NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 V 4.1280 7.9127 120.3833 62.7176 32.7706 173.7133 17 V 4.0649 8.6273 128.0979 62.0058 32.4626 174.6385 18 G 3.8337 8.7589 114.6577 46.1684 0.0000 173.4135 19 G 3.9952 7.4875 109.5154 44.1781 0.0000 172.8885 20 E 4.7425 7.8479 117.8331 54.2499 34.4456 175.0168 21 D 4.9606 8.6679 120.9197 54.4647 41.4677 176.5705 22 A 4.7003 9.0826 125.2759 51.7408 19.7456 177.1892 23 K 4.4280 9.1801 119.0344 54.2617 33.6143 175.2945 24 P 4.3061 0.0000 0.0000 64.1579 31.6217 177.1557 25 G 3.7313 8.9644 109.4636 45.8491 0.0000 174.2865 26 Q 3.5473 7.7350 121.5668 57.8836 29.5891 176.2923 27 F 3.4955 7.0339 115.6890 54.2424 39.3142 173.3709 28 P 4.3830 0.0000 0.0000 63.7154 31.8739 178.7246 29 W 5.0715 6.1873 115.3519 56.7862 29.0285 175.6418 30 Q 4.7320 7.6823 122.0166 56.3470 29.2118 175.4901 31 V 5.0202 9.1528 118.9672 59.5363 36.3277 174.6172 32 V 4.7991 8.2480 120.8943 59.9737 34.3854 174.3816 33 L 5.0391 8.3738 122.8886 53.1462 44.1278 175.1684 34 N 5.4453 9.1126 120.7909 51.1566 41.9433 173.0175 35 G 4.0330 8.8961 111.9954 45.8216 0.0000 175.8590 36 K 3.8704 8.7371 124.4804 58.7324 32.6013 176.5286 *38 V 4.5063 7.4779 117.0396 62.6328 32.3293 173.7317 39 D 4.6948 8.7040 125.5075 54.9307 42.3701 175.5817 40 A 3.7805 8.4266 126.6464 53.1470 15.6438 177.0904 41 F 4.7377 8.1200 116.5121 58.6147 40.1741 176.2803 42 C 4.8237 6.6332 115.3326 57.1021 44.9175 172.4914 43 G 4.5769 8.5112 108.4589 45.3022 0.0000 171.8943 44 G 4.7426 8.2730 105.1681 46.4067 0.0000 172.5844 45 S 5.5337 8.9965 115.2559 56.4921 67.3276 174.1175 46 I 4.2144 8.8591 124.7858 61.6712 37.3588 177.1060 47 V 3.7684 9.3626 128.4198 64.9708 32.0555 174.8955 48 N 4.9274 7.5664 114.2703 52.2991 39.3646 174.0646 49 E 4.1205 8.9730 116.0564 58.7721 29.8072 178.1523 50 K 4.4968 8.9326 117.0520 55.5612 33.8891 175.3707 51 W 5.6143 8.2331 119.3389 54.8894 33.3803 174.1667 52 I 5.1924 9.0076 124.5961 59.4742 40.0553 174.7483 53 V 4.9264 8.8901 125.8958 60.6969 34.0191 174.9485 54 T 4.8939 8.9687 117.1393 61.2827 71.3589 171.6124 55 A 4.5304 8.4692 123.0274 50.8681 20.1692 178.5714 56 A 3.7927 8.2076 125.2260 55.1559 18.4808 179.3462 57 H 4.5312 8.2757 110.6123 57.9751 28.6977 175.8472 58 C 4.6619 7.8041 116.9633 58.4990 40.9687 173.9716 59 V 4.3951 7.3536 112.0482 58.9898 31.1119 175.5663 60 E 3.8465 8.3504 119.1123 56.6746 29.2296 176.9086 61 T 3.9167 7.8541 115.0824 63.6805 67.4785 172.3988 61A G 4.0803 8.1428 122.2878 45.9582 0.0000 172.5331 61B V 3.7941 6.9826 116.3706 59.8548 32.4387 176.3267 62 K 4.2110 8.3577 123.7339 56.3401 33.0740 176.2109 63 I 5.0043 8.2147 125.4554 59.8784 41.2551 174.3423 64 T 5.0075 9.1832 121.7551 61.7436 72.2562 173.0564 65 V 4.7727 8.6537 124.3867 61.0519 34.8471 174.3976 65A V 4.7236 8.7127 127.1080 61.2397 33.9950 174.6106 66 A 5.1474 8.3783 130.2225 49.1775 21.8554 177.2990 66 G 4.7874 8.4683 115.2225 41.7775 0.0000 174.3990 70 E 4.6444 8.1961 119.5365 55.2362 30.8817 174.0017 71 H 4.9508 8.8142 122.4626 56.9174 32.0539 171.9812 72 N 5.4563 8.8923 119.5909 51.5849 39.8694 175.6046 73 I 3.6506 8.8855 128.2227 63.3148 37.2377 176.7255 74 E 4.4348 8.4933 116.6412 55.9041 30.1892 175.0735 75 E 4.6882 7.8596 118.4311 54.9044 32.7563 174.9938 76 T 4.5624 8.2080 116.4050 62.2838 68.9506 174.7126 77 E 4.2547 9.4030 125.7318 55.9079 30.6396 177.1350 78 H 4.2061 8.1849 114.6728 56.5581 26.5845 175.2105 79 T 4.3896 6.9714 109.2752 61.5294 70.0752 174.5946 80 E 4.3850 8.1098 122.3691 56.5476 30.3826 176.3430 81 Q 4.5032 8.9416 122.0681 54.2049 31.5203 174.7460 82 K 4.7828 8.6460 123.8555 55.1293 33.8045 176.4741 83 R 4.7404 8.8844 122.2512 54.6557 35.0271 173.9700 84 N 4.9983 9.0764 118.6893 52.2135 40.9379 174.3211 85 V 4.4784 8.0162 122.2451 62.1000 31.8545 175.6508 86 I 4.3290 8.5825 121.5595 61.4096 39.3042 175.8566 87 R 4.7322 7.5603 122.5611 54.9039 33.6653 173.4499 88 I 5.1151 8.4646 125.4776 59.7214 40.7078 175.1423 89 I 4.6967 9.2877 128.0807 58.7683 39.0444 173.0647 90 P 4.8372 0.0000 0.0000 62.1330 32.6751 175.7986 91 H 3.7661 8.7569 121.9542 56.5992 30.1735 176.0374 92 H 4.2613 8.4473 119.8177 58.1480 28.6697 175.6866 93 N 4.6910 7.7651 115.6480 52.7044 39.0774 174.3943 94 F 4.5497 7.9983 121.8475 59.3528 39.8900 174.3148 95 N 4.1197 8.0168 121.5434 