NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2355 8.1476 120.2494 54.6375 32.6794 174.6131 2 K 4.7401 7.7673 125.9993 56.1882 33.1177 176.4223 3 G 3.8342 8.4809 111.0309 45.1467 0.0000 167.4876 4 D 4.3929 8.5931 131.4336 54.0834 41.2260 174.4486 5 T 3.8305 8.5942 123.7873 66.7709 68.5517 176.1658 6 K 3.7108 8.1875 120.8303 59.5374 32.0442 178.7249 7 V 3.8938 8.1167 117.9154 66.2793 31.6572 178.1816 8 I 3.7861 7.7887 119.2489 63.9916 36.8098 178.2886 9 N 4.2900 8.1348 117.8721 56.3129 38.3437 176.9685 10 Y 4.0734 7.8787 118.0738 61.0711 37.9184 178.6432 11 L 3.8620 8.2524 120.0131 58.0415 41.7920 179.4832 12 N 4.2811 8.0639 116.0377 55.9335 38.3992 177.5272 13 K 3.9111 7.9352 121.3007 59.3390 32.2920 178.9629 14 L 4.0149 8.0545 119.7078 57.5801 41.4036 179.1772 15 L 3.9798 7.6927 120.5197 58.0212 42.1186 179.2510 16 G 3.5893 7.9521 105.5783 47.8838 0.0000 175.2640 17 N 4.3617 8.0226 118.9499 56.1363 38.5112 177.3360 18 E 4.0638 8.1546 119.8092 59.4949 29.3950 179.2626 19 L 4.0211 8.1442 119.3354 57.9222 41.6356 180.1054 20 V 3.6244 7.8070 118.3822 64.6863 31.3897 178.3661 21 A 3.8651 7.8978 121.7999 54.6874 18.2186 179.6362 22 I 3.8401 8.0807 111.8736 64.3144 37.7461 178.3413 23 N 4.3769 7.9317 118.2573 56.0591 38.4174 177.2707 24 Q 3.8847 8.2605 121.0706 59.3799 29.1534 177.7950 25 Y 4.4391 8.1023 117.8788 60.9783 37.9405 178.1259 26 F 3.9826 8.5726 121.8811 60.9228 39.4719 177.1876 27 L 3.9934 8.0508 119.8918 58.3549 41.8815 178.5106 28 H 3.7982 8.2744 115.9476 58.6896 28.5956 177.2417 29 A 4.1659 8.0129 122.3921 55.7497 18.2039 180.0985 30 R 3.8180 7.6677 115.6085 59.0816 30.0593 179.3956 31 M 3.4551 7.6585 119.0540 57.9250 31.8155 178.6293 32 F 4.3678 7.4834 117.8642 60.4649 39.1891 177.2605 33 K 3.7932 8.3160 119.6368 59.9035 31.6894 177.7898 34 N 4.2588 7.6636 115.4134 56.7649 38.8485 176.1613 35 W 4.7935 7.7076 117.5198 57.6505 29.3058 177.2393 36 G 4.0608 8.8548 108.6304 45.5175 0.0000 173.6879 37 L 4.6377 7.9060 122.0384 52.8373 39.4387 177.0363 38 K 3.9271 8.1186 122.6791 59.3485 32.5012 178.3250 39 R 3.8575 8.2602 119.0970 59.5104 30.0228 178.6458 40 L 4.0535 7.7569 118.3165 57.4920 41.5773 178.8643 41 N 4.4449 8.1683 116.9288 56.7988 38.8449 176.5718 42 D 4.3494 8.2044 120.4250 57.4264 41.0569 179.1577 43 V 3.3146 7.6106 118.2971 66.0966 31.4335 177.8932 44 E 3.7984 8.1105 118.2506 59.4104 29.3814 178.9796 45 Y 3.8711 8.1106 119.6369 61.0159 38.9474 177.5954 46 H 4.0566 7.9344 119.1391 59.0333 29.7853 177.0801 47 E 3.6901 7.6008 120.2921 58.9552 29.0625 179.1102 48 S 4.0899 7.3842 113.4166 61.4478 62.5184 176.3469 49 I 3.6383 7.2288 122.0844 64.1044 36.6480 178.2195 50 D 4.1551 7.8345 119.8361 57.4257 40.6035 178.5101 51 E 4.0216 8.2946 119.2519 59.8450 29.3373 179.3527 52 M 4.0433 8.1472 118.5727 58.4469 31.9385 178.9505 53 K 4.0550 7.9076 118.3254 59.2423 32.2291 179.1496 54 H 4.1235 8.3316 116.7290 58.7706 28.6417 177.4224 55 A 4.2187 8.3046 122.7139 55.5432 18.2449 179.1318 56 D 4.3087 7.9326 116.1836 57.4735 41.1676 178.6952 57 R 3.8396 7.7471 118.2426 59.4281 30.0407 178.6261 58 Y 4.2825 7.5405 115.8952 61.2739 38.0385 178.4729 59 I 3.7985 8.0568 120.7650 64.7519 37.2165 178.3764 60 E 4.0782 8.2867 119.2359 59.1526 29.3242 179.3649 61 R 4.0012 8.1366 118.8941 59.5337 30.2006 178.5729 62 I 3.7952 8.3049 120.0619 64.5439 36.9814 178.4662 63 L 4.0908 7.9815 119.5180 57.5413 41.1792 179.3906 64 F 4.2667 8.1029 119.8355 61.3435 39.8081 176.9096 65 L 4.5810 7.9262 118.1160 54.5661 41.4871 176.6175 66 E 3.5727 7.8664 117.3600 57.8514 26.6531 173.4276 67 G 4.1697 8.3287 107.2710 43.4571 0.0000 172.1718 68 L 4.6402 8.0805 120.2071 52.1015 43.7251 174.3755 69 P 4.3826 0.0000 0.0000 62.8176 31.8046 175.6808 70 N 4.7113 9.2552 121.7076 52.4955 38.5560 173.9549 71 L 4.6852 8.3530 124.6103 54.5390 42.3815 177.3720 72 Q 4.2136 8.3332 