NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.2804 8.1133 120.8656 56.1357 31.1450 174.0017 2 I 4.6643 8.3027 126.4993 58.5526 38.7382 173.5710 3 T 4.9263 9.4244 115.4903 60.0980 73.3533 172.5132 4 L 5.4961 8.4850 121.6105 53.2748 46.6627 175.3159 5 K 4.7768 8.8125 122.1120 55.2745 35.8479 174.8989 6 E 5.1923 8.9872 127.0991 56.0146 30.8371 175.7936 7 S 4.7103 9.7827 117.1250 56.4029 67.1558 174.3165 8 G 3.9747 8.0855 107.7341 44.8665 0.0000 169.7703 9 P 4.4624 0.0000 0.0000 61.9127 32.1689 174.7234 10 P 4.6661 0.0000 0.0000 64.7008 32.7374 175.6946 11 L 5.4004 7.8467 119.2093 52.9056 44.8858 176.1980 12 V 4.5454 8.9564 122.0938 61.3486 35.6638 173.9354 13 K 4.9251 8.4024 124.8745 53.5204 34.1437 174.5706 14 P 4.6144 0.0000 0.0000 64.4875 31.9317 177.4500 15 T 3.4883 9.1141 110.1354 62.3321 69.3548 172.0581 16 Q 4.3233 7.7546 121.3847 56.0578 30.5068 174.6933 17 T 4.8103 8.2188 116.7400 62.0475 70.3512 174.1480 18 L 4.5563 8.9886 128.6163 53.5122 44.3887 174.9016 19 T 4.8033 8.4140 122.6471 61.7170 70.8269 173.3700 20 L 4.8546 8.7318 126.7682 53.0569 45.0217 175.5855 21 T 5.1557 9.0411 119.7660 61.9361 71.7681 172.2415 22 C 5.3518 9.8237 126.6480 55.1786 44.6622 172.3727 23 S 5.2663 9.0359 123.3447 56.7664 64.9410 173.4894 24 F 5.4998 7.7650 118.6023 55.4000 41.5704 173.5413 25 S 4.5157 9.1266 112.4783 57.7868 66.2509 175.2914 26 G 4.0548 11.0723 108.7734 46.5486 0.0000 172.8515 27 F 4.9096 7.1625 112.0728 56.0462 40.6218 172.9529 28 S 4.8524 9.7723 115.3681 56.5079 64.8806 173.6864 29 L 4.6933 8.7896 126.7426 55.5215 41.5495 177.6938 30 S 4.8359 7.6131 109.1288 57.7245 63.8936 174.1877 31 D 4.6254 8.2446 122.5177 53.7236 41.2574 175.5000 32 F 4.0233 8.9622 124.1467 59.8566 39.5414 174.9873 33 G 3.4554 8.0996 114.1573 45.8603 0.0000 173.3745 34 V 3.7906 7.2529 119.8766 62.7630 32.7564 175.1754 35 G 4.1234 8.6032 112.0685 44.2660 0.0000 171.5386 35A V 4.5468 8.3717 120.1806 60.7851 34.9047 174.6922 35B G 4.3481 8.7491 114.0258 44.0473 0.0000 171.1014 36 W 5.3587 8.6809 118.6573 54.8090 32.8916 175.1881 37 I 5.3021 9.4213 124.1379 59.6470 41.3586 174.4036 38 R 4.9666 9.2955 121.2385 54.6652 33.5000 174.6195 39 Q 4.6057 8.9002 121.1937 54.2252 31.4301 172.2898 40 P 4.7424 0.0000 0.0000 61.1643 32.2121 174.5780 41 P 4.3745 0.0000 0.0000 64.5983 31.1940 177.1152 42 G 3.9089 8.8828 109.1809 45.7361 0.0000 173.0820 43 K 4.3985 7.9714 119.1717 54.4424 34.2582 175.6056 44 A 4.3977 8.1398 122.6677 51.6969 19.2281 177.0512 45 L 4.5996 8.1843 119.3697 54.8684 42.8501 176.6875 46 E 4.7619 9.3102 123.1440 54.0312 32.7089 174.5246 47 W 4.6054 9.2554 135.0000 57.8704 31.2512 174.8148 48 L 4.4848 7.7872 125.6440 55.4778 43.8265 176.0608 49 A 3.7727 6.0963 117.2627 51.5708 22.4021 174.5501 50 I 4.6886 7.6375 117.9112 59.9501 42.0851 173.2795 51 I 4.9094 8.5975 126.7417 59.5239 41.5663 173.8262 52 Y 5.1392 8.5657 125.8962 55.9480 40.4270 177.1067 53 S 4.5205 9.1141 115.5856 60.8589 63.0717 175.0878 54 D 4.5549 8.0942 118.0906 53.1797 39.2931 175.8849 55 D 4.6021 8.4644 118.0114 55.1072 40.4224 173.2382 56 D 4.6347 8.3871 117.2383 53.7452 41.8422 175.0825 57 K 5.1645 8.3855 123.5368 54.8579 35.9580 175.7286 58 R 4.8175 8.3855 120.8392 55.0051 34.8402 173.7691 59 Y 5.2577 8.6094 118.4644 55.7772 42.4974 175.2076 60 S 4.5342 9.0437 117.3727 58.5667 62.8852 173.7190 61 P 4.3858 0.0000 0.0000 65.6945 31.3878 177.8445 62 S 4.2653 8.2395 111.4078 60.3199 62.5356 174.1961 63 L 4.6944 7.4492 116.4674 53.8753 43.0490 177.4276 64 N 4.0302 8.2964 119.2499 56.9384 38.7924 176.9614 65 T 3.8183 7.8657 105.7179 63.9741 68.9844 174.5945 66 R 4.4999 8.0669 119.8238 55.1611 31.6170 175.7721 67 L 5.1174 7.3767 119.3833 53.1955 44.1717 176.2017 68 T 4.7027 8.7947 118.5921 61.8313 72.3417 172.7074 69 I 5.0533 9.2373 126.7250 59.6775 40.6997 174.2579 70 T 4.9514 9.1933 122.1326 60.6360 71.3344 172.1886 71 K 5.1051 8.6456 123.2258 55.2487 36.2869 175.5597 72 D 4.6735 9.4039 121.1129 52.4116 42.0007 175.9322 73 T 3.9745 8.6002 121.8267 66.5401 68.8474 177.0545 74 S 4.1871 8.0951 115.3469 60.6409 63.0349 174.9595 75 K 4.1714 8.1167 117.5437 55.3138 32.8415 175.7905 76 N 