53.2395 35.9700 175.2803 96 A 3.9499 7.8751 123.4967 54.1258 18.6078 178.2639 97 A 4.6448 7.5593 117.1479 50.2620 21.7146 174.4179 98 I 4.1752 7.8119 118.7174 60.7161 39.3909 175.1099 98A N 4.2125 8.2698 122.8545 54.2628 36.0933 175.1533 98B T 3.6039 6.6545 108.0519 61.2005 69.7508 175.1645 99 Y 3.7657 7.2591 117.0342 58.2068 35.5673 169.1005 100 N 4.4584 7.6700 118.3075 54.9745 39.5370 174.0015 101 H 4.2925 8.5485 118.4846 56.1331 26.3733 175.9304 102 D 4.5413 8.0267 118.9240 52.9214 39.5731 174.2509 103 I 4.7519 7.1786 120.7582 59.3533 42.0097 172.5575 104 A 5.4700 9.3021 128.9569 50.8583 23.3464 174.8012 105 L 5.4359 9.1572 118.9570 52.9746 45.5130 175.7676 106 L 5.2240 9.2388 122.5571 52.9991 44.8273 175.0365 107 E 3.6428 8.8908 125.6235 54.4877 31.0905 175.0660 108 L 4.8199 8.0586 127.1600 53.7728 42.6333 176.7614 109 D 4.4832 8.7710 122.3121 55.7995 39.9736 176.7563 110 E 4.7027 7.8303 116.5667 52.8984 33.1443 173.4721 111 P 4.6005 0.0000 0.0000 63.0631 31.7835 176.1853 112 L 4.2290 8.8535 122.7916 54.9442 42.7170 176.8010 113 V 4.2633 8.8076 121.9891 61.0567 32.4151 175.7000 114 L 4.4319 8.5436 128.9966 54.9726 42.6160 176.4475 115 N 4.7893 8.6213 118.4362 52.4990 39.8554 174.9861 116 S 4.0028 8.6900 113.2496 61.3668 62.7781 174.7190 117 Y 4.4177 8.6278 115.9757 57.7066 38.8372 176.1206 118 V 4.4937 7.9546 119.3781 61.3644 32.9388 173.3030 119 T 5.1263 8.6670 122.5488 60.9319 72.9397 172.2106 120 P 5.0609 0.0000 0.0000 62.6378 32.4332 175.4792 121 I 3.9347 8.2621 122.0153 60.0729 39.2409 175.2528 122 C 4.3472 7.7401 125.0827 59.4192 29.5937 173.1600 123 I 4.7134 8.1424 121.3678 59.6367 39.4514 175.5663 124 A 4.4909 8.8123 129.0139 50.8522 20.0024 176.0856 125 D 4.7188 8.1906 119.5287 52.4906 41.9656 176.9419 126 K 3.8103 8.4588 118.9949 59.7684 32.0664 177.8839 126A E 3.7213 8.0524 118.8191 59.7296 29.5326 178.3428 126B Y 3.2503 8.7369 116.6951 60.6527 37.7275 178.2644 127 T 3.7713 7.8257 117.0657 66.5322 68.5262 176.1527 128 N 4.1351 7.7684 118.5247 56.4644 38.7085 177.0126 129 I 3.4006 6.8616 120.3395 64.3192 37.5326 178.0963 130 F 3.3870 7.6602 118.9045 60.0667 38.6113 177.4485 131 L 3.7995 7.8871 120.0777 58.0481 41.6560 179.0936 132 K 4.0079 7.7395 116.6073 58.4794 31.9553 178.5802 133 F 4.7164 7.4032 117.8449 59.0589 39.0392 176.4340 134 G 3.9375 9.5946 105.5374 44.7674 0.0000 172.3476 135 S 4.7943 7.6972 113.7623 56.7063 65.2905 173.0653 136 G 4.1921 8.7542 112.9654 44.9232 0.0000 170.2021 137 Y 5.2344 9.0986 117.4020 56.1799 40.7787 175.8134 138 V 5.2371 9.1212 115.7483 58.8996 35.7770 174.7378 139 S 4.8519 8.1764 116.1567 56.6081 66.2123 173.2779 140 G 3.8504 7.2776 108.0846 46.0502 0.0000 172.5412 141 W 4.5816 8.4515 117.0026 56.6326 30.0619 177.9173 142 G 4.0184 8.4582 109.8384 45.6504 0.0000 173.4727 143 R 4.5681 8.3503 118.9646 56.3715 30.3229 177.8078 144 V 4.5718 8.4818 114.2678 60.5342 32.7326 176.0399 145 F 4.6979 7.3810 118.2834 56.1698 42.9216 172.7221 143 H 4.9581 8.5403 116.6646 55.3715 28.4229 175.6078 144 K 4.7718 8.7418 115.4678 54.5342 32.9326 176.3399 145 G 4.0379 7.4110 106.7834 43.5698 0.0000 171.8221 150 R 4.2794 8.4333 115.1929 56.3022 30.2650 176.7549 151 S 4.8074 8.5644 116.0039 58.0025 64.1895 173.8214 152 A 4.2854 8.2465 123.6569 52.2752 18.7283 177.8900 153 L 4.3268 8.7826 120.9612 56.9720 43.2970 176.9452 154 V 4.7693 7.6503 117.3596 60.7628 33.1800 175.4088 155 L 2.7731 8.3297 129.3910 55.8504 42.9044 175.8173 156 Q 5.2778 8.2897 124.4863 54.4619 31.9581 174.0979 157 Y 5.2828 8.6964 119.0335 55.8128 42.2835 173.6435 158 L 4.7107 8.8811 120.8422 53.9924 46.2056 173.8824 159 R 4.3185 8.6135 126.6625 55.5255 31.3150 175.6957 160 V 4.4088 8.6692 119.6449 58.7169 35.6209 173.2771 161 P 4.7310 0.0000 0.0000 61.9993 32.8260 175.3963 162 L 4.2267 8.4209 125.0857 55.2960 42.8288 176.0551 163 V 4.2178 7.9459 125.0798 60.5507 33.4666 175.0726 164 D 4.3728 8.5900 126.9535 54.1858 42.0879 176.5551 165 R 3.8875 8.9219 125.1881 59.9276 29.8767 178.6163 166 A 4.0187 8.3700 120.1292 55.5130 18.1559 179.7931 167 T 3.9410 7.7756 112.8411 67.0261 68.7745 176.7232 168 C 4.2768 8.2737 120.4174 59.6525 41.8471 175.2982 169 L 3.9752 8.7921 120.3767 58.2316 41.2716 179.8175 170 R 4.1280 8.3640 117.0610 58.5011 30.1152 177.7137 171 S 4.5405 8.1956 112.5693 