NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1810 8.1633 120.2792 54.6618 33.0925 174.1788 2 K 3.9648 8.5026 126.3503 56.2695 32.4329 175.7342 3 G 3.9382 8.6772 113.6452 44.8432 0.0000 171.9079 4 D 4.5346 8.4828 119.8085 54.4153 41.8595 176.7857 5 T 3.8728 9.0012 123.1914 66.9659 68.4938 176.3813 6 K 3.8302 8.1409 120.7713 59.2024 32.2511 178.7534 7 V 3.9128 8.6963 118.9770 66.2189 31.4255 177.8739 8 I 3.7400 7.8260 119.4171 64.7210 36.9217 178.0907 9 N 4.2771 8.2319 117.0189 56.4277 38.3084 177.0921 10 Y 4.0604 8.0694 118.1234 61.0899 38.0041 178.5428 11 L 3.8751 8.4750 120.2377 58.0378 41.6739 179.4629 12 N 4.3742 8.5491 116.7080 55.9960 38.4051 177.4814 13 K 3.8690 8.1342 121.3049 59.3525 32.3117 178.9366 14 L 3.8017 8.1463 119.6687 57.5217 41.3858 178.9352 15 L 3.9852 7.7505 120.8078 58.2471 42.0378 179.0554 16 G 3.7346 8.1725 105.5993 48.1704 0.0000 175.1917 17 N 4.3482 8.0150 119.0217 56.0597 38.5644 177.4066 18 E 4.0029 8.3592 119.9229 59.3626 29.4035 179.3852 19 L 4.0051 8.1680 119.2711 57.6155 41.5509 179.8015 20 V 3.4638 7.6470 117.4646 65.9828 31.5477 177.9216 21 A 3.2355 7.8984 120.5020 54.8012 18.0911 179.3724 22 I 3.5596 7.9701 118.6391 64.8448 37.2211 178.3970 23 N 4.3568 7.7995 116.8188 56.3497 38.3280 177.4187 24 Q 3.8767 8.1740 121.2088 59.4787 29.0823 177.9009 25 Y 4.6059 8.3088 118.2464 60.8679 37.9429 178.1100 26 F 3.8048 8.4570 121.8381 61.0511 39.5319 176.9540 27 L 3.9507 8.2069 120.0118 58.5479 41.8534 178.4724 28 H 3.8163 8.3280 116.0341 58.7050 28.5487 177.4000 29 A 4.0675 8.0884 122.5960 55.5181 18.1784 179.8419 30 R 3.8468 7.6292 115.2642 58.4859 30.1236 179.2377 31 M 3.4563 7.7433 119.2857 58.1713 31.8575 178.3690 32 F 4.6401 7.5804 118.0229 60.6656 39.0198 177.7097 33 K 3.9260 8.2737 119.1329 59.5852 31.8264 178.1023 34 N 4.2385 7.9910 116.1903 56.6576 38.8903 176.0815 35 W 4.8380 7.9838 116.8582 56.9928 29.0381 177.1074 36 G 3.9805 8.5026 108.4213 46.0207 0.0000 174.3361 37 L 4.7371 8.2152 122.7438 52.6307 40.4495 176.9905 38 K 3.8684 8.1338 123.6329 59.6469 32.5927 177.6174 39 R 3.9034 8.1462 118.7871 59.4390 29.8976 178.5340 40 L 4.0445 7.7552 118.3948 57.5269 41.5695 178.6209 41 N 4.4388 8.3493 117.0881 56.8487 38.9020 176.5124 42 D 4.4006 8.2014 120.0980 57.4873 40.9856 179.0499 43 V 3.3668 7.6485 118.4072 65.9593 31.4747 177.6810 44 E 3.8659 8.5337 119.4397 59.3221 29.4938 178.1035 45 Y 3.9451 8.4085 120.0202 61.1078 38.9338 177.7977 46 H 4.0979 8.3830 116.7417 58.2247 28.7927 177.4423 47 E 3.8216 8.1047 121.8371 58.9604 29.4221 178.5500 48 S 4.2220 8.1690 113.3252 61.5568 62.4894 176.1902 49 I 3.5698 7.5656 122.4033 64.4509 36.7778 178.0777 50 D 4.2604 7.9479 119.5936 57.5310 40.5613 178.8352 51 E 4.0649 8.1955 118.7196 59.3307 29.3773 179.2742 52 M 4.0364 7.8885 119.0590 58.2734 32.0012 178.7598 53 K 3.9082 8.0898 118.6009 59.7809 32.2102 179.0955 54 H 4.1102 8.0429 116.1440 58.7844 28.5891 177.6013 55 A 4.2257 8.3617 122.8948 55.3400 18.1571 179.1116 56 D 4.2876 8.2816 116.4583 57.5927 41.3109 178.7205 57 R 3.8587 7.9387 118.4828 59.4212 30.0528 178.6668 58 Y 4.3155 7.8455 116.4068 61.1575 37.8842 178.5908 59 I 3.7598 8.2419 121.0668 64.6729 37.2012 178.3889 60 E 4.0294 8.4150 119.3516 59.3057 29.1747 179.4961 61 R 4.0344 8.2183 118.7810 59.5184 30.1520 178.5536 62 I 3.7624 8.3909 120.0133 64.4494 37.1047 178.4544 63 L 3.9988 8.1733 119.7537 57.7915 41.2653 179.2618 64 F 4.3338 8.4316 119.7693 61.2683 39.6740 176.3719 65 L 4.5206 8.0838 117.6031 53.9242 41.2040 177.3238 66 E 3.8556 8.0108 117.6643 57.2513 27.0765 174.6148 67 G 3.9328 7.9639 109.0302 44.1624 0.0000 173.5952 68 L 4.5410 8.0167 119.2753 51.9953 42.1683 175.0484 69 P 4.3659 0.0000 0.0000 62.5372 31.7693 175.9905 70 N 4.7063 9.6770 122.4435 52.4142 38.7428 173.9871 71 L 4.6086 8.2958 124.2249 54.5265 42.4700 177.5039 72 Q 4.0955 8.5225 122.0276 57.9971 29.3168 175.8134 73 