122.2911 57.3728 29.6812 175.6834 73 D 4.6782 8.0929 117.7260 52.8672 41.7518 175.2169 74 L 4.6220 8.3543 125.9539 53.0768 44.1803 176.2062 75 G 3.9676 8.2039 113.6922 43.9966 0.0000 172.7233 76 K 4.1440 8.3471 118.8905 55.8899 32.5056 176.7102 77 L 4.3441 8.3986 124.1523 53.3533 42.6819 175.8453 78 N 4.7099 8.3905 122.7867 51.7580 38.2117 174.3987 79 I 3.8001 7.7989 125.9900 62.2923 37.8796 177.3673 80 G 4.3034 8.2316 107.8480 45.7785 0.0000 172.8300 81 E 4.7184 8.7779 119.8208 55.9389 30.8900 176.3767 82 D 4.9853 7.8033 118.9884 50.4507 43.8133 176.2987 83 V 4.0761 8.6543 121.6108 65.6866 30.9976 178.2176 84 E 3.8724 8.2224 119.2520 58.7131 29.5649 178.3450 85 E 3.9722 8.4745 119.4426 59.4513 29.7867 178.4874 86 M 4.2193 8.4893 119.1431 58.6681 32.0715 178.7771 87 L 4.2080 8.4343 119.2662 58.0484 41.7941 179.9226 88 R 4.0211 7.8996 118.0038 59.0392 29.9388 179.3583 89 S 4.1275 8.0551 114.7181 61.7693 62.9191 176.1869 90 D 4.2579 8.1212 121.5794 57.3920 40.5748 178.9207 91 L 3.9895 7.9975 120.4160 58.0834 42.1722 178.7930 92 A 4.0018 8.0759 120.7666 55.0192 18.3213 179.3391 93 L 3.8805 8.0190 118.7416 58.4505 42.2169 178.9941 94 E 4.0630 8.1367 118.4344 59.4647 29.3600 179.4792 95 L 4.0366 8.1239 118.9454 57.8572 41.6432 179.2637 96 D 4.4650 8.3115 118.9665 57.2839 40.7394 179.0470 97 G 3.6319 8.1906 105.9488 47.8640 0.0000 175.3823 98 A 4.0277 8.1553 123.5195 54.7776 18.0960 179.5941 99 K 3.8956 7.9303 117.5720 59.8531 32.2958 178.8578 100 N 4.3962 7.9786 116.4102 56.0993 38.3495 177.3436 101 L 3.9923 8.0463 120.5582 58.0312 41.8952 179.8300 102 R 3.8862 8.0480 117.8429 59.0628 29.8204 178.7665 103 E 3.8383 7.8972 118.7751 59.2711 29.6948 178.8160 104 A 2.8660 7.6444 120.7101 54.8069 17.8245 179.6995 105 I 3.7741 7.9988 118.7465 64.4034 37.0024 178.9559 106 G 3.6230 7.9639 106.3039 47.7948 0.0000 175.2739 107 Y 3.9481 7.7626 121.8232 60.3867 38.7733 177.6115 108 A 3.8823 7.9763 121.7472 55.1324 18.3406 179.1410 109 D 4.1408 7.6902 115.4100 57.5692 41.1239 178.4556 110 S 3.9703 7.3042 114.6472 61.4388 62.9752 176.5159 111 V 3.6328 6.9568 118.0863 61.6994 31.5503 176.3509 112 H 2.9571 7.2410 115.6353 56.7694 26.7929 176.1333 113 D 4.4959 7.5200 122.0409 53.4566 38.5414 176.1202 114 Y 4.3736 7.5037 121.7141 60.3272 38.3890 177.4815 115 V 3.7253 7.8510 119.1090 65.8560 31.7975 178.1557 116 S 4.2358 8.3757 115.2302 61.4275 62.7627 176.7387 117 R 4.0668 8.1499 118.7428 58.7711 29.0744 178.5777 118 D 4.2573 8.1967 119.2931 57.5026 41.3125 177.6046 119 M 4.0007 7.9554 118.6907 59.1244 32.1327 178.0620 120 M 4.1166 8.0071 118.4742 58.5758 32.1156 178.8985 121 I 3.7458 7.7338 119.3976 64.0277 37.0239 178.4715 122 E 3.9304 7.9204 119.8590 59.5769 29.3820 179.4017 123 I 3.6135 7.6656 119.8438 64.1734 37.0778 178.3347 124 L 4.0038 8.2637 121.6283 58.0102 41.6878 178.9534 125 R 3.9291 7.8399 118.0335 59.3385 30.2657 178.0504 126 D 4.4544 7.7852 118.9328 57.2297 40.7842 178.4290 127 E 3.9372 8.1822 119.0435 59.6050 29.4423 179.3406 128 E 4.1619 8.4557 118.1185 58.7607 29.2775 179.4632 129 G 3.7147 7.9255 106.1698 47.6416 0.0000 175.7761 130 H 4.5803 8.0032 118.0467 58.8586 28.8205 177.7544 131 I 3.8679 8.3247 122.1347 64.3984 36.9289 178.0300 132 D 4.3595 8.1081 118.9064 56.9985 41.0787 178.0952 133 W 4.1728 8.1983 128.7965 60.4197 30.7003 177.9882 134 L 3.6231 8.1116 118.5952 57.7605 40.9823 179.2473 135 E 3.9113 8.1152 118.4543 59.7877 29.5320 179.6610 136 T 3.8279 7.8827 115.5371 66.5362 68.4518 176.5162 137 E 3.7943 7.7546 120.3871 59.5010 29.0947 179.5238 138 L 3.8165 7.7868 118.7509 57.7589 41.5888 179.3249 139 D 4.4166 7.7691 118.9773 56.8974 40.7925 178.7456 140 L 4.0619 7.7018 119.3089 57.7898 41.6056 179.5605 141 I 3.4966 7.1956 119.4430 64.1473 36.6954 178.3015 142 Q 3.8751 7.2440 118.2075 59.0939 28.9820 178.0805 143 K 4.1585 8.2408 118.9261 