59.0976 63.7499 173.4870 172 T 4.7147 6.8239 114.7347 60.9293 70.3556 173.4875 173 K 4.1139 8.3234 124.3076 58.2148 32.5814 177.9278 174 F 4.6223 8.0015 117.7296 57.0703 39.5910 175.2477 175 T 4.1749 8.5780 120.4346 63.4838 68.8381 174.3860 176 I 4.5213 8.4300 127.8441 59.8807 38.0924 175.7764 177 T 4.4170 8.3282 116.6164 60.3682 70.0838 174.9343 178 N 4.6506 8.5953 117.3002 54.4143 37.7092 175.1203 179 N 4.9246 8.1913 116.4786 53.5004 38.8086 173.8656 180 M 5.6110 7.9352 116.9684 53.8466 36.4075 174.3395 181 F 5.1167 8.7235 114.2717 55.8423 42.2400 172.5427 182 C 5.5197 8.9288 116.3102 55.6106 37.3730 172.7280 183 A 5.0501 9.0811 122.6803 50.4872 22.7922 176.8367 184 G 4.5395 7.2636 107.4139 44.3186 0.0000 172.0813 184A F 4.8726 8.3172 117.8867 55.6540 39.8150 177.0096 185 H 4.4562 8.8862 120.9250 58.9552 28.6818 176.8775 186 E 3.8680 8.3917 116.0256 55.8109 30.1675 177.8175 187 G 3.7524 8.2053 108.1623 45.3568 0.0000 172.7860 188 G 4.0678 9.0657 106.9737 44.9695 0.0000 173.9994 188A R 4.8386 7.2012 116.9858 54.6693 33.4800 174.1937 189 D 4.6455 8.6921 121.6862 53.5762 45.6235 175.1462 190 S 4.7872 8.8098 117.5187 58.5477 64.8916 172.9339 191 C 4.7308 9.0853 118.6286 55.4908 46.4613 172.4816 192 Q 4.3220 8.4971 119.1863 57.8764 28.5960 176.9987 193 G 4.1512 9.1895 110.0235 45.1511 0.0000 174.7146 194 D 4.5512 8.1847 118.3967 55.2809 41.6972 176.7357 195 S 4.5203 7.9381 115.3871 60.3137 63.5476 175.3404 196 G 4.2096 8.7585 111.9408 46.5674 0.0000 173.9845 197 G 4.2932 7.8609 107.0617 45.4532 0.0000 171.1552 198 P 5.2433 0.0000 0.0000 62.3944 33.5930 174.2863 199 H 5.1684 9.2599 122.3361 54.8729 31.7369 173.7741 200 V 5.0844 9.0191 118.7983 59.8642 36.0661 174.6656 201 T 4.9578 8.8570 119.5377 61.7669 71.5142 172.7945 202 E 4.5562 9.0983 128.1340 55.4852 30.8363 175.8857 203 V 4.1234 9.2075 127.9974 61.5765 32.4746 175.0644 204 E 3.5951 9.7441 130.0835 57.4551 26.6512 176.1889 205 G 3.9469 8.3623 104.6628 45.4318 0.0000 172.8816 206 T 4.5055 7.6541 117.1596 61.7024 71.2717 173.4319 207 S 4.8812 8.2782 122.5994 57.5737 64.7470 173.0865 208 F 4.9853 8.8309 122.8367 55.1704 42.2251 174.4133 209 L 4.4979 8.8754 126.3251 55.6087 41.6588 176.4131 210 T 4.6443 9.1883 116.5392 61.8985 71.3981 173.6723 211 G 4.8361 7.8773 107.9261 46.8246 0.0000 171.9011 212 I 5.1956 8.1342 119.7903 58.9654 40.6782 175.4635 213 I 3.5824 8.8328 128.2966 62.3902 37.4244 174.6616 214 S 4.6443 8.2916 119.6661 58.5917 64.2808 173.6857 215 W 4.7390 7.3485 114.0658 55.9342 31.9325 171.9823 216 G 3.9140 7.9364 105.6362 46.5369 0.0000 172.3904 217 E 4.6825 8.8135 119.4909 54.6365 31.0863 175.4167 217 E 4.6825 8.8135 119.4909 54.6365 31.0863 175.4167 220 C 4.9230 7.9493 115.7382 57.5852 44.3096 173.5490 221 A 4.3866 9.0657 124.5027 53.1853 16.8073 176.4329 221A M 4.4859 7.2084 117.6757 55.5111 33.2814 175.5068 222 K 4.0759 8.3508 126.7337 57.9051 32.7143 177.0042 223 G 3.8866 8.1551 115.1913 44.8352 0.0000 173.1891 224 K 4.5067 7.0313 117.8259 54.7562 34.6459 174.7867 225 Y 4.9396 7.9257 117.1122 56.0400 42.3727 175.3781 226 G 3.6672 8.8140 108.3162 46.3630 0.0000 172.5836 227 I 4.6275 7.7739 123.9185 59.2237 39.7700 174.3919 228 Y 4.8158 8.1014 123.2491 55.9729 42.0004 175.0314 229 T 4.5123 8.7069 120.1640 63.3575 70.1017 174.2942 230 K 4.5294 9.4812 128.7524 55.4511 31.4467 177.2693 231 V 3.9970 8.5196 126.8904 65.6677 31.8460 178.3592 232 S 4.2684 8.3276 113.6176 61.4512 62.5804 175.7466 233 R 3.8868 7.7381 117.7201 57.8182 30.0796 176.5482 234 Y 4.8334 8.3302 114.4708 57.1639 39.6020 177.6114 235 V 3.7947 7.9600 120.6352 65.9826 31.5865 177.3987 236 N 4.3502 8.2602 115.9476 56.0261 38.5204 176.9131 237 W 4.1973 8.3686 129.1653 60.5825 31.0687 177.7932 238 I 3.2419 8.2804 119.8672 64.3907 36.3505 178.6706 239 K 3.9235 8.0350 118.1529 59.2192 31.9019 178.8176 240 E 3.9509 8.0534 119.0498 58.6813 29.5988 178.3064 241 K 3.9188 7.2157 116.8110 57.3018 32.3969 178.0054 242 T 2.7278 6.4893 107.8865 59.8270 69.3883 174.8700 243 K 4.0619 7.2171 120.6647 56.8866 32.7287 176.2891 244 L 4.7182 8.2711 122.4554 53.5951 43.4919 176.6045 245 T 4.1726 8.3838 115.1176 62.2389 67.4211 173.9027 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 V 7.91 4.13 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.94 0.00 0.00 17 V 