D 4.6733 8.0810 117.4219 52.6299 41.9394 175.2343 74 L 4.5244 8.2911 125.7614 52.6968 43.7771 176.2014 75 G 3.8069 8.4575 115.3623 44.6794 0.0000 171.9705 76 K 4.0325 8.3064 120.6835 56.1170 32.4289 176.5205 77 L 4.2513 8.3061 126.3229 54.4989 42.3702 176.4979 78 N 4.8099 8.7466 120.1498 51.6982 39.1615 172.4732 79 I 4.2377 8.1122 124.2311 59.7701 38.1869 176.6395 80 G 4.0483 8.7671 114.5767 45.1477 0.0000 172.7934 81 E 4.7348 8.6011 117.6635 56.1893 31.0989 176.3757 82 D 4.9103 7.6997 117.9529 50.3085 44.0640 176.0821 83 V 4.0098 8.4031 118.8919 66.5287 31.3704 177.5089 84 E 3.8645 8.1909 118.2234 59.4016 29.5124 178.2282 85 E 3.9738 8.4066 118.8867 59.4270 29.6560 178.7554 86 M 4.0504 8.2580 118.7491 58.4173 32.0090 178.7372 87 L 4.1456 8.2047 119.1076 58.0029 41.7298 179.8092 88 R 3.9304 8.4053 118.3888 59.2396 29.9603 179.1570 89 S 4.1524 8.2416 113.0121 61.4108 62.3734 175.8111 90 D 4.6953 8.4311 121.6967 57.3835 40.5677 178.5168 91 L 3.9427 8.2557 120.5975 58.3142 42.1453 178.9396 92 A 4.0278 8.3576 120.8919 55.0297 18.2666 179.3825 93 L 3.9810 8.1205 118.9651 58.3556 42.1168 179.1023 94 E 4.1150 8.6151 118.7840 59.3642 29.4517 179.3069 95 L 4.0294 8.1878 119.1055 58.0192 41.7654 179.3300 96 D 4.5128 8.3954 118.9662 57.3370 40.6486 179.1644 97 G 3.6375 8.3433 106.1279 47.6363 0.0000 175.6978 98 A 4.0272 8.4860 123.5731 54.6204 18.4806 179.4860 99 K 3.8381 8.0212 118.1036 59.9346 32.3262 178.7259 100 N 4.3928 8.1002 116.4334 56.2604 38.3845 177.3165 101 L 3.9995 8.1650 120.4883 57.9649 41.7466 179.7661 102 R 3.9000 8.2639 118.1476 59.1940 30.0320 178.7019 103 E 3.8301 8.0297 118.2466 59.3022 29.6103 178.7469 104 A 2.8807 7.7256 120.6522 54.8177 18.4282 179.6417 105 I 3.7299 8.0953 118.8704 64.3645 36.9255 178.9154 106 G 3.5819 7.7617 105.5892 47.9572 0.0000 174.9005 107 Y 4.1245 7.9992 122.0248 60.1792 38.8808 177.3494 108 A 3.7764 8.2393 122.1665 55.3032 18.3915 179.0260 109 D 4.1340 7.8217 116.0264 57.4473 41.1150 178.4688 110 S 4.1876 7.5003 112.7049 60.0282 63.3024 175.6512 111 V 3.9936 6.8412 114.0081 60.7412 31.6363 175.5801 112 H 2.7771 7.0851 114.2524 56.6070 26.8849 176.4663 113 D 4.5218 7.3033 121.3889 53.7383 37.9372 176.1099 114 Y 4.3207 7.5250 121.3891 60.5550 38.5087 177.7811 115 V 3.7313 7.8837 113.1846 64.2341 31.7421 178.5240 116 S 4.1942 8.3466 114.9926 61.4670 62.5837 176.5771 117 R 3.8892 8.0085 121.3841 59.5703 29.7687 178.0331 118 D 4.3226 8.3702 117.9079 57.5768 41.2968 177.8346 119 M 4.0045 8.2006 118.6826 59.0263 32.1683 178.1803 120 M 4.1776 8.2416 118.8556 58.2833 32.0823 178.8460 121 I 3.7280 8.1783 120.5769 64.3085 37.2594 178.2001 122 E 3.9782 8.0053 119.2127 59.4981 29.2158 179.5452 123 I 3.5575 7.5710 119.2771 64.2113 37.0635 178.1821 124 L 3.9522 8.1570 121.3926 58.1266 41.9990 178.9893 125 R 3.8993 8.1576 118.6403 59.6114 30.1618 178.2700 126 D 4.4369 8.1954 118.6749 57.4251 40.7974 178.6831 127 E 4.1353 8.4529 119.3314 59.5043 29.4606 179.2397 128 E 4.2610 8.7463 119.1990 59.1828 29.4499 179.5608 129 G 3.6982 8.0886 105.5824 48.1345 0.0000 175.2820 130 H 4.4022 8.2133 120.3678 59.0325 29.8640 177.2680 131 I 3.6979 8.3356 122.1441 64.4648 36.9192 177.8026 132 D 4.3337 8.3714 118.7494 57.0527 41.0056 178.0269 133 W 4.1056 8.2623 128.7441 60.4915 30.7275 177.6199 134 L 3.7763 8.4169 119.0501 58.0367 41.1418 179.3848 135 E 3.8975 8.4627 118.5505 59.7577 29.3028 179.7286 136 T 3.7504 7.9116 115.5629 66.5420 68.5394 176.4847 137 E 3.6819 7.7335 120.6104 59.4328 29.0807 179.4610 138 L 3.7552 7.6876 118.7638 57.8810 41.5639 179.4323 139 D 4.3471 7.9903 118.7708 57.2761 40.6571 178.7590 140 L 3.9523 7.9959 119.7653 57.7426 41.5973 179.5659 141 I 3.3745 7.3911 119.7778 64.3591 36.7394 178.2790 142 Q 3.9142 7.3354 117.8883 58.9893 28.9580 177.9006 143 K 4.1464 8.0574 119.1435 58.6517 32.3166 178.2895 144 M 4.3843 8.3278 114.9700 53.9625 32.5286 177.2499 