58.7844 32.4026 178.3730 144 M 4.3921 8.5577 114.9891 54.2081 32.5380 177.3147 145 G 4.0524 7.4996 105.5961 45.6105 0.0000 174.3724 146 L 4.0260 8.3568 120.6914 58.1434 42.1373 179.3956 147 Q 4.1064 8.0238 117.6271 58.9810 28.7193 178.2660 148 N 4.3965 8.1125 117.1782 56.2704 38.4826 176.7030 149 Y 3.9605 7.7700 119.8047 60.6479 39.2244 177.8465 150 L 4.1077 8.5544 120.3214 57.9092 41.9273 179.3118 151 Q 3.9887 8.2286 119.2095 58.8518 28.7487 177.3522 152 A 4.2333 7.6223 118.9421 53.0062 18.6112 178.0330 153 Q 4.4147 7.7993 116.5765 55.5860 30.1308 177.0652 154 I 4.1846 7.0687 110.8828 61.6736 37.7849 176.2314 155 R 4.6296 7.4389 119.9724 54.2596 33.7671 174.6240 156 E 4.1412 8.5980 120.4427 55.8648 30.6616 177.3427 157 E 4.0884 8.2959 121.5001 55.5757 31.5074 176.8392 *158 G 3.7267 8.5798 107.7364 46.1107 0.0000 172.6578 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 M 8.15 4.24 0.00 1.28 1.77 0.00 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.41 0.00 2 K 7.77 4.74 0.00 1.92 1.88 0.00 1.23 0.00 0.00 2.34 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.42 7.81 3 G 8.48 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 4 D 8.59 4.39 0.00 2.97 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 5 T 8.59 3.83 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 1.24 0.00 0.00 6 K 8.19 3.71 0.00 1.97 1.74 0.00 0.92 0.00 0.00 1.17 0.00 0.00 2.39 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.30 1.13 7.81 7 V 8.12 3.89 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 1.25 0.00 0.00 1.20 0.00 0.00 8 I 7.79 3.79 2.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.20 0.92 0.00 0.00 9 N 8.13 4.29 0.00 2.77 2.61 0.00 0.00 6.85 7.02 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 10 Y 7.88 4.07 0.00 3.19 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 11 L 8.25 3.86 0.00 2.04 1.75 1.10 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.06 4.28 0.00 2.89 2.81 0.00 0.00 6.70 6.57 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 13 K 7.94 3.91 0.00 1.78 2.02 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.46 7.81 14 L 8.05 4.01 0.00 1.56 0.86 0.92 0.51 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 15 L 7.69 3.98 0.00 1.69 1.76 1.09 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.95 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 0.00 0.00 0.00 17 N 8.02 4.36 0.00 3.03 2.91 0.00 0.00 7.05 7.78 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 18 E 8.15 4.06 0.00 2.31 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 0.00 2.75 2.85 0.00 19 L 8.14 4.02 0.00 1.85 1.73 0.92 0.75 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 20 V 7.81 3.62 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 0.89 0.00 0.00 0.90 0.00 0.00 21 A 7.90 3.87 1.42 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 22 I 8.08 3.84 1.92 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.97 1.03 0.00 0.00 23 N 7.93 4.38 0.00 2.97 2.91 0.00 0.00 6.68 7.11 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 24 Q 8.26 3.88 0.00 2.01 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.00 2.18 0.00 25 Y 8.10 4.44 0.00 3.39 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 26 F 8.57 3.98 0.00 3.35 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 27 L 8.05 3.99 0.00 1.88 1.63 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.27 3.80 0.00 3.58 3.25 0.00 5.89 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.01 4.17 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 30 R 7.67 3.82 0.00 1.75 1.88 0.00 3.17 0.00 0.00 2.96 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.74 0.00 31 M 7.66 3.46 0.00 0.87 1.51 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.22 0.00 32 F 7.48 4.37 0.00 3.26 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.32 3.79 0.00 