NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1829 8.1633 120.2788 54.6612 33.0732 174.2036 2 K 3.9885 8.4987 126.4167 56.2496 32.4244 175.7549 3 G 3.9382 8.6985 113.6284 44.8587 0.0000 171.9698 4 D 4.5338 8.4831 119.8540 54.4104 41.8544 176.8370 5 T 3.8754 8.9793 123.1530 66.9314 68.4912 176.4063 6 K 3.8236 8.1357 120.8188 59.1897 32.2608 178.7326 7 V 3.9108 8.6549 118.9203 66.2483 31.4218 177.8940 8 I 3.7400 7.8326 119.3683 64.7042 36.9183 178.1141 9 N 4.2801 8.2424 117.0523 56.4021 38.3048 177.0772 10 Y 4.0723 8.0629 118.1390 61.1185 38.0270 178.5460 11 L 3.8741 8.4836 120.2015 58.0747 41.6745 179.4932 12 N 4.3942 8.5592 116.6745 55.9791 38.3974 177.4906 13 K 3.8680 8.1348 121.3165 59.3457 32.3077 178.9292 14 L 3.7910 8.1358 119.6659 57.5365 41.3785 178.9168 15 L 3.9847 7.7511 120.7866 58.2951 42.0142 179.0924 16 G 3.7133 8.1836 105.5497 48.1449 0.0000 175.2173 17 N 4.3507 8.0102 118.9479 56.0647 38.5696 177.3996 18 E 4.0054 8.2830 119.9494 59.3820 29.4121 179.3824 19 L 4.0094 8.1942 119.3113 57.6220 41.5500 179.8132 20 V 3.4668 7.6492 117.4358 65.9704 31.5470 177.9170 21 A 3.2327 7.8803 120.4822 54.8125 18.0874 179.3502 22 I 3.5572 7.9798 118.6192 64.8558 37.2122 178.3895 23 N 4.3513 7.7979 116.8250 56.3418 38.3301 177.4045 24 Q 3.8708 8.1611 121.1874 59.4950 29.0826 177.9319 25 Y 4.6100 8.3015 118.2311 60.8821 37.9851 178.0933 26 F 3.8108 8.4981 121.8407 61.0545 39.5241 176.9566 27 L 3.9582 8.2209 120.0267 58.5477 41.8508 178.4959 28 H 3.8294 8.3395 116.0413 58.6840 28.5543 177.4163 29 A 4.0647 8.0955 122.6291 55.5099 18.1762 179.8314 30 R 3.8582 7.6105 115.1569 58.4671 30.1394 179.2296 31 M 3.4511 7.7376 119.2728 58.1726 31.8521 178.3601 32 F 4.6405 7.5786 118.0375 60.6732 39.0254 177.7102 33 K 3.9258 8.2503 119.0874 59.5779 31.8236 178.0950 34 N 4.2390 7.9547 116.1309 56.6633 38.8985 176.1063 35 W 4.8259 7.9585 116.8321 57.0537 29.1286 177.1171 36 G 3.9832 8.5331 108.4819 45.9766 0.0000 174.2831 37 L 4.7237 8.2144 122.7419 52.6399 40.4450 177.0004 38 K 3.8667 8.1515 123.6844 59.6161 32.5939 177.6031 39 R 3.8967 8.1281 118.7766 59.4791 29.9105 178.5293 40 L 4.0512 7.7628 118.3604 57.5182 41.5550 178.6342 41 N 4.4375 8.3344 117.1062 56.8517 38.9109 176.5066 42 D 4.4030 8.2064 120.1091 57.4949 40.9545 179.0736 43 V 3.3695 7.6544 118.4071 65.9395 31.4819 177.6658 44 E 3.8525 8.5493 119.4759 59.3403 29.5050 178.1177 45 Y 3.9493 8.3927 119.9814 61.1162 38.9302 177.7997 46 H 4.1026 8.3926 116.7859 58.2775 28.8085 177.4508 47 E 3.8213 8.1489 121.8564 58.9724 29.4279 178.5844 48 S 4.2287 8.1714 113.3266 61.5330 62.4803 176.1824 49 I 3.5672 7.5536 122.3975 64.4733 36.7884 178.0816 50 D 4.2589 7.9458 119.5778 57.5202 40.5537 178.8250 51 E 4.0704 8.1950 118.6677 59.2955 29.3713 179.2673 52 M 4.0344 7.8736 119.0522 58.2763 31.9944 178.7504 53 K 3.9028 8.0946 118.6052 59.7887 32.2215 179.0867 54 H 4.1017 8.0456 116.1359 58.7750 28.5983 177.5890 55 A 4.2257 8.3560 122.8813 55.3554 18.1648 179.1087 56 D 4.2918 8.2855 116.4654 57.6035 41.3084 178.7264 57 R 3.8595 7.9175 118.4895 59.4088 30.0525 178.6687 58 Y 4.3078 7.8280 116.4058 61.1499 37.9173 178.5646 59 I 3.7551 8.2564 121.0851 64.7009 37.1921 178.3851 60 E 4.0429 8.4102 119.3179 59.3052 29.1685 179.5134 61 R 4.0287 8.2086 118.8002 59.5113 30.1408 178.5511 62 I 3.7635 8.4108 120.0095 64.4565 37.1118 178.4596 63 L 4.0035 8.1501 119.7401 57.7735 41.2583 179.2790 64 F 4.3486 8.3904 119.7543 61.2472 39.6689 176.3795 65 L 4.5109 8.0788 117.6224 53.9245 41.2069 177.3124 66 E 3.8875 8.0069 117.6537 57.2575 27.0551 174.5771 67 G 3.9317 8.0088 108.9430 44.1393 0.0000 173.6239 68 L 4.5323 8.0128 119.2033 52.0004 42.0881 175.0855 69 P 4.3668 0.0000 0.0000 62.5481 31.7633 175.9821 70 N 4.7078 9.6014 122.2983 52.4107 38.7419 