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 F 9.02 5.32 0.00 3.00 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 0.00 209 V 8.79 4.06 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 0.84 0.00 0.00 0.96 0.00 0.00 210 T 8.94 4.44 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 0.00 211 G 7.76 5.33 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 0.00 212 I 8.09 5.21 1.96 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 1.34 1.00 1.11 0.00 0.00 213 V 8.95 3.20 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 0.81 0.00 0.00 1.20 0.00 0.00 214 S 8.42 4.90 0.00 3.93 3.71 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 0.00 215 W 7.34 4.85 0.00 3.14 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 0.00 216 G 8.52 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 0.00 0.00 0.00 0.00 217 E 8.63 4.45 0.00 2.15 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 2.70 2.78 0.00 218 G 8.21 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 0.00 218 C 8.20 4.47 0.00 2.86 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 0.00 221 A 8.91 3.78 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 R 7.75 3.89 0.00 1.89 1.85 0.00 3.31 0.00 0.00 3.26 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 223 K 8.54 4.27 0.00 1.73 1.69 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.42 7.81 223A G 9.29 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 0.00 0.00 0.00 224 K 7.38 4.42 0.00 1.77 1.65 0.00 1.83 0.00 0.00 1.72 0.00 0.00 2.82 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.29 1.49 7.81 225 Y 7.99 4.93 0.00 2.78 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 0.00 226 G 8.51 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 0.00 227 I 7.83 4.72 1.28 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.23 0.00 0.00 228 Y 8.24 4.86 0.00 1.54 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 0.00 229 T 8.73 4.63 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 1.25 0.00 0.00 230 K 9.25 4.63 0.00 2.15 1.89 0.00 1.63 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.34 7.81 231 V 8.66 3.94 2.30 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 1.23 0.00 0.00 1.10 0.00 0.00 232 T 8.17 3.88 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 1.14 0.00 0.00 233 A 7.81 3.96 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 F 8.15 4.88 0.00 3.20 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 0.00 235 L 7.99 4.11 0.00 1.80 1.82 1.07 0.95 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 0.00 236 K 8.19 4.05 0.00 1.90 1.93 0.00 1.71 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.57 1.55 7.81 237 W 8.38 4.14 0.00 3.55 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 8.47 3.76 2.18 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.07 0.95 0.00 0.00 239 D 8.17 4.25 0.00 2.86 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 240 R 7.81 3.74 0.00 1.93 1.69 0.00 3.28 0.00 0.00 3.31 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 241 S 7.76 3.89 0.00 3.56 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 242 M 7.42 2.60 0.00 1.62 1.98 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 1.77 0.00 243 K 7.60 4.37 0.00 1.77 1.80 0.00 1.76 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.58 1.56 7.81 244 T 7.79 3.30 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 0.00 245 R 8.07 4.06 0.00 1.65 1.74 0.00 3.24 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.42 0.00 * Residues marked with a * may have inaccurate shift predictions.