8.63 4.06 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 0.85 0.00 0.00 0.92 0.00 0.00 18 G 8.76 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 7.49 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 20 E 7.85 4.74 0.00 1.41 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 2.12 2.07 0.00 21 D 8.67 4.96 0.00 2.64 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 22 A 9.08 4.70 1.38 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 0.00 0.00 23 K 9.18 4.43 0.00 1.66 1.66 0.00 1.59 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.38 7.81 24 P 0.00 4.31 0.00 2.09 1.96 0.00 3.70 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 1.94 1.62 0.00 25 G 8.96 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 7.73 3.55 0.00 1.75 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.70 7.14 0.00 0.00 0.00 0.00 0.00 1.16 1.60 0.00 27 F 7.03 3.50 0.00 2.80 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.38 0.00 2.17 2.19 0.00 2.20 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.65 0.00 29 W 6.19 5.07 0.00 3.63 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 30 Q 7.68 4.73 0.00 2.08 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.74 0.00 0.00 0.00 0.00 0.00 2.20 2.72 0.00 31 V 9.15 5.02 2.23 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 0.99 0.00 0.00 1.04 0.00 0.00 32 V 8.25 4.80 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 0.00 0.00 0.27 0.00 0.00 0.62 0.00 0.00 33 L 8.37 5.04 0.00 0.71 1.36 0.80 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.11 5.45 0.00 2.61 2.70 0.00 0.00 6.42 7.33 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 35 G 8.90 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 36 K 8.74 3.87 0.00 1.69 1.65 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.74 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.44 1.38 7.81 *38 V 7.48 4.51 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 1.35 0.00 0.00 0.87 0.00 0.00 39 D 8.70 4.69 0.00 2.69 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.43 3.78 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 41 F 8.12 4.74 0.00 3.17 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 42 C 6.63 4.82 0.00 2.03 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 8.51 4.58 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 0.00 0.00 0.00 44 G 8.27 4.74 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 45 S 9.00 5.53 0.00 3.85 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 46 I 8.86 4.21 2.05 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.85 1.08 0.00 0.00 47 V 9.36 3.77 2.38 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 0.79 0.00 0.00 1.01 0.00 0.00 48 N 7.57 4.93 0.00 3.02 2.97 0.00 0.00 6.20 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 49 E 8.97 4.12 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 50 K 8.93 4.50 0.00 1.91 1.45 0.00 1.48 0.00 0.00 1.59 0.00 0.00 2.83 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.33 1.51 7.81 51 W 8.23 5.61 0.00 3.27 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 52 I 9.01 5.19 1.94 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.16 1.05 0.00 0.00 53 V 8.89 4.93 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.15 0.00 0.00 54 T 8.97 4.89 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 55 A 8.47 4.53 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 56 A 8.21 3.79 0.22 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 57 H 8.28 4.53 0.00 3.42 3.64 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 7.80 4.66 0.00 3.18 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 59 V 7.35 4.40 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 1.04 0.00 0.00 60 E 8.35 3.85 0.00 2.17 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 61 T 7.85 3.92 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 61A G 8.14 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 61B V 6.98 3.79 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 0.62 0.00 0.00 0.87 0.00 0.00 62 K 8.36 4.21 0.00 1.71 1.70 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.46 7.81 63 I 8.21 5.00 1.93 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 1.54 1.12 1.02 0.00 0.00 64 T 9.18 5.01 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 1.25 0.00 0.00 65 V 8.65 4.77 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 1.01 0.00 0.00 0.92 0.00 0.00 65A V 8.71 4.72 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.84 0.00 0.00 66 A 8.38 5.15 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 66 G 8.47 4.