173.9735 71 L 4.6128 8.2994 124.1955 54.5231 42.4814 177.4894 72 Q 4.1017 8.5310 122.0171 57.9362 29.3318 175.7885 73 D 4.6828 8.0767 117.4123 52.5973 41.9713 175.2305 74 L 4.5265 8.2897 125.7272 52.6989 43.7961 176.2114 75 G 3.8082 8.4580 115.3521 44.6733 0.0000 171.9893 76 K 4.0322 8.3058 120.6851 56.1249 32.4378 176.5141 77 L 4.2551 8.3028 126.3035 54.4831 42.3812 176.4895 78 N 4.8058 8.7500 120.1206 51.7015 39.1746 172.4776 79 I 4.2381 8.1178 124.2687 59.7655 38.1515 176.6458 80 G 4.0475 8.7687 114.6175 45.1497 0.0000 172.7649 81 E 4.7316 8.6025 117.6683 56.2045 31.0756 176.3877 82 D 4.9130 7.6996 117.9476 50.2994 44.0475 176.0593 83 V 3.9997 8.4127 118.9098 66.5437 31.3559 177.4983 84 E 3.8565 8.1953 118.1836 59.4198 29.5026 178.2382 85 E 3.9764 8.4052 118.8832 59.4319 29.6622 178.7569 86 M 4.0504 8.2379 118.7489 58.4231 32.0145 178.7299 87 L 4.1500 8.2248 119.1361 58.0059 41.7307 179.8158 88 R 3.9310 8.4133 118.3937 59.2516 29.9649 179.1500 89 S 4.1542 8.3442 113.0207 61.4090 62.3613 175.8393 90 D 4.6949 8.4302 121.6918 57.3585 40.5763 178.4996 91 L 3.9437 8.2626 120.6352 58.3036 42.1482 178.9440 92 A 4.0349 8.3403 120.8637 55.0058 18.2755 179.3839 93 L 3.9765 8.1092 118.9611 58.3739 42.1248 179.0982 94 E 4.1169 8.6174 118.7844 59.3697 29.4472 179.3217 95 L 4.0269 8.1697 119.0632 58.0150 41.7750 179.3075 96 D 4.5107 8.3810 118.9556 57.3722 40.6532 179.1876 97 G 3.6391 8.3648 106.0763 47.6303 0.0000 175.6945 98 A 4.0264 8.4835 123.5644 54.6285 18.4889 179.4784 99 K 3.8351 8.0211 118.1028 59.9396 32.3220 178.7111 100 N 4.3902 8.0962 116.4134 56.2626 38.3961 177.3070 101 L 3.9972 8.1689 120.4876 57.9720 41.7495 179.7786 102 R 3.9019 8.2392 118.0933 59.1687 30.0303 178.6727 103 E 3.8258 8.0258 118.2698 59.3313 29.6017 178.7576 104 A 2.8994 7.7244 120.6215 54.8139 18.4377 179.6312 105 I 3.7229 8.1163 118.8863 64.3769 36.9325 178.8974 106 G 3.5908 7.7598 105.5347 47.9679 0.0000 174.8869 107 Y 4.1289 8.0061 122.0163 60.1888 38.8860 177.3697 108 A 3.7863 8.2316 122.1426 55.2975 18.3840 179.0396 109 D 4.1348 7.8326 116.0451 57.4357 41.1202 178.4616 110 S 4.1869 7.5133 112.7252 60.0390 63.2982 175.6534 111 V 3.9892 6.8382 114.0257 60.7215 31.6254 175.5708 112 H 2.7448 7.0827 114.2087 56.6075 26.9258 176.4597 113 D 4.5210 7.2927 121.3805 53.7305 37.9224 176.1199 114 Y 4.3266 7.4997 121.3527 60.5551 38.5057 177.7966 115 V 3.7338 7.8871 113.1974 64.2324 31.7356 178.5211 116 S 4.1932 8.3591 115.0466 61.4737 62.5836 176.5851 117 R 3.8895 8.0444 121.3822 59.5611 29.7878 178.0480 118 D 4.3211 8.3658 117.9027 57.5677 41.3008 177.8348 119 M 4.0065 8.2065 118.7023 59.0216 32.1692 178.1810 120 M 4.1776 8.2471 118.8683 58.2889 32.0817 178.8432 121 I 3.7298 8.1792 120.5770 64.2973 37.2528 178.2094 122 E 3.9779 8.0157 119.1737 59.4989 29.2148 179.5347 123 I 3.5630 7.5721 119.2917 64.2004 37.0600 178.1944 124 L 3.9523 8.1670 121.4081 58.1136 42.0073 178.9689 125 R 3.9027 8.1574 118.6541 59.6243 30.1571 178.2693 126 D 4.4375 8.1989 118.6610 57.4182 40.8005 178.6790 127 E 4.1351 8.4581 119.3408 59.5151 29.4588 179.2448 128 E 4.2680 8.7587 119.2083 59.1854 29.4558 179.5740 129 G 3.6924 8.0909 105.5829 48.1187 0.0000 175.2849 130 H 4.3982 8.2070 120.3306 59.0379 29.8776 177.2598 131 I 3.6973 8.3347 122.1378 64.4795 36.9248 177.8001 132 D 4.3330 8.3736 118.7393 57.0566 41.0087 178.0310 133 W 4.1000 8.2558 128.7322 60.4830 30.7236 177.6340 134 L 3.7764 8.4189 119.0529 58.0281 41.1332 179.3871 135 E 3.8959 8.4819 118.5745 59.7401 29.3016 179.7121 136 T 3.7415 7.9067 115.5671 66.5514 68.5399 176.4635 137 E 3.6823 7.7097 120.5685 59.4393 29.0945 179.4717 138 L 3.7544 7.6915 118.7626 57.8665 41.5530 179.4277 139 D 4.3455 7.9743 118.7820 57.2810 40.6623 178.7477 140 L 3.9470 7.9866 119.7478 57.7613 