3.5304 7.5488 116.3482 54.0836 36.4997 173.3040 77 Q 4.9664 7.7625 114.8638 54.2149 34.4043 175.9911 78 V 4.9383 9.0577 120.9515 61.2639 35.0362 174.3253 79 V 5.0543 9.0753 127.4749 61.0159 34.6730 173.7516 80 L 4.9897 8.6969 129.0451 53.1270 44.8245 174.8747 81 V 4.6257 8.8485 126.7958 61.2454 34.0367 173.6533 82 M 5.1024 9.2900 128.8346 53.9986 34.3821 175.0731 82A T 4.5007 8.7936 116.5979 59.6311 71.8149 174.3405 82B R 3.9668 8.0623 117.9355 56.1972 27.8020 177.0198 82C V 4.0543 7.8466 111.3420 61.3571 32.8025 176.1163 83 S 4.9832 9.0792 116.0271 55.6308 66.4287 173.1323 84 P 4.4474 0.0000 0.0000 65.1476 30.9589 179.1694 85 V 3.7540 7.2670 108.2311 63.5188 31.4057 176.4893 86 D 4.7442 8.2557 119.3328 54.5585 40.9223 176.5566 87 T 4.2131 7.9872 111.4150 61.7037 69.3786 173.5223 88 A 4.4194 8.4858 125.7951 51.8263 23.7437 174.6292 89 T 4.6569 8.3607 116.5579 62.8530 70.2676 173.9493 90 Y 4.8879 9.0793 124.5743 56.3427 40.2834 174.7547 91 F 5.6831 9.9590 123.4551 55.8634 42.6171 172.2203 92 C 4.6137 9.1974 116.7430 53.8253 43.6325 172.3615 93 A 4.6656 7.9840 120.2082 50.8659 22.5644 174.9050 94 H 4.5371 8.7984 120.5530 55.2343 31.8214 174.1051 95 R 4.5407 7.9485 124.8357 54.1597 32.9273 175.0829 96 R 4.1365 8.5463 125.1312 56.3778 31.5906 176.2690 97 G 3.9986 8.2283 108.8033 43.9364 0.0000 171.5088 98 P 4.7251 0.0000 0.0000 62.7569 32.1080 177.0884 99 T 4.2736 8.8346 119.9760 63.9544 69.5109 173.6610 100 T 5.0449 8.4364 114.4162 59.8978 72.2859 173.1356 100A L 4.2116 8.7512 124.3198 54.1576 44.6328 176.6761 100B F 3.6877 8.7859 126.6688 59.1938 36.4503 175.2462 100C G 3.9176 7.9517 100.0637 46.5973 0.0000 173.5288 100D V 4.2332 7.5874 117.9357 59.4822 34.2197 172.5884 100E P 4.7933 0.0000 0.0000 62.9854 31.4561 175.9454 100F I 4.4557 8.7251 114.9431 59.9062 39.3526 175.3781 100G A 4.5587 7.7881 124.1595 50.6345 21.4304 176.1925 100H R 4.4035 8.6093 118.9470 56.2725 31.0465 178.5021 100I G 3.7528 8.2440 108.5751 48.4718 0.0000 173.7022 100J P 4.3774 0.0000 0.0000 64.4912 31.3990 177.5312 100K V 4.0164 7.6394 110.0269 62.0628 32.2383 176.6637 100L N 4.5939 7.8433 119.8952 49.6979 36.8921 173.8943 100M A 4.3422 6.6850 123.2029 52.4787 21.6641 176.3147 100N M 4.4668 8.5018 119.8274 53.6648 32.5596 176.1664 101 D 4.6236 8.3442 124.8352 55.0418 40.4103 177.0812 102 V 4.6742 7.5729 119.1416 60.8902 34.8509 174.2147 103 W 5.1615 9.1487 126.5625 54.8234 32.1741 175.5169 104 G 4.3564 8.6450 110.1484 45.0814 0.0000 174.1488 105 Q 4.2958 8.8663 118.2961 57.4945 28.7691 178.0172 106 G 3.8225 9.1559 105.1761 45.0961 0.0000 172.3219 107 I 4.5688 8.5091 121.7243 59.0888 41.0608 174.3642 108 T 4.5988 8.6422 126.3554 63.1688 69.3882 174.1124 109 V 4.6617 9.0519 126.7063 61.3592 34.6644 174.0731 110 T 4.9736 9.2672 124.7171 61.8967 71.4537 173.2406 111 I 5.3521 8.2755 126.7867 59.3516 38.8661 174.4580 112 S 4.7408 8.3257 120.8152 57.1341 65.5249 174.7693 113 S 4.4513 8.5476 119.2053 58.8286 63.5861 174.6663 114 T 3.7611 6.9747 118.6126 63.8488 68.5711 174.1039 115 S 4.7240 8.0431 120.3400 57.0891 64.6764 174.1362 116 T 4.4410 8.3449 118.2856 64.9491 68.8649 173.6686 117 K 4.5597 9.5909 125.4443 55.3319 36.5137 175.1804 118 G 4.4158 9.0834 114.4988 44.4648 0.0000 171.1671 119 P 5.3020 0.0000 0.0000 62.1546 32.6285 175.5210 120 S 4.5839 8.4845 116.7358 57.0738 65.1473 173.0917 121 V 4.4474 7.6672 123.1983 60.2279 32.8643 174.5766 122 F 5.3376 8.4167 125.6319 54.8715 42.6842 172.8214 123 P 4.7313 0.0000 0.0000 62.7595 33.0724 175.1968 124 L 4.9988 8.7501 120.9422 53.2283 44.2738 175.0098 125 A 4.8566 8.4061 125.6752 49.0414 22.4645 174.6808 126 P 4.4462 0.0000 0.0000 62.7618 30.9945 175.3641 115 G 4.2140 8.0631 113.4400 43.8891 0.0000 174.4362 116 A 4.4110 8.4349 128.4856 55.6491 18.1649 176.7686 117 A 4.5597 9.5409 128.8443 51.6319 22.5137 176.3804 118 A 4.7758 8.9934 129.4988 51.8648 20.2372 174.0671 119 A 5.2020 8.3967 123.6201 51.3546 19.6285 176.0210 120 L 4.4539 8.3345 122.8358 53.8738 43.7473 176.0917 121 G 4.2874 7.9672 112.7983 43.1279 0.0000 173.1766 122 C 5.2676 8.4367 123.9319 55.3715 31.0842 171.6214 123 L 4.6513 8.3818 121.0629 54.5595 43.3724 