NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2339 8.1476 120.2503 54.6473 32.7208 174.6237 2 K 4.3612 8.3333 126.5855 56.6235 33.1520 176.4525 3 G 3.8514 8.6834 111.3533 45.1357 0.0000 167.5770 4 D 4.3948 8.5648 131.0644 54.1446 41.1660 174.4320 5 T 3.8305 8.5968 123.8049 66.7837 68.5477 176.1534 6 K 3.7150 8.1896 120.8098 59.5323 32.0484 178.7271 7 V 3.8915 8.1276 117.9418 66.2786 31.6450 178.1865 8 I 3.7928 7.7932 119.2550 64.0096 36.8159 178.2722 9 N 4.2955 8.1138 117.8608 56.2947 38.3362 176.9974 10 Y 4.0738 7.9035 118.0865 61.0479 37.9417 178.5929 11 L 3.8611 8.2343 120.0022 58.0353 41.7759 179.4785 12 N 4.2960 8.0756 116.1018 55.9298 38.4043 177.5302 13 K 3.9058 7.9523 121.2897 59.3631 32.2954 178.9559 14 L 4.0183 8.0416 119.6825 57.5542 41.3853 179.1895 15 L 3.9677 7.6663 120.4746 58.0138 42.1342 179.2482 16 G 3.5873 7.9474 105.5999 47.8920 0.0000 175.2146 17 N 4.3509 8.0315 118.9980 56.1687 38.5247 177.3227 18 E 4.0604 8.1194 119.7397 59.4855 29.4421 179.2677 19 L 4.0224 8.1507 119.3506 57.9236 41.6260 180.1043 20 V 3.6202 7.8113 118.4165 64.6748 31.3732 178.3551 21 A 3.8560 7.8991 121.7474 54.7155 18.2283 179.6318 22 I 3.8415 8.0714 111.8407 64.2984 37.7349 178.3419 23 N 4.3725 7.9382 118.3394 56.0775 38.4314 177.2713 24 Q 3.8815 8.2708 121.1059 59.3757 29.1484 177.7969 25 Y 4.4356 8.0808 117.8886 60.9824 37.9258 178.1417 26 F 3.9920 8.5907 121.8693 60.9416 39.4606 177.1733 27 L 3.9863 8.0516 119.8876 58.3793 41.8680 178.4985 28 H 3.8047 8.2551 115.9403 58.7027 28.5757 177.2698 29 A 4.1685 8.0202 122.3642 55.7231 18.2136 180.0885 30 R 3.7660 7.6836 115.6947 59.0670 30.0954 179.3839 31 M 3.4479 7.6835 119.1058 57.9197 31.8234 178.6180 32 F 4.3719 7.4952 117.9102 60.4669 39.1891 177.2575 33 K 3.7948 8.2720 119.5767 59.9162 31.6901 177.7963 34 N 4.2575 7.6569 115.4063 56.7573 38.8413 176.1592 35 W 4.7941 7.6964 117.5360 57.6606 29.2574 177.2343 36 G 4.0742 8.8999 108.5575 45.4403 0.0000 173.6739 37 L 4.6385 7.9094 121.9188 52.9044 39.4520 177.0328 38 K 3.9347 8.1195 122.6798 59.3401 32.4838 178.3372 39 R 3.8583 8.2901 119.1658 59.4903 30.0142 178.6454 40 L 4.0508 7.7565 118.3345 57.4929 41.6015 178.8486 41 N 4.4503 8.1829 116.9878 56.8017 38.8322 176.5916 42 D 4.3525 8.2240 120.4462 57.4077 41.0491 179.1422 43 V 3.3216 7.6301 118.3569 66.0936 31.4327 177.8878 44 E 3.7983 8.1110 118.2615 59.4259 29.3893 178.9659 45 Y 3.8544 8.0971 119.5893 61.0185 38.9356 177.6345 46 H 4.0595 7.9321 119.0976 59.0369 29.7935 177.0811 47 E 3.6830 7.5986 120.2897 58.9633 29.0442 179.1198 48 S 4.0931 7.4021 113.2902 61.4466 62.4869 176.3365 49 I 3.6172 7.2278 122.1185 64.1296 36.6460 178.1956 50 D 4.1450 7.8376 119.7984 57.4476 40.6197 178.5261 51 E 4.0243 8.2581 119.1594 59.8608 29.3274 179.3650 52 M 4.0431 8.1689 118.5842 58.4481 31.9907 178.9506 53 K 4.0467 7.9241 118.4031 59.2450 32.2685 179.1493 54 H 4.1308 8.3508 116.7580 58.7930 28.6366 177.4542 55 A 4.2284 8.2862 122.6560 55.5137 18.2526 179.1576 56 D 4.3031 7.9368 116.3457 57.4283 41.1784 178.6859 57 R 3.8382 7.7581 118.2069 59.4228 30.0416 178.6259 58 Y 4.2680 7.5321 115.8562 61.2538 38.0154 178.4690 59 I 3.7992 8.0630 120.7825 64.7433 37.2205 178.3803 60 E 4.0703 