2.07 1.91 0.00 1.66 0.00 0.00 1.50 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.43 7.81 34 N 7.66 4.26 0.00 2.70 2.64 0.00 0.00 7.38 8.11 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 35 W 7.71 4.79 0.00 3.76 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 36 G 8.85 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 7.91 4.64 0.00 2.14 1.66 1.03 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 38 K 8.12 3.93 0.00 1.78 1.85 0.00 1.79 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.53 1.51 7.81 39 R 8.26 3.86 0.00 2.02 2.07 0.00 3.06 0.00 0.00 3.37 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 40 L 7.76 4.05 0.00 1.49 0.90 1.06 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.17 4.44 0.00 3.16 3.06 0.00 0.00 7.16 8.20 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 42 D 8.20 4.35 0.00 2.93 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 43 V 7.61 3.31 1.69 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 -0.67 0.00 0.00 0.73 0.00 0.00 44 E 8.11 3.80 0.00 2.34 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 0.00 2.66 3.15 0.00 45 Y 8.11 3.87 0.00 3.00 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 46 H 7.93 4.06 0.00 3.19 3.16 0.00 5.83 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 7.60 3.69 0.00 1.16 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.78 0.00 48 S 7.38 4.09 0.00 3.99 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 49 I 7.23 3.64 1.87 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.76 0.85 0.00 0.00 50 D 7.83 4.16 0.00 2.71 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 51 E 8.29 4.02 0.00 2.18 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 0.00 2.72 2.82 0.00 52 M 8.15 4.04 0.00 2.03 2.20 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.55 0.00 53 K 7.91 4.06 0.00 1.92 1.80 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.62 7.81 54 H 8.33 4.12 0.00 3.36 3.47 0.00 5.65 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.30 4.22 1.45 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 0.00 0.00 56 D 7.93 4.31 0.00 2.76 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 57 R 7.75 3.84 0.00 1.99 1.64 0.00 3.12 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 58 Y 7.54 4.28 0.00 3.22 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 59 I 8.06 3.80 2.05 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 1.59 1.53 0.95 0.00 0.00 60 E 8.29 4.08 0.00 2.18 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 2.35 2.70 0.00 61 R 8.14 4.00 0.00 2.14 2.22 0.00 3.31 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.85 0.00 62 I 8.30 3.80 1.94 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 1.59 0.75 0.96 0.00 0.00 63 L 7.98 4.09 0.00 2.12 1.79 0.98 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.10 4.27 0.00 3.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 L 7.93 4.58 0.00 1.99 1.68 0.99 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.87 3.57 0.00 2.01 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 2.13 2.23 0.00 67 G 8.33 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 68 L 8.08 4.64 0.00 1.57 1.54 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.38 0.00 2.10 2.01 0.00 3.72 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.12 0.00 70 N 9.26 4.71 0.00 2.60 2.80 0.00 0.00 7.03 7.63 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 71 L 8.35 4.69 0.00 1.64 1.62 0.93 0.96 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 72 Q 8.33 4.21 0.00 1.99 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.21 6.73 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 73 D 8.09 4.68 0.00 2.68 2.57 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 0.00 0.00 0.00 0.00 74 L 8.35 4.62 0.00 1.56 1.51 0.91 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.20 