41.6247 179.5695 141 I 3.3727 7.3783 119.7570 64.3622 36.7388 178.2780 142 Q 3.9173 7.3330 117.8708 58.9863 28.9626 177.8886 143 K 4.1461 8.0768 119.1710 58.6382 32.3082 178.2833 144 M 4.3894 8.3284 114.9911 53.9502 32.5410 177.2741 145 G 4.1029 7.5386 105.4743 45.9529 0.0000 174.3799 146 L 3.9597 8.4151 121.5386 58.0242 42.1788 179.2723 147 Q 3.9723 8.0897 117.4576 59.3464 28.7224 178.7283 148 N 4.3506 8.1355 116.7173 56.3100 38.3733 176.6935 149 Y 3.9081 7.9078 120.1175 60.6120 39.1427 177.8298 150 L 4.0311 8.4471 120.2023 57.9504 41.6555 179.1945 151 Q 3.8836 8.1233 119.1248 59.1993 28.7230 177.9656 152 A 4.0975 7.7123 119.5054 53.6665 18.7007 178.3211 153 Q 4.2282 7.9304 116.3894 55.9506 29.2091 177.3361 154 I 4.1481 7.3109 112.6456 61.6073 38.2151 176.1842 155 R 4.6614 7.5526 119.6677 53.8288 32.4749 175.4787 156 E 4.2447 8.5695 119.4079 55.9787 30.5747 175.6207 157 E 4.4965 8.4196 117.8048 54.3981 31.7170 176.2456 *158 G 3.7099 8.5911 110.1171 45.8811 0.0000 172.3695 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 8.16 4.18 0.00 1.41 1.79 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.46 0.00 2 K 8.50 3.99 0.00 1.70 1.72 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.46 7.81 3 G 8.70 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 4 D 8.48 4.53 0.00 2.77 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.98 3.88 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 6 K 8.14 3.82 0.00 1.71 2.06 0.00 1.38 0.00 0.00 1.41 0.00 0.00 2.54 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.30 0.96 7.81 7 V 8.65 3.91 2.36 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 1.08 0.00 0.00 1.19 0.00 0.00 8 I 7.83 3.74 2.06 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.60 0.91 0.00 0.00 9 N 8.24 4.28 0.00 2.62 2.66 0.00 0.00 7.08 7.09 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 10 Y 8.06 4.07 0.00 3.21 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 8.48 3.87 0.00 2.02 1.77 1.09 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.56 4.39 0.00 2.76 2.81 0.00 0.00 6.69 7.88 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 13 K 8.13 3.87 0.00 1.82 1.97 0.00 1.58 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.43 1.44 7.81 14 L 8.14 3.79 0.00 0.78 1.18 0.92 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.75 3.98 0.00 1.69 1.84 1.01 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.18 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 17 N 8.01 4.35 0.00 2.92 2.89 0.00 0.00 7.08 7.75 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 18 E 8.28 4.01 0.00 2.23 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.86 0.00 19 L 8.19 4.01 0.00 1.79 1.68 0.90 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.65 3.47 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.95 0.00 0.00 21 A 7.88 3.23 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.98 3.56 1.96 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.90 0.85 0.00 0.00 23 N 7.80 4.35 0.00 2.78 2.84 0.00 0.00 6.76 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 24 Q 8.16 3.87 0.00 2.02 1.98 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 2.59 2.22 0.00 25 Y 8.30 4.61 0.00 3.02 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 F 8.50 3.81 0.00 3.41 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 27 L 8.22 3.96 0.00 1.95 1.60 0.90 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.34 3.83 0.00 3.46 2.98 0.00 5.70 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 8.10 4.06 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 30 R 7.61 3.86 0.00 1.76 1.87 0.00 3.24 0.00 0.00 3.06 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.66 0.00 31 M 7.74 3.45 0.00 1.01 1.63 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.18 