8.2676 119.2191 59.1632 29.3207 179.3666 61 R 4.0023 8.1159 118.8780 59.5595 30.2289 178.5946 62 I 3.8004 8.3151 120.0618 64.5178 36.9708 178.4735 63 L 4.1129 8.0030 119.6178 57.5333 41.1835 179.3725 64 F 4.2848 8.1136 119.8322 61.3576 39.8058 176.9148 65 L 4.5674 7.9350 118.1477 54.5658 41.5080 176.5981 66 E 3.4988 7.8663 117.3259 57.8410 26.6381 173.4372 67 G 4.1433 8.3754 107.0447 43.4805 0.0000 172.2349 68 L 4.6282 8.0715 120.2596 52.1097 43.6026 174.3167 69 P 4.3959 0.0000 0.0000 62.7864 31.8194 175.6949 70 N 4.7212 9.2729 121.5139 52.4922 38.6498 173.9971 71 L 4.6900 8.3706 124.7485 54.5535 42.3961 177.3394 72 Q 4.2229 8.3726 122.2523 57.3389 29.7299 175.6701 73 D 4.6707 8.1001 117.7397 52.8933 41.7160 175.2171 74 L 4.6105 8.3538 126.0067 53.0870 44.1177 176.1816 75 G 3.9685 8.2043 113.7533 43.9712 0.0000 172.7920 76 K 4.1426 8.3395 118.8683 55.9058 32.5233 176.7254 77 L 4.3620 8.3923 124.0315 53.2979 42.7360 175.8248 78 N 4.7043 8.3899 122.7769 51.7528 38.1423 174.3736 79 I 3.7959 7.7436 126.0560 61.9468 37.9068 177.3187 80 G 4.2909 8.2224 108.2026 45.7626 0.0000 172.8334 81 E 4.7172 8.7830 119.9187 55.9475 30.8622 176.3604 82 D 4.9830 7.7983 118.9810 50.4350 43.8187 176.2975 83 V 4.0694 8.6388 121.6116 65.6755 31.0218 178.2079 84 E 3.8650 8.2268 119.3015 58.7000 29.5451 178.3443 85 E 3.9706 8.5128 119.4326 59.4599 29.7967 178.4928 86 M 4.2204 8.4792 119.1430 58.6764 32.0722 178.8044 87 L 4.2123 8.4256 119.2431 58.0160 41.7817 179.9072 88 R 4.0241 7.9054 118.0663 59.0229 29.9467 179.3435 89 S 4.1274 8.0527 114.7244 61.7713 62.9162 176.1764 90 D 4.2618 8.0958 121.5490 57.3912 40.5630 178.9335 91 L 3.9833 7.9985 120.3817 58.1208 42.1869 178.7902 92 A 3.9995 8.0987 120.7645 55.0315 18.3018 179.3637 93 L 3.8852 8.0086 118.7351 58.4204 42.2298 178.9952 94 E 4.0611 8.1467 118.4704 59.4509 29.4223 179.4605 95 L 4.0384 8.1403 118.9649 57.8648 41.6197 179.2583 96 D 4.4715 8.2922 118.9474 57.3164 40.7588 179.0818 97 G 3.6272 8.1845 105.9466 47.8399 0.0000 175.4141 98 A 4.0355 8.1465 123.4444 54.7700 18.0332 179.5885 99 K 3.8925 7.9440 117.5460 59.8596 32.2746 178.8590 100 N 4.4028 7.9763 116.4722 56.1089 38.3542 177.3586 101 L 3.9882 8.0176 120.5404 58.0257 41.8393 179.8457 102 R 3.8902 8.0506 117.8845 59.0304 29.8141 178.7802 103 E 3.8368 7.8967 118.6932 59.2562 29.7075 178.8134 104 A 2.8845 7.6223 120.7518 54.8165 17.8292 179.7086 105 I 3.7828 8.0019 118.7452 64.3621 37.0601 178.9538 106 G 3.6027 7.9383 106.2686 47.8040 0.0000 175.2619 107 Y 3.9324 7.7623 121.8856 60.3806 38.7827 177.6780 108 A 3.8822 7.9584 121.7117 55.1220 18.3270 179.1348 109 D 4.1434 7.6942 115.5632 57.6111 41.1370 178.4270 110 S 3.9650 7.3309 114.2178 61.4536 62.9694 176.5212 111 V 3.6505 6.9728 118.0947 61.6561 31.5631 176.3408 112 H 2.9850 7.2747 115.6656 56.7971 26.7838 176.1096 113 D 4.4921 7.5631 122.1215 53.4448 38.6221 176.1009 114 Y 4.3602 7.4924 121.8613 60.3567 38.3862 177.4711 115 V 3.7160 7.8729 119.0444 65.8449 31.8209 178.1712 116 S 4.2369 8.3344 115.0706 61.4134 62.8387 176.7207 117 R 4.0695 8.1174 118.6869 58.7531 29.0900 178.5683 118 D 4.2665 8.2144 119.3362 57.5249 41.3128 177.6047 119 M 3.9906 7.9473 118.6768 59.1366 32.1217 