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.20 4.64 0.00 1.80 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 1.51 2.05 0.00 71 H 8.81 4.95 0.00 3.22 3.44 0.00 5.68 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 72 N 8.89 5.46 0.00 2.80 2.87 0.00 0.00 7.36 8.63 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 73 I 8.89 3.65 1.76 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.06 0.79 0.00 0.00 74 E 8.49 4.43 0.00 2.05 2.05 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 2.51 2.26 0.00 75 E 7.86 4.69 0.00 2.00 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 2.22 2.24 0.00 76 T 8.21 4.56 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 0.94 0.00 0.00 77 E 9.40 4.25 0.00 1.93 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 0.00 2.23 2.28 0.00 78 H 8.18 4.21 0.00 3.28 3.36 0.00 5.61 0.00 0.00 0.00 0.00 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 T 6.97 4.39 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 0.18 0.00 0.00 80 E 8.11 4.39 0.00 1.80 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.52 0.00 81 Q 8.94 4.50 0.00 1.89 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.75 0.00 0.00 0.00 0.00 0.00 2.24 2.35 0.00 82 K 8.65 4.78 0.00 1.60 1.70 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.79 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.41 7.81 83 R 8.88 4.74 0.00 1.63 1.70 0.00 3.46 0.00 0.00 3.14 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.71 0.00 84 N 9.08 5.00 0.00 2.75 2.69 0.00 0.00 6.80 7.30 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 85 V 8.02 4.48 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.96 0.00 0.00 86 I 8.58 4.33 1.81 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.65 0.85 0.00 0.00 87 R 7.56 4.73 0.00 1.83 1.62 0.00 3.24 0.00 0.00 3.40 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.74 0.00 88 I 8.46 5.12 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.82 1.00 0.00 0.00 89 I 9.29 4.70 2.04 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 1.45 1.03 1.17 0.00 0.00 90 P 0.00 4.84 0.00 2.19 2.10 0.00 3.93 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.07 0.00 91 H 8.76 3.77 0.00 2.59 3.07 0.00 5.79 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.45 4.26 0.00 3.27 3.46 0.00 5.76 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 N 7.77 4.69 0.00 2.35 2.68 0.00 0.00 6.81 8.13 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 94 F 8.00 4.55 0.00 3.11 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 95 N 8.02 4.12 0.00 2.71 2.69 0.00 0.00 7.25 7.35 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 96 A 7.88 3.95 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 A 7.56 4.64 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 I 7.81 4.18 1.76 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 1.28 1.28 0.80 0.00 0.00 98A N 8.27 4.21 0.00 2.59 2.46 0.00 0.00 6.95 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 98B T 6.65 3.60 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 99 Y 7.26 3.77 0.00 2.74 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 0.00 100 N 7.67 4.46 0.00 2.60 2.68 0.00 0.00 7.14 8.73 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 0.00 101 H 8.55 4.29 0.00 3.44 3.17 0.00 5.80 0.00 0.00 0.00 0.00 8.03 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 4.54 0.00 3.14 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.18 4.75 1.52 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 1.49 1.22 0.03 0.00 0.00 104 A 9.30 5.47 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 0.00 105 L 9.16 5.44 0.00 1.64 1.78 -0.30 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 106 L 9.24 5.22 0.00 1.57 1.53 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 107 E 8.89 3.64 0.00 1.16 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 1.64 1.47 0.00 108 L 8.06 4.82 0.00 1.39 1.47 0.95 0.85 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 0.00 109 D 8.77 4.48 0.00 