175.4968 124 V 4.7788 8.6201 118.3422 60.3283 34.7738 173.7098 125 K 4.8566 8.4561 122.2752 52.7414 36.4645 173.4808 126 D 4.6662 8.6901 118.2344 53.6618 39.9945 174.3641 145 Y 5.2229 7.3910 117.2915 55.5786 42.4247 176.0118 146 F 5.2037 8.8481 119.4864 57.1852 42.3772 171.8465 147 P 3.7337 0.0000 0.0000 61.0728 33.8773 174.9828 148 E 4.0953 8.2640 118.5268 56.1470 29.8950 174.1555 149 P 4.8420 0.0000 0.0000 60.9953 33.8829 174.2236 150 V 4.6376 7.8230 116.5961 60.0059 34.3981 174.9201 151 T 4.6745 8.6913 112.4229 59.9715 71.5097 173.1156 152 V 4.9061 8.2631 123.1810 61.2677 34.8033 174.2275 153 S 4.8917 8.8559 120.8015 56.5725 67.3019 172.3296 154 W 4.7361 8.6126 118.7222 55.3407 32.1916 175.6779 155 N 4.0412 9.6313 120.0989 55.7413 35.9611 174.6865 156 S 3.7885 9.4881 106.1757 59.6482 61.7347 174.4236 157 G 4.0322 8.3952 107.8755 45.3659 0.0000 175.3182 158 A 4.1311 8.1214 122.1474 53.2489 18.9517 177.0595 159 L 4.6994 7.9337 118.0548 53.7165 43.4622 175.5681 160 T 4.5120 8.3830 114.3688 62.5791 71.1420 174.4356 161 S 4.3129 7.9729 116.3084 59.0925 63.8082 174.3316 162 G 3.7329 8.8493 111.6048 45.2571 0.0000 172.2984 163 V 4.3119 7.1505 119.4053 62.1065 32.7890 175.1724 164 H 4.7135 9.2140 124.4336 54.4652 32.2920 172.5062 165 T 4.8678 8.3640 120.8988 61.7725 69.5757 174.8235 166 F 4.5388 8.8236 126.1259 56.0348 40.0145 174.2591 167 P 4.4236 0.0000 0.0000 62.5220 31.9184 176.2224 168 A 4.5768 8.5071 122.3623 52.3923 19.4208 176.9793 169 V 4.5208 8.7803 113.0366 59.4754 35.0616 174.9602 170 L 4.3199 8.4011 126.1053 53.7252 42.6282 176.4634 171 Q 4.2871 8.7978 126.5768 55.1356 29.4489 177.6592 172 S 4.2610 8.4440 114.2355 61.0342 63.0662 175.8912 173 S 4.0532 7.8531 114.8244 59.7540 62.9993 175.0631 174 G 3.7668 8.4438 109.4696 44.6759 0.0000 172.7872 175 L 4.8005 7.2774 118.7263 52.9259 45.2389 175.8122 176 Y 4.8748 8.8425 119.7837 57.6711 40.1387 174.3802 177 S 5.5529 8.7513 114.1995 57.4872 66.2075 172.9451 178 L 5.2725 8.7189 125.4220 54.5126 43.6593 174.8531 179 S 5.5036 8.8973 113.8632 56.8565 66.6715 172.6626 180 S 5.2683 8.8565 114.8970 57.0978 65.0166 173.1617 181 V 5.3005 9.4224 119.9038 59.7399 36.0714 174.7632 182 V 4.6549 7.6019 119.7764 60.6676 33.9580 174.1283 183 T 5.2801 8.1865 120.6911 62.2263 70.1314 174.3092 184 V 4.5401 7.8957 117.3243 58.6930 36.5410 173.2466 185 P 4.2843 0.0000 0.0000 62.8456 31.9120 177.3783 186 S 4.1267 9.0232 118.7319 60.1375 62.4184 174.6288 187 S 4.5676 8.7192 114.0995 60.6339 64.0111 176.5598 188 S 4.2680 8.2006 115.9521 61.2610 63.1686 174.0778 189 L 4.2224 7.1504 120.9369 54.5882 41.0527 177.1700 *192 Q 3.9112 7.6097 117.9724 56.0035 30.4019 173.8905 193 T 4.4257 7.8991 113.8599 60.0013 71.3393 173.2422 194 Y 5.0593 8.2990 119.6792 56.6935 41.3727 174.3033 195 T 5.1862 9.7667 119.8306 60.2653 70.8056 170.0762 196 C 3.8098 8.6198 123.7932 54.0440 45.0971 172.1955 197 N 5.2609 8.7222 120.1060 50.8988 40.3179 173.7103 198 V 4.6623 8.6981 124.8439 61.0216 34.4240 174.1660 199 N 5.0581 9.0422 125.7966 52.6303 42.3160 172.4157 200 H 4.7394 9.0018 127.6261 54.0394 30.2305 174.5711 201 K 3.7806 8.6034 124.6537 58.8791 32.3245 177.4791 202 P 4.0909 0.0000 0.0000 65.2140 31.1467 177.1209 203 S 4.5384 7.5345 108.7485 57.1291 63.8559 173.5827 204 N 4.0225 8.0889 117.3985 55.3223 35.9639 175.4631 205 T 4.5170 7.3276 113.3977 61.9011 72.0915 174.7112 206 K 5.0135 8.5666 125.6323 54.5772 34.8233 176.3076 207 V 4.4675 8.6737 122.9176 61.4263 35.1323 173.1686 208 D 5.2881 8.6824 126.2355 52.2907 44.1974 174.6265 209 K 4.6696 8.8080 124.5166 54.4429 35.0247 174.8450 210 R 4.6771 8.7082 128.5867 55.9278 31.0190 175.3979 211 V 4.7223 9.1479 126.7630 61.1353 33.7131 174.3631 212 E 4.9006 8.7027 124.0429 53.8838 33.3527 174.4874 213 P 4.5199 0.0000 0.0000 66.7632 29.8110 177.5844 214 K 4.6335 7.8680 118.4972 54.0626 37.1393 176.5714 215 S 3.5742 9.6052 108.9467 59.3700 60.6203 171.5324 216 C 4.0891 8.2483 123.7737 59.9498 32.1237 172.2154 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 1 R 8.11 4.28 0.00 1.88 1.91 0.00 3.15 0.00 0.00 3.36 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 2 I 8.30 4.66 