178.0952 120 M 4.1291 8.0130 118.4081 58.5306 32.1063 178.8831 121 I 3.7517 7.7614 119.4491 64.0005 37.0532 178.4596 122 E 3.9235 7.9331 119.8831 59.5908 29.3904 179.3994 123 I 3.6165 7.6624 119.8306 64.1937 37.0754 178.3384 124 L 4.0010 8.2755 121.6284 58.0074 41.6838 178.9505 125 R 3.9240 7.8339 118.0511 59.3399 30.2306 178.0621 126 D 4.4517 7.8040 118.9922 57.2672 40.8140 178.4184 127 E 3.9350 8.1999 119.0313 59.6147 29.4965 179.3501 128 E 4.2151 8.4673 118.1335 58.7867 29.2645 179.4293 129 G 3.7357 7.9677 106.1556 47.5625 0.0000 175.7929 130 H 4.5725 7.9960 118.0373 58.8671 28.8376 177.7181 131 I 3.8521 8.3519 122.1669 64.4248 36.9375 178.0215 132 D 4.3653 8.1186 118.6483 57.0212 41.0822 178.0993 133 W 4.1688 8.1818 128.9116 60.4247 30.7103 177.9879 134 L 3.6345 8.1470 118.7783 57.7617 40.9790 179.2647 135 E 3.9157 8.1642 118.4645 59.7714 29.5341 179.6429 136 T 3.8284 7.8927 115.5669 66.5364 68.4421 176.5170 137 E 3.7986 7.7627 120.3839 59.4964 29.4087 179.5348 138 L 3.8218 7.7862 118.7167 57.7073 41.5784 179.2994 139 D 4.4416 7.7615 119.0106 56.8601 40.8067 178.7322 140 L 4.0444 7.7021 119.3197 57.8148 41.6112 179.5679 141 I 3.4960 7.1843 119.4272 64.1369 36.6911 178.3046 142 Q 3.8685 7.2140 118.0639 59.1260 28.9914 178.1065 143 K 4.1580 8.2518 118.8512 58.7868 32.3898 178.3755 144 M 4.3982 8.5482 114.9539 54.1868 32.5221 177.2942 145 G 4.0527 7.5100 105.5822 45.6216 0.0000 174.3952 146 L 4.0269 8.3529 120.6132 58.1363 42.1299 179.3613 147 Q 4.1007 8.0232 117.6258 58.9948 28.7439 178.2882 148 N 4.3852 8.1124 117.1629 56.2800 38.4819 176.6858 149 Y 3.9711 7.7691 119.8030 60.6486 39.1920 177.8843 150 L 4.1081 8.5690 120.2814 57.9180 41.9310 179.3099 151 Q 3.9885 8.2540 119.2162 58.8637 28.7469 177.3643 152 A 4.2189 7.6739 118.9062 53.0222 18.6092 178.0351 153 Q 4.4121 7.7203 116.6102 55.5843 30.1234 177.0746 154 I 4.1681 7.0647 110.9522 61.7002 37.7752 176.2366 155 R 4.6319 7.4344 119.9468 54.2774 33.7866 174.6100 156 E 4.1444 8.5919 120.3918 55.8423 30.6587 177.2379 157 E 4.0898 8.2975 121.4682 55.5565 31.5109 176.8414 *158 G 3.7265 8.6144 107.8158 46.0890 0.0000 172.6666 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 4.23 0.00 1.24 1.76 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.40 0.00 2 K 8.33 4.36 0.00 1.92 1.88 0.00 1.62 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.46 7.81 3 G 8.68 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.56 4.39 0.00 2.89 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 5 T 8.60 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 1.21 0.00 0.00 6 K 8.19 3.71 0.00 1.98 1.73 0.00 0.92 0.00 0.00 1.17 0.00 0.00 2.39 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.30 1.14 7.81 7 V 8.13 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 1.24 0.00 0.00 1.23 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 1.16 0.92 0.00 0.00 9 N 8.11 4.30 0.00 2.77 2.61 0.00 0.00 6.85 6.82 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 10 Y 7.90 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 8.23 3.86 0.00 2.05 1.75 1.09 0.89 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 8.08 4.30 0.00 2.89 2.81 0.00 0.00 6.69 6.75 