145 G 4.1023 7.5563 105.6537 45.9636 0.0000 174.3734 146 L 3.9559 8.4224 121.6440 58.0244 42.1777 179.2779 147 Q 3.9736 8.0918 117.4499 59.3488 28.7285 178.7274 148 N 4.3500 8.1371 116.7054 56.3159 38.3731 176.6810 149 Y 3.9181 7.9133 120.1061 60.6131 39.1307 177.8462 150 L 4.0310 8.4233 120.1988 57.9624 41.6610 179.1787 151 Q 3.8844 8.0931 119.1171 59.2314 28.7137 178.0077 152 A 4.0969 7.7333 119.4860 53.6756 18.6949 178.3221 153 Q 4.2277 7.9365 116.3936 55.9293 29.1963 177.3084 154 I 4.1488 7.3129 112.6695 61.5701 38.2344 176.1769 155 R 4.6605 7.5523 119.6729 53.8338 32.4622 175.4853 156 E 4.2461 8.5666 119.3966 55.9747 30.5780 175.6170 157 E 4.4958 8.4195 117.7889 54.3951 31.7113 176.2471 *158 G 3.7098 8.5930 110.1521 45.8771 0.0000 172.3657 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 -0.04 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 3.96 0.00 1.71 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 8.68 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 9.00 3.87 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 3.83 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 2.39 0.00 0.00 0.00 0.00 0.30 0.97 7.81 7 V 8.70 3.91 2.37 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 1.12 0.00 0.00 1.15 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 8.23 4.28 0.00 2.62 2.67 0.00 0.00 7.09 7.06 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 10 Y 8.07 4.06 0.00 3.21 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 11 L 8.48 3.88 0.00 2.03 1.77 1.11 0.82 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 8.55 4.37 0.00 2.76 2.81 0.00 0.00 6.69 7.86 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 13 K 8.13 3.87 0.00 1.82 1.96 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 8.15 3.80 0.00 0.79 1.17 0.92 0.50 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 3.99 0.00 1.69 1.84 1.05 1.07 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 16 G 8.17 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 17 N 8.01 4.35 0.00 2.92 2.89 0.00 0.00 7.10 7.53 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 18 E 8.36 4.00 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 8.17 4.01 0.00 1.79 1.68 0.90 0.90 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 3.46 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 1.04 0.00 0.00 0.91 0.00 0.00 21 A 7.90 3.24 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.97 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 0.99 0.85 0.00 0.00 23 N 7.80 4.36 0.00 2.78 2.84 0.00 0.00 6.76 8.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 Q 8.17 3.88 0.00 2.03 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 2.60 2.22 0.00 25 Y 8.31 4.61 0.00 3.01 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 F 8.46 3.80 0.00 3.42 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 8.21 3.95 0.00 1.96 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 8.33 3.82 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 8.09 4.07 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 7.63 3.85 0.00 1.76 1.88 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 1.34 1.67 0.00 31 M 7.74 3.46 0.00 1.01 1.63 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.18 0.00 32 F 7.58 4.64 0.00 3.30 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 8.27 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 7.99 4.24 0.00 2.65 2.65 0.00 0.00 7.35 8.07 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 35 W 7.98 4.84 0.00 3.73 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.50 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 8.22 4.74 0.00 1.89 1.62 1.19 0.63 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 38 K 8.13 3.87 0.00 2.02 1.81 0.00 1.62 0.00 0.00 1.76 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 8.15 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 