1.87 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.85 0.98 0.00 0.00 3 T 9.42 4.93 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 1.26 0.00 0.00 4 L 8.48 5.50 0.00 1.66 1.58 0.99 0.46 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 5 K 8.81 4.78 0.00 1.85 1.63 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.48 7.81 6 E 8.99 5.19 0.00 2.02 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 2.70 2.38 0.00 7 S 9.78 4.71 0.00 3.84 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 8 G 8.09 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 9 P 0.00 4.46 0.00 2.35 2.05 0.00 3.68 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.90 0.00 10 P 0.00 4.67 0.00 2.15 2.36 0.00 3.64 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 11 L 7.85 5.40 0.00 1.55 1.68 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 12 V 8.96 4.55 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 0.99 0.00 0.00 0.89 0.00 0.00 13 K 8.40 4.93 0.00 1.72 1.66 0.00 2.01 0.00 0.00 1.75 0.00 0.00 2.82 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.60 1.29 7.81 14 P 0.00 4.61 0.00 2.00 1.98 0.00 3.71 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.06 0.00 15 T 9.11 3.49 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 1.19 0.00 0.00 16 Q 7.75 4.32 0.00 2.19 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.83 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 17 T 8.22 4.81 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 1.19 0.00 0.00 18 L 8.99 4.56 0.00 1.54 1.45 0.72 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 19 T 8.41 4.80 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 20 L 8.73 4.85 0.00 0.66 1.17 0.06 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 21 T 9.04 5.16 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 1.27 0.00 0.00 22 C 9.82 5.35 0.00 2.68 3.19 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 23 S 9.04 5.27 0.00 3.76 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 F 7.77 5.50 0.00 2.90 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 25 S 9.13 4.52 0.00 3.86 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 26 G 11.07 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 27 F 7.16 4.91 0.00 3.18 2.93 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 28 S 9.77 4.85 0.00 3.85 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 29 L 8.79 4.69 0.00 2.07 1.75 0.97 0.88 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 30 S 7.61 4.84 0.00 4.08 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 31 D 8.24 4.63 0.00 2.88 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 32 F 8.96 4.02 0.00 3.01 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 33 G 8.10 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 0.00 0.00 0.00 34 V 7.25 3.79 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 0.63 0.00 0.00 0.95 0.00 0.00 35 G 8.60 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 0.00 0.00 0.00 35A V 8.37 4.55 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 0.71 0.00 0.00 0.68 0.00 0.00 35B G 8.75 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 0.00 0.00 0.00 0.00 36 W 8.68 5.36 0.00 3.09 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 37 I 9.42 5.30 2.16 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.91 1.30 0.00 0.00 38 R 9.30 4.97 0.00 0.70 1.62 0.00 2.72 0.00 0.00 3.34 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.23 0.00 39 Q 8.90 4.61 0.00 2.39 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.99 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 40 P 0.00 4.74 0.00 2.24 1.97 0.00 3.84 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.07 0.00 41 P 0.00 4.37 0.00 2.23 2.14 0.00 3.90 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 2.05 2.07 0.00 42 G 8.88 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 43 K 7.97 4.40 0.00 1.88 1.81 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.39 7.81 44 A 8.14 4.40 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 45 L 8.18 4.60 0.00 1.66 1.81 0.85 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 46 E 9.31 4.76 