2.63 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 E 7.83 4.70 0.00 1.89 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 0.00 2.17 2.18 0.00 111 P 0.00 4.60 0.00 2.07 2.06 0.00 3.75 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 112 L 8.85 4.23 0.00 1.53 1.67 0.96 0.92 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 0.00 113 V 8.81 4.26 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 0.78 0.00 0.00 0.94 0.00 0.00 114 L 8.54 4.43 0.00 1.70 1.70 0.95 1.12 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 0.00 115 N 8.62 4.79 0.00 2.97 2.96 0.00 0.00 6.80 6.53 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 0.00 116 S 8.69 4.00 0.00 3.45 3.44 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 0.00 0.00 0.00 0.00 117 Y 8.63 4.42 0.00 3.03 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 0.00 118 V 7.95 4.49 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 1.05 0.00 0.00 1.07 0.00 0.00 119 T 8.67 5.13 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 1.32 0.00 0.00 120 P 0.00 5.06 0.00 1.97 2.24 0.00 3.73 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 121 I 8.26 3.93 1.59 0.00 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.29 0.92 0.00 0.00 122 C 7.74 4.35 0.00 1.78 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 0.00 0.00 0.00 0.00 123 I 8.14 4.71 1.93 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.77 1.01 0.00 0.00 124 A 8.81 4.49 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 0.00 125 D 8.19 4.72 0.00 2.97 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 0.00 126 K 8.46 3.81 0.00 1.82 1.81 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.80 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.60 7.81 126A E 8.05 3.72 0.00 1.95 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 1.86 2.13 0.00 126B Y 8.74 3.25 0.00 2.87 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 0.00 0.00 0.00 127 T 7.83 3.77 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 1.29 0.00 0.00 128 N 7.77 4.14 0.00 2.69 2.75 0.00 0.00 7.23 8.73 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 0.00 129 I 6.86 3.40 1.24 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.34 0.60 0.00 0.00 130 F 7.66 3.39 0.00 2.89 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 0.00 131 L 7.89 3.80 0.00 1.68 1.53 0.33 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 132 K 7.74 4.01 0.00 1.83 1.82 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.37 1.47 7.81 133 F 7.40 4.72 0.00 3.13 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 0.00 134 G 9.59 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 0.00 135 S 7.70 4.79 0.00 3.79 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 G 8.75 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 0.00 0.00 0.00 137 Y 9.10 5.23 0.00 3.11 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 V 9.12 5.24 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.08 0.00 0.00 139 S 8.18 4.85 0.00 3.38 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 0.00 140 G 7.28 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 0.00 0.00 0.00 141 W 8.45 4.58 0.00 3.28 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 0.00 142 G 8.46 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 0.00 143 R 8.35 4.57 0.00 1.72 2.15 0.00 3.23 0.00 0.00 3.42 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.62 0.00 144 V 8.48 4.57 1.65 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 1.04 0.00 0.00 0.96 0.00 0.00 145 F 7.38 4.70 0.00 3.08 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 0.00 143 H 8.54 4.96 0.00 3.15 3.55 0.00 8.61 0.00 0.00 0.00 0.00 5.