4.04 0.00 1.68 1.08 1.11 0.27 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 8.35 4.44 0.00 3.10 3.01 0.00 0.00 7.21 7.77 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 42 D 8.20 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 -0.40 0.00 0.00 0.75 0.00 0.00 44 E 8.53 3.87 0.00 2.49 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.55 0.00 45 Y 8.41 3.95 0.00 2.92 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 46 H 8.38 4.10 0.00 3.26 3.26 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 8.10 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 1.64 1.77 0.00 48 S 8.17 4.22 0.00 4.09 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 7.57 3.57 1.82 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.41 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 4.06 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 2.72 2.52 0.00 52 M 7.89 4.04 0.00 2.04 2.24 0.00 0.00 0.00 0.00 0.00 2.06 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 3.91 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 8.04 4.11 0.00 3.41 3.31 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 8.28 4.29 0.00 2.92 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 7.94 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 7.85 4.32 0.00 3.21 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 59 I 8.24 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 0.83 0.95 0.00 0.00 60 E 8.42 4.03 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 2.50 0.00 61 R 8.22 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 8.39 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 0.66 1.01 0.00 0.00 63 L 8.17 4.00 0.00 2.11 1.79 0.95 0.91 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 8.43 4.33 0.00 2.95 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 L 8.08 4.52 0.00 1.85 1.61 0.99 0.94 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 3.86 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 2.15 2.24 0.00 67 G 7.96 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 8.02 4.54 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 1.72 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 3.80 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 9.68 4.71 0.00 2.60 2.81 0.00 0.00 7.08 7.95 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 71 L 8.30 4.61 0.00 1.62 1.63 0.93 0.97 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 72 Q 8.52 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 6.69 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 73 D 8.08 4.67 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 4.52 0.00 1.51 1.51 0.88 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 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 8.31 4.25 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 7.15 7.24 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 79 I 8.11 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 8.40 4.01 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 1.16 0.00 0.00 1.19 0.00 0.00 84 E 8.19 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 3.97 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 8.26 4.05 0.00 1.79 2.41 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.39 0.00 87 L 8.20 4.15 0.00 2.02 1.71 1.23 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 88 R 8.41 3.93 0.00 1.86 2.00 0.00 3.12 0.00 0.00 3.09 7.58 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 8.24 4.15 0.00 4.04 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.43 4.70 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 0.98 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 8.36 4.03 1.36 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 93 L 8.12 3.98 0.00 1.99 2.05 0.93 0.70 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 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 