0.00 2.05 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 2.30 2.34 0.00 47 W 9.26 4.61 0.00 3.40 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 48 L 7.79 4.48 0.00 1.61 1.56 1.08 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 49 A 6.10 3.77 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 I 7.64 4.69 2.03 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 0.37 1.01 1.07 0.00 0.00 51 I 8.60 4.91 1.80 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 1.23 1.72 0.88 0.00 0.00 52 Y 8.57 5.14 0.00 3.15 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 53 S 9.11 4.52 0.00 4.16 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 54 D 8.09 4.55 0.00 2.81 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 55 D 8.46 4.60 0.00 2.85 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 56 D 8.39 4.63 0.00 2.81 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 K 8.39 5.16 0.00 1.61 1.28 0.00 1.84 0.00 0.00 1.81 0.00 0.00 3.09 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.28 1.59 7.81 58 R 8.39 4.82 0.00 1.99 1.99 0.00 3.32 0.00 0.00 3.26 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.93 0.00 59 Y 8.61 5.26 0.00 2.83 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 60 S 9.04 4.53 0.00 4.29 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 61 P 0.00 4.39 0.00 2.16 2.17 0.00 3.89 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 62 S 8.24 4.27 0.00 3.88 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 63 L 7.45 4.69 0.00 1.77 1.62 0.95 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 64 N 8.30 4.03 0.00 2.96 2.84 0.00 0.00 6.90 6.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 T 7.87 3.82 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 1.18 0.00 0.00 66 R 8.07 4.50 0.00 1.71 2.06 0.00 3.08 0.00 0.00 3.25 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.38 0.00 67 L 7.38 5.12 0.00 1.28 1.60 0.97 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 68 T 8.79 4.70 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 1.26 0.00 0.00 69 I 9.24 5.05 1.93 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 1.21 0.72 0.00 0.00 70 T 9.19 4.95 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 1.26 0.00 0.00 71 K 8.65 5.11 0.00 1.86 1.81 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.73 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.34 1.46 7.81 72 D 9.40 4.67 0.00 2.66 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 T 8.60 3.97 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 1.28 0.00 0.00 74 S 8.10 4.19 0.00 3.84 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 K 8.12 4.17 0.00 1.75 1.74 0.00 1.81 0.00 0.00 1.67 0.00 0.00 3.17 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.50 7.81 76 N 7.55 3.53 0.00 2.31 1.55 0.00 0.00 6.70 8.35 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 77 Q 7.76 4.97 0.00 1.94 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.76 0.00 0.00 0.00 0.00 0.00 2.12 2.23 0.00 78 V 9.06 4.94 2.26 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 1.15 0.00 0.00 1.12 0.00 0.00 79 V 9.08 5.05 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 0.94 0.00 0.00 0.99 0.00 0.00 80 L 8.70 4.99 0.00 0.55 0.17 0.84 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.85 4.63 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 0.87 0.00 0.00 0.87 0.00 0.00 82 M 9.29 5.10 0.00 1.88 1.71 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 82A T 8.79 4.50 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 82B R 8.06 3.97 0.00 1.88 1.95 0.00 3.55 0.00 0.00 3.86 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.50 0.00 82C V 7.85 4.05 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 0.63 0.00 0.00 0.96 0.00 0.00 83 S 9.08 4.98 0.00 3.90 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 84 P 0.00 4.45 0.00 2.17 2.13 0.00 3.86 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 2.08 2.05 0.00 85 V 7.27 3.75 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 0.67 0.00 0.00 0.95 0.00 0.00 86 D 8.26 4.74 0.00 2.82 2.83 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 87 T 7.99 