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.74 4.77 0.00 1.83 1.64 0.00 0.98 0.00 0.00 1.56 0.00 0.00 2.13 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.38 1.21 7.81 145 G 7.41 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 R 8.43 4.28 0.00 1.90 2.02 0.00 3.11 0.00 0.00 3.30 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.79 0.00 151 S 8.56 4.81 0.00 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 0.00 152 A 8.25 4.29 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 L 8.78 4.33 0.00 1.68 1.78 1.05 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 154 V 7.65 4.77 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 0.68 0.00 0.00 0.97 0.00 0.00 155 L 8.33 2.77 0.00 1.04 1.29 -0.52 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 156 Q 8.29 5.28 0.00 1.97 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.45 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 157 Y 8.70 5.28 0.00 2.83 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 0.00 158 L 8.88 4.71 0.00 1.69 1.50 0.90 0.90 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 0.00 159 R 8.61 4.32 0.00 1.49 1.77 0.00 3.21 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.13 0.00 160 V 8.67 4.41 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 0.99 0.00 0.00 0.87 0.00 0.00 161 P 0.00 4.73 0.00 1.85 1.89 0.00 2.72 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.12 0.00 162 L 8.42 4.23 0.00 1.50 1.50 0.72 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 163 V 7.95 4.22 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 0.22 0.00 0.00 0.30 0.00 0.00 164 D 8.59 4.37 0.00 2.67 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 R 8.92 3.89 0.00 1.91 1.94 0.00 3.25 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.76 0.00 166 A 8.37 4.02 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 0.00 167 T 7.78 3.94 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 1.33 0.00 0.00 168 C 8.27 4.28 0.00 3.09 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 L 8.79 3.98 0.00 1.97 1.77 1.00 0.89 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 0.00 170 R 8.36 4.13 0.00 2.13 2.12 0.00 3.28 0.00 0.00 3.30 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 171 S 8.20 4.54 0.00 4.40 4.38 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 0.00 172 T 6.82 4.71 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 173 K 8.32 4.11 0.00 1.21 1.62 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.74 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.25 1.20 7.81 174 F 8.00 4.62 0.00 3.47 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 0.00 175 T 8.58 4.17 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 176 I 8.43 4.52 1.99 0.00 0.00 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 1.65 0.93 1.01 0.00 0.00 177 T 8.33 4.42 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 1.26 0.00 0.00 178 N 8.60 4.65 0.00 2.86 3.00 0.00 0.00 5.93 8.04 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 0.00 179 N 8.19 4.92 0.00 3.06 3.11 0.00 0.00 6.66 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 0.00 180 M 7.94 5.61 0.00 1.94 2.13 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.67 0.00 181 F 8.72 5.12 0.00 3.05 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 0.00 182 C 8.93 5.52 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 0.00 183 A 9.08 5.05 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 0.00 184 G 7.26 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184A F 8.32 4.87 0.00 3.14 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 H 8.89 4.46 0.00 3.32 3.44 0.00 5.61 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 0.00 186 E 8.39 3.87 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.29 0.00 187 G 8.21 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 0.00 0.00 0.00 188 G 9.07 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 188A R 7.20 4.84 0.00 1.52 1.78 0.00 2.83 0.00 0.00 2.85 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.37 0.00 189 D 8.69 4.65 0.00 2.80 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 0.00 190 S 8.81 4.79 0.00 3.93 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 0.00 191 C 9.09 4.73 0.00 2.93 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 0.00 192 Q 8.50 4.32 0.00 2.12 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.34 0.00 0.00 0.00 0.00 0.00 2.41 2.35 0.00 193 G 9.19 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.18 4.55 0.00 2.90 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 0.00 195 S 7.94 4.52 0.00 3.90 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 0.00 196 G 8.76 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 0.00 0.00 0.00 0.00 197 G 7.86 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 0.00 198 P 0.00 5.24 0.00 2.27 2.35 0.00 3.89 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 