0.00 32 F 7.58 4.64 0.00 3.29 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.25 3.93 0.00 2.07 1.89 0.00 1.66 0.00 0.00 1.48 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.42 7.81 34 N 7.95 4.24 0.00 2.66 2.65 0.00 0.00 7.35 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 35 W 7.96 4.83 0.00 3.75 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 36 G 8.53 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.21 4.72 0.00 1.89 1.62 1.21 0.59 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 38 K 8.15 3.87 0.00 2.02 1.81 0.00 1.62 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.57 7.81 39 R 8.13 3.90 0.00 2.12 2.00 0.00 3.55 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 40 L 7.76 4.05 0.00 1.69 1.11 1.07 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.33 4.44 0.00 3.10 3.01 0.00 0.00 7.20 7.89 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 42 D 8.21 4.40 0.00 2.89 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 V 7.65 3.37 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 0.81 0.00 0.00 44 E 8.55 3.85 0.00 2.48 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 2.59 2.55 0.00 45 Y 8.39 3.95 0.00 2.92 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 46 H 8.39 4.10 0.00 3.26 3.27 0.00 5.67 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.15 3.82 0.00 2.10 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 48 S 8.17 4.23 0.00 4.10 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 49 I 7.55 3.57 1.82 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.35 0.83 0.00 0.00 50 D 7.95 4.26 0.00 2.98 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 E 8.20 4.07 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.51 0.00 52 M 7.87 4.03 0.00 2.04 2.24 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.53 0.00 53 K 8.09 3.90 0.00 1.88 1.81 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.63 7.81 54 H 8.05 4.10 0.00 3.42 3.32 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 8.36 4.23 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 56 D 8.29 4.29 0.00 2.91 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 57 R 7.92 3.86 0.00 1.82 1.76 0.00 3.13 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.73 0.00 58 Y 7.83 4.31 0.00 3.21 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.26 3.76 2.03 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.01 0.95 0.00 0.00 60 E 8.41 4.04 0.00 2.02 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 2.49 0.00 61 R 8.21 4.03 0.00 2.13 2.20 0.00 3.35 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.86 0.00 62 I 8.41 3.76 2.07 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 1.58 0.72 0.97 0.00 0.00 63 L 8.15 4.00 0.00 2.11 1.79 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.39 4.35 0.00 2.95 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 L 8.08 4.51 0.00 1.85 1.61 1.04 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.01 3.89 0.00 2.07 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 2.14 2.24 0.00 67 G 8.01 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.01 4.53 0.00 1.59 1.62 0.92 0.98 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 69 P 0.00 4.37 0.00 2.05 2.02 0.00 3.66 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 70 N 9.60 4.71 0.00 2.60 2.81 0.00 0.00 7.08 8.41 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 71 L 8.30 4.61 0.00 1.62 1.63 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.53 4.10 0.00 1.97 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.61 6.68 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 73 D 8.08 4.68 0.00 2.67 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 74 L 8.29 4.53 0.00 1.51 1.50 0.88 1.10 