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 76 K 8.35 4.14 0.00 1.75 1.76 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.45 7.81 77 L 8.40 4.34 0.00 1.61 1.57 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 78 N 8.39 4.71 0.00 2.64 2.74 0.00 0.00 7.22 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 I 7.80 3.80 1.90 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.93 1.00 0.00 0.00 80 G 8.23 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 0.00 0.00 0.00 0.00 81 E 8.78 4.72 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 82 D 7.80 4.99 0.00 2.87 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 83 V 8.65 4.08 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 1.13 0.00 0.00 1.12 0.00 0.00 84 E 8.22 3.87 0.00 2.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.22 0.00 85 E 8.47 3.97 0.00 2.47 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 0.00 2.34 2.37 0.00 86 M 8.49 4.22 0.00 1.80 2.42 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.51 0.00 87 L 8.43 4.21 0.00 1.87 1.74 1.22 0.84 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 88 R 7.90 4.02 0.00 1.99 1.99 0.00 3.12 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.76 0.00 89 S 8.06 4.13 0.00 4.15 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 90 D 8.12 4.26 0.00 3.09 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 91 L 8.00 3.99 0.00 1.93 1.87 0.98 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 92 A 8.08 4.00 1.41 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 0.00 0.00 93 L 8.02 3.88 0.00 1.87 1.79 0.89 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.14 4.06 0.00 2.34 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 2.57 2.71 0.00 95 L 8.12 4.04 0.00 2.06 1.73 0.96 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 96 D 8.31 4.46 0.00 2.87 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 G 8.19 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 0.00 0.00 0.00 98 A 8.16 4.03 1.44 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 0.00 0.00 99 K 7.93 3.90 0.00 1.97 2.04 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.50 7.81 100 N 7.98 4.40 0.00 2.95 2.89 0.00 0.00 7.05 8.02 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 0.00 101 L 8.05 3.99 0.00 1.90 1.74 0.96 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.05 3.89 0.00 1.86 1.97 0.00 3.14 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.93 0.00 103 E 7.90 3.84 0.00 2.01 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 2.27 2.36 0.00 104 A 7.64 2.87 1.11 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 0.00 105 I 8.00 3.77 1.85 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.19 0.92 0.00 0.00 106 G 7.96 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 Y 7.76 3.95 0.00 3.05 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 0.00 108 A 7.98 3.88 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 0.00 109 D 7.69 4.14 0.00 2.87 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 0.00 110 S 7.30 3.97 0.00 3.52 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 6.96 3.63 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 0.63 0.00 0.00 0.82 0.00 0.00 112 H 7.24 2.96 0.00 3.14 3.23 0.00 5.84 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.52 4.50 0.00 2.61 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 0.00 114 Y 7.50 4.37 0.00 3.09 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 0.00 115 V 7.85 3.73 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 1.08 0.00 0.00 0.99 0.00 0.00 116 S 8.38 4.24 0.00 4.11 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 0.00 117 R 8.15 4.07 0.00 2.14 2.33 0.00 2.91 0.00 0.00 3.15 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.93 0.00 118 D 8.20 4.26 0.00 3.00 