4.21 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 88 A 8.49 4.42 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 T 8.36 4.66 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 0.48 0.00 0.00 90 Y 9.08 4.89 0.00 2.98 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 91 F 9.96 5.68 0.00 3.17 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 92 C 9.20 4.61 0.00 1.96 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 93 A 7.98 4.67 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 H 8.80 4.54 0.00 2.77 2.96 0.00 5.53 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 95 R 7.95 4.54 0.00 1.63 1.44 0.00 3.12 0.00 0.00 3.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.68 0.00 96 R 8.55 4.14 0.00 1.86 1.78 0.00 3.15 0.00 0.00 3.61 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.65 0.00 97 G 8.23 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 98 P 0.00 4.73 0.00 2.16 2.17 0.00 3.63 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.13 0.00 99 T 8.83 4.27 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 1.19 0.00 0.00 100 T 8.44 5.04 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 1.21 0.00 0.00 100A L 8.75 4.21 0.00 1.50 1.45 0.26 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 100B F 8.79 3.69 0.00 3.20 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 100C G 7.95 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 0.00 0.00 0.00 100D V 7.59 4.23 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 1.00 0.00 0.00 1.05 0.00 0.00 100E P 0.00 4.79 0.00 2.28 2.11 0.00 3.67 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.93 0.00 100F I 8.73 4.46 1.87 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 1.20 0.72 0.94 0.00 0.00 100G A 7.79 4.56 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 100H R 8.61 4.40 0.00 1.99 2.18 0.00 2.98 0.00 0.00 3.34 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 100I G 8.24 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 100J P 0.00 4.38 0.00 2.04 2.12 0.00 3.77 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 2.02 2.10 0.00 100K V 7.64 4.02 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 0.99 0.00 0.00 100L N 7.84 4.59 0.00 2.82 2.77 0.00 0.00 6.79 6.63 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 100M A 6.68 4.34 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 100N M 8.50 4.47 0.00 1.54 2.05 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 101 D 8.34 4.62 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 0.00 102 V 7.57 4.67 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 1.19 0.00 0.00 0.91 0.00 0.00 103 W 9.15 5.16 0.00 3.01 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 0.00 104 G 8.65 4.36 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 0.00 105 Q 8.87 4.30 0.00 2.28 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.43 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 106 G 9.16 3.82 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 0.00 107 I 8.51 4.57 1.96 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 1.27 1.42 1.11 0.00 0.00 108 T 8.64 4.60 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 0.00 109 V 9.05 4.66 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 0.98 0.00 0.00 0.98 0.00 0.00 110 T 9.27 4.97 4.41 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 1.49 0.00 0.00 111 I 8.28 5.35 1.90 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 1.23 1.72 0.98 0.00 0.00 112 S 8.33 4.74 0.00 3.76 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.55 4.45 0.00 3.93 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 0.00 114 T 6.97 3.76 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 0.96 0.00 0.00 115 S 8.04 4.72 0.00 3.86 3.82 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 0.00 116 T 8.34 4.44 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 1.35 0.00 0.00 117 K 9.59 4.56 0.00 1.84 1.74 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.56 1.45 7.81 118 G 9.08 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 0.00 0.00 0.00 0.00 119 P 0.00 5.30 0.00 2.05 2.04 0.00 3.31 