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 75 G 8.46 3.81 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 0.00 0.00 0.00 76 K 8.31 4.03 0.00 1.73 1.74 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.46 7.81 77 L 8.30 4.26 0.00 1.65 1.57 0.88 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 78 N 8.75 4.81 0.00 2.65 2.74 0.00 0.00 7.14 7.23 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 79 I 8.12 4.24 1.90 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 1.35 0.95 0.95 0.00 0.00 80 G 8.77 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 81 E 8.60 4.73 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 82 D 7.70 4.91 0.00 2.75 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 8.41 4.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 1.20 0.00 0.00 84 E 8.20 3.86 0.00 2.00 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 2.34 2.28 0.00 85 E 8.41 3.98 0.00 2.41 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 2.36 2.39 0.00 86 M 8.24 4.05 0.00 1.80 2.42 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.39 0.00 87 L 8.22 4.15 0.00 2.02 1.71 1.24 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 88 R 8.41 3.93 0.00 1.86 2.00 0.00 3.12 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 89 S 8.34 4.15 0.00 4.04 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 90 D 8.43 4.69 0.00 3.06 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 8.26 3.94 0.00 1.84 1.89 0.94 0.97 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 92 A 8.34 4.03 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 L 8.11 3.98 0.00 1.99 2.05 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.62 4.12 0.00 2.25 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 2.69 2.49 0.00 95 L 8.17 4.03 0.00 2.05 1.75 0.95 0.95 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 96 D 8.38 4.51 0.00 2.87 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 97 G 8.36 3.64 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 0.00 0.00 0.00 98 A 8.48 4.03 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.02 3.84 0.00 2.13 1.90 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.66 7.81 100 N 8.10 4.39 0.00 3.00 2.90 0.00 0.00 7.12 6.72 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 0.00 101 L 8.17 4.00 0.00 1.98 1.75 1.01 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.24 3.90 0.00 1.98 1.98 0.00 3.14 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 1.66 1.92 0.00 103 E 8.03 3.83 0.00 2.08 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 2.33 2.38 0.00 104 A 7.72 2.90 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 I 8.12 3.72 2.03 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 0.98 0.92 0.00 0.00 106 G 7.76 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 0.00 107 Y 8.01 4.13 0.00 3.16 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 0.00 108 A 8.23 3.79 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 0.00 109 D 7.83 4.13 0.00 2.87 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 0.00 110 S 7.51 4.19 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 0.00 111 V 6.84 3.99 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 0.49 0.00 0.00 0.65 0.00 0.00 112 H 7.08 2.74 0.00 3.15 3.26 0.00 5.84 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.29 4.52 0.00 2.63 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 0.00 114 Y 7.50 4.33 0.00 3.11 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 V 7.89 3.73 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.97 0.00 0.00 116 S 8.36 4.19 0.00 4.17 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 0.00 117 R 8.04 3.89 0.00 1.91 2.20 0.00 3.33 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 118 D 8.37 