199 H 9.26 5.17 0.00 3.28 3.44 0.00 5.72 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 V 9.02 5.08 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 0.64 0.00 0.00 1.19 0.00 0.00 201 T 8.86 4.96 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 202 E 9.10 4.56 0.00 2.11 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 203 V 9.21 4.12 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 0.90 0.00 0.00 0.04 0.00 0.00 204 E 9.74 3.60 0.00 2.15 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 205 G 8.36 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 0.00 206 T 7.65 4.51 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 207 S 8.28 4.88 0.00 2.84 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 F 8.83 4.99 0.00 2.91 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 0.00 209 L 8.88 4.50 0.00 1.63 1.68 1.10 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 210 T 9.19 4.64 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 1.32 0.00 0.00 211 G 7.88 4.84 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 0.00 212 I 8.13 5.20 1.92 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 1.45 0.94 0.95 0.00 0.00 213 I 8.83 3.58 2.02 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 1.41 1.06 0.84 0.00 0.00 214 S 8.29 4.64 0.00 3.83 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 0.00 215 W 7.35 4.74 0.00 2.87 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 G 7.94 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 E 8.81 4.68 0.00 2.05 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 2.58 2.67 0.00 217 E 8.81 4.68 0.00 2.05 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 2.58 2.67 0.00 220 C 7.95 4.92 0.00 2.96 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 0.00 221 A 9.07 4.39 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 221A M 7.21 4.49 0.00 1.94 1.87 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 2.53 2.48 0.00 222 K 8.35 4.08 0.00 1.84 1.68 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.64 7.81 223 G 8.16 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 0.00 224 K 7.03 4.51 0.00 1.79 1.63 0.00 1.70 0.00 0.00 1.79 0.00 0.00 2.84 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.31 1.49 7.81 225 Y 7.93 4.94 0.00 2.77 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 0.00 226 G 8.81 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 I 7.77 4.63 0.56 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.11 -0.36 0.51 0.00 0.00 228 Y 8.10 4.82 0.00 1.43 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 0.00 0.00 0.00 0.00 229 T 8.71 4.51 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 230 K 9.48 4.53 0.00 2.02 1.91 0.00 1.82 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.53 1.55 7.81 231 V 8.52 4.00 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 0.92 0.00 0.00 1.09 0.00 0.00 232 S 8.33 4.27 0.00 4.10 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 0.00 233 R 7.74 3.89 0.00 0.96 1.47 0.00 3.14 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 234 Y 8.33 4.83 0.00 3.09 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 0.00 235 V 7.96 3.79 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 1.26 0.00 0.00 1.15 0.00 0.00 236 N 8.26 4.35 0.00 2.94 2.92 0.00 0.00 6.79 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 0.00 237 W 8.37 4.20 0.00 3.53 3.63 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 0.00 238 I 8.28 3.24 2.08 0.00 0.00 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 1.66 1.48 0.86 0.00 0.00 239 K 8.04 3.92 0.00 1.82 1.83 0.00 1.72 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.57 7.81 240 E 8.05 3.95 0.00 1.92 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.30 0.00 241 K 7.22 3.92 0.00 0.86 1.09 0.00 1.53 0.00 0.00 1.52 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.89 0.43 7.81 242 T 6.49 2.73 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 243 K 7.22 4.06 0.00 1.71 1.76 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.38 1.53 7.81 244 L 8.27 4.72 0.00 1.67 1.64 1.00 1.02 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 0.00 245 T 8.38 4.17 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 1.24 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.