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 1.88 1.62 0.00 120 S 8.48 4.58 0.00 3.62 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 0.00 121 V 7.67 4.45 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 0.96 0.00 0.00 0.79 0.00 0.00 122 F 8.42 5.34 0.00 3.12 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 0.00 123 P 0.00 4.73 0.00 2.21 2.27 0.00 3.88 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.09 0.00 124 L 8.75 5.00 0.00 1.83 1.68 1.06 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 125 A 8.41 4.86 1.29 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 0.00 126 P 0.00 4.45 0.00 2.17 2.12 0.00 3.81 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 115 G 8.06 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 0.00 116 A 8.43 4.41 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 0.00 117 A 9.54 4.56 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 A 8.99 4.78 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 0.00 119 A 8.40 5.20 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 0.00 120 L 8.33 4.45 0.00 1.35 0.98 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 121 G 7.97 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 0.00 122 C 8.44 5.27 0.00 2.91 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 0.00 123 L 8.38 4.65 0.00 1.54 1.95 0.92 0.20 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 0.00 124 V 8.62 4.78 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 0.79 0.00 0.00 0.93 0.00 0.00 125 K 8.46 4.86 0.00 1.70 1.53 0.00 0.61 0.00 0.00 1.87 0.00 0.00 2.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.30 7.81 126 D 8.69 4.67 0.00 2.60 2.83 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 0.00 145 Y 7.39 5.22 0.00 2.89 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 0.00 146 F 8.85 5.20 0.00 3.09 3.15 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 0.00 147 P 0.00 3.73 0.00 1.66 1.07 0.00 3.84 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.84 0.00 148 E 8.26 4.10 0.00 1.70 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 0.00 1.47 1.53 0.00 149 P 0.00 4.84 0.00 2.09 1.98 0.00 3.62 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 1.82 1.86 0.00 150 V 7.82 4.64 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.63 0.00 0.00 151 T 8.69 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 1.16 0.00 0.00 152 V 8.26 4.91 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 0.66 0.00 0.00 0.86 0.00 0.00 153 S 8.86 4.89 0.00 3.88 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 0.00 154 W 8.61 4.74 0.00 3.55 3.29 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 0.00 155 N 9.63 4.04 0.00 2.92 2.82 0.00 0.00 7.02 8.33 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 0.00 156 S 9.49 3.79 0.00 4.00 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 0.00 157 G 8.40 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 0.00 158 A 8.12 4.13 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 0.00 159 L 7.93 4.70 0.00 1.78 1.83 1.14 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 160 T 8.38 4.51 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 0.00 161 S 7.97 4.31 0.00 3.98 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 0.00 162 G 8.85 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 0.00 163 V 7.15 4.31 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 0.89 0.00 0.00 0.89 0.00 0.00 164 H 9.21 4.71 0.00 2.90 2.46 0.00 5.66 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 T 8.36 4.87 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 0.00 166 F 8.82 4.54 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 0.00 167 P 0.00 4.42 0.00 2.26 2.12 0.00 4.05 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.06 0.00 168 A 8.51 4.58 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 V 8.78 4.52 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 0.75 0.00 0.00 1.00 0.00 0.00 170 L 8.40 4.32 0.00 1.61 1.49 0.84 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 171 Q 8.80 4.29 0.00 2.11 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 172 S 8.44 4.26 0.00 3.94 