4.32 0.00 2.97 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 M 8.21 4.01 0.00 2.25 2.02 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 120 M 8.25 4.18 0.00 2.17 2.25 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 2.92 2.84 0.00 121 I 8.18 3.73 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.86 0.92 0.00 0.00 122 E 8.02 3.98 0.00 2.10 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 2.32 2.50 0.00 123 I 7.57 3.56 1.94 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 1.08 0.55 0.72 0.00 0.00 124 L 8.17 3.95 0.00 1.85 1.86 0.95 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 125 R 8.16 3.90 0.00 2.08 2.12 0.00 3.16 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 126 D 8.20 4.44 0.00 3.01 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 0.00 127 E 8.46 4.14 0.00 2.15 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.57 0.00 128 E 8.76 4.27 0.00 2.03 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 2.37 2.53 0.00 129 G 8.09 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 0.00 0.00 0.00 130 H 8.21 4.40 0.00 3.38 3.56 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 I 8.33 3.70 2.06 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 1.45 0.63 0.94 0.00 0.00 132 D 8.37 4.33 0.00 2.95 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 W 8.26 4.10 0.00 3.52 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 0.00 134 L 8.42 3.78 0.00 2.01 1.70 1.22 1.14 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 0.00 135 E 8.48 3.90 0.00 2.09 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 2.31 2.49 0.00 136 T 7.91 3.74 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 137 E 7.71 3.68 0.00 1.49 1.57 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 1.47 1.47 0.00 138 L 7.69 3.75 0.00 1.69 1.60 0.90 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 139 D 7.97 4.35 0.00 2.77 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 L 7.99 3.95 0.00 1.83 1.82 0.92 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.38 3.37 1.71 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 -0.06 -0.20 0.71 0.00 0.00 142 Q 7.33 3.92 0.00 2.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.00 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 143 K 8.08 4.15 0.00 1.74 1.83 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.47 7.81 144 M 8.33 4.39 0.00 2.17 2.19 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 2.65 2.86 0.00 145 G 7.54 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 L 8.42 3.96 0.00 1.74 1.66 0.94 0.69 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 0.00 147 Q 8.09 3.97 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.68 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 148 N 8.14 4.35 0.00 2.96 2.88 0.00 0.00 6.67 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 7.91 3.91 0.00 3.02 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 0.00 150 L 8.45 4.03 0.00 1.99 1.68 1.03 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 8.12 3.88 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 152 A 7.71 4.10 1.20 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 0.00 0.00 153 Q 7.93 4.23 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.12 2.14 0.00 154 I 7.31 4.15 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.23 1.00 0.00 0.00 155 R 7.55 4.66 0.00 1.77 1.84 0.00 3.19 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 156 E 8.57 4.24 0.00 2.09 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 2.29 0.00 157 E 8.42 4.50 0.00 2.07 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 2.19 2.27 0.00 *158 G 8.59 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 * Residues marked with a * may have inaccurate shift predictions.