8.19 4.03 0.00 2.05 1.75 0.95 0.98 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 8.40 4.51 0.00 2.86 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 8.34 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 8.49 4.03 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 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 7.11 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 L 8.17 4.00 0.00 1.98 1.75 0.99 1.24 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 8.26 3.90 0.00 1.97 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 7.73 2.88 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 8.10 3.73 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 0.97 0.92 0.00 0.00 106 G 7.76 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 Y 8.00 4.12 0.00 3.15 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 0.00 108 A 8.24 3.78 1.35 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 0.00 109 D 7.82 4.13 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 7.50 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 0.53 0.00 0.00 0.64 0.00 0.00 112 H 7.09 2.78 0.00 3.15 3.27 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 7.30 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 7.52 4.32 0.00 3.10 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 0.00 115 V 7.88 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 0.96 0.00 0.00 0.96 0.00 0.00 116 S 8.35 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 8.01 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 8.20 4.00 0.00 2.26 2.02 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.45 0.00 120 M 8.24 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 0.87 0.92 0.00 0.00 122 E 8.01 3.98 0.00 2.09 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 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.55 0.75 0.00 0.00 124 L 8.16 3.95 0.00 1.85 1.85 0.95 1.02 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 2.07 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 8.45 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 8.75 4.26 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 2.52 0.00 129 G 8.09 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.34 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 0.65 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 4.11 0.00 3.51 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 2.00 1.70 1.17 1.15 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 8.46 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 3.75 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 137 E 7.73 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 3.76 0.00 1.69 1.60 0.87 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 7.99 4.35 0.00 2.78 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 8.00 3.95 0.00 1.83 1.82 0.93 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 7.39 3.37 1.71 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.05 -0.28 0.71 0.00 0.00 142 Q 7.34 3.91 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 8.06 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 4.38 0.00 2.17 2.19 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 2.65 2.86 0.00 145 G 7.56 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 0.70 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 3.92 0.00 3.00 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 0.00 150 L 8.42 4.03 0.00 2.00 1.68 1.03 0.98 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 8.09 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 7.73 4.10 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 7.94 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 1.18 0.90 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 1.56 0.00 156 E 8.57 4.25 0.00 2.07 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.