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 0.00 173 S 7.85 4.05 0.00 3.94 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 0.00 174 G 8.44 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 L 7.28 4.80 0.00 1.53 1.52 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 176 Y 8.84 4.87 0.00 1.58 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 0.00 177 S 8.75 5.55 0.00 4.00 3.68 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 0.00 178 L 8.72 5.27 0.00 1.80 1.77 1.06 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 179 S 8.90 5.50 0.00 4.01 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 0.00 180 S 8.86 5.27 0.00 4.05 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 0.00 181 V 9.42 5.30 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 0.92 0.00 0.00 1.10 0.00 0.00 182 V 7.60 4.65 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 -0.58 0.00 0.00 0.58 0.00 0.00 183 T 8.19 5.28 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 184 V 7.90 4.54 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 0.50 0.00 0.00 0.63 0.00 0.00 185 P 0.00 4.28 0.00 2.08 1.98 0.00 3.64 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.08 0.00 186 S 9.02 4.13 0.00 3.99 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 0.00 187 S 8.72 4.57 0.00 4.00 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 0.00 188 S 8.20 4.27 0.00 4.10 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 0.00 189 L 7.15 4.22 0.00 1.73 1.76 0.91 0.85 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 *192 Q 7.61 3.91 0.00 1.95 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 1.97 1.51 0.00 193 T 7.90 4.43 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 1.17 0.00 0.00 194 Y 8.30 5.06 0.00 3.16 3.18 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 0.00 195 T 9.77 5.19 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 1.31 0.00 0.00 196 C 8.62 3.81 0.00 1.99 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 0.00 197 N 8.72 5.26 0.00 2.53 2.76 0.00 0.00 6.36 7.60 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 0.00 198 V 8.70 4.66 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 0.85 0.00 0.00 0.76 0.00 0.00 199 N 9.04 5.06 0.00 2.69 2.51 0.00 0.00 6.43 8.56 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 0.00 200 H 9.00 4.74 0.00 3.01 3.07 0.00 5.68 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 0.00 201 K 8.60 3.78 0.00 1.72 1.79 0.00 1.72 0.00 0.00 1.77 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.38 7.81 202 P 0.00 4.09 0.00 1.68 2.07 0.00 3.12 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.00 0.00 203 S 7.53 4.54 0.00 3.97 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 0.00 204 N 8.09 4.02 0.00 2.86 2.87 0.00 0.00 6.68 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 0.00 205 T 7.33 4.52 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 1.18 0.00 0.00 206 K 8.57 5.01 0.00 1.57 1.64 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.74 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.29 1.35 7.81 207 V 8.67 4.47 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 0.78 0.00 0.00 0.86 0.00 0.00 208 D 8.68 5.29 0.00 2.54 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 0.00 209 K 8.81 4.67 0.00 1.71 1.55 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.78 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.34 1.35 7.81 210 R 8.71 4.68 0.00 1.89 1.84 0.00 3.25 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.83 0.00 211 V 9.15 4.72 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 1.04 0.00 0.00 1.24 0.00 0.00 212 E 8.70 4.90 0.00 2.12 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 213 P 0.00 4.52 0.00 2.10 2.09 0.00 3.75 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.10 0.00 214 K 7.87 4.63 0.00 1.95 1.95 0.00 1.75 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.38 1.44 7.81 215 S 9.61 3.57 0.00 4.00 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 0.00 216 C 8.25 4.09 0.00 3.12 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 * Residues marked with a * may have inaccurate shift predictions.