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 0.00 119 M 7.96 4.00 0.00 2.29 2.03 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 2.48 2.48 0.00 120 M 8.01 4.12 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.81 0.00 121 I 7.73 3.75 2.01 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 1.53 0.84 0.92 0.00 0.00 122 E 7.92 3.93 0.00 2.23 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.54 0.00 123 I 7.67 3.61 1.93 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.84 0.73 0.00 0.00 124 L 8.26 4.00 0.00 1.84 1.86 0.94 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 125 R 7.84 3.93 0.00 2.04 2.12 0.00 3.32 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 126 D 7.79 4.45 0.00 2.99 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 0.00 127 E 8.18 3.94 0.00 2.14 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 2.61 2.55 0.00 128 E 8.46 4.16 0.00 2.25 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 129 G 7.93 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 0.00 0.00 0.00 130 H 8.00 4.58 0.00 3.65 3.63 0.00 5.65 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 I 8.32 3.87 2.09 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 1.50 0.83 0.97 0.00 0.00 132 D 8.11 4.36 0.00 2.94 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 0.00 133 W 8.20 4.17 0.00 3.45 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 L 8.11 3.62 0.00 1.87 1.73 1.27 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.12 3.91 0.00 2.17 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 2.33 2.66 0.00 136 T 7.88 3.83 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 1.19 0.00 0.00 137 E 7.75 3.79 0.00 1.56 1.64 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 1.47 1.47 0.00 138 L 7.79 3.82 0.00 1.66 1.61 0.88 0.88 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 0.00 139 D 7.77 4.42 0.00 2.83 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 0.00 140 L 7.70 4.06 0.00 2.07 1.85 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.20 3.50 1.67 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.04 0.68 0.00 0.00 142 Q 7.24 3.88 0.00 2.01 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.99 0.00 0.00 0.00 0.00 0.00 2.33 2.50 0.00 143 K 8.24 4.16 0.00 1.79 1.84 0.00 1.72 0.00 0.00 1.91 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.42 7.81 144 M 8.56 4.39 0.00 2.15 2.21 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 2.64 2.94 0.00 145 G 7.50 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 0.00 146 L 8.36 4.03 0.00 1.74 1.67 0.95 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 147 Q 8.02 4.11 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.70 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 148 N 8.11 4.40 0.00 2.95 2.89 0.00 0.00 6.77 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 0.00 149 Y 7.77 3.96 0.00 3.10 3.21 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 0.00 150 L 8.55 4.11 0.00 2.01 1.71 1.12 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 8.23 3.99 0.00 2.21 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.92 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 152 A 7.62 4.23 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 0.00 153 Q 7.80 4.41 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.82 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 154 I 7.07 4.18 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.24 0.95 0.00 0.00 155 R 7.44 4.63 0.00 1.73 1.79 0.00 3.19 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 156 E 8.60 4.14 0.00 2.08 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 2.25 2.34 0.00 157 E 8.30 4.09 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 *158 G 8.58 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 * Residues marked with a * may have inaccurate shift predictions.