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 13 K 7.95 3.91 0.00 1.78 2.02 0.00 1.70 0.00 0.00 1.71 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 8.04 4.02 0.00 1.55 0.86 0.96 0.60 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 15 L 7.67 3.97 0.00 1.70 1.76 1.09 0.91 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 8.03 4.35 0.00 3.03 2.91 0.00 0.00 7.06 7.82 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 18 E 8.12 4.06 0.00 2.32 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 8.15 4.02 0.00 1.85 1.73 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 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 0.87 0.00 0.00 0.93 0.00 0.00 21 A 7.90 3.86 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 22 I 8.07 3.84 1.92 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 1.53 1.00 1.06 0.00 0.00 23 N 7.94 4.37 0.00 2.96 2.91 0.00 0.00 6.68 7.18 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 24 Q 8.27 3.88 0.00 2.00 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 8.08 4.44 0.00 3.26 2.99 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 26 F 8.59 3.99 0.00 3.35 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 27 L 8.05 3.99 0.00 1.88 1.63 0.90 0.95 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 8.26 3.80 0.00 3.59 3.28 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 8.02 4.17 1.32 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 0.00 0.00 30 R 7.68 3.77 0.00 1.75 1.89 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 1.34 1.74 0.00 31 M 7.68 3.45 0.00 0.85 1.51 0.00 0.00 0.00 0.00 0.00 2.04 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 7.50 4.37 0.00 3.25 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 3.79 0.00 2.09 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 7.70 4.79 0.00 3.77 3.16 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 36 G 8.90 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 7.91 4.64 0.00 2.14 1.67 1.03 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 38 K 8.12 3.93 0.00 1.79 1.85 0.00 1.66 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 8.29 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 1.66 1.68 0.00 40 L 7.76 4.05 0.00 1.50 0.90 1.04 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.18 4.45 0.00 3.16 3.07 0.00 0.00 7.17 8.36 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 42 D 8.22 4.35 0.00 2.92 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 7.63 3.32 1.70 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 -0.75 0.00 0.00 0.78 0.00 0.00 44 E 8.11 3.80 0.00 2.34 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 0.00 2.66 3.15 0.00 45 Y 8.10 3.85 0.00 3.01 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 3.20 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 3.68 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 1.82 1.78 0.00 48 S 7.40 4.09 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 49 I 7.23 3.62 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 1.11 0.62 0.86 0.00 0.00 50 D 7.84 4.14 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 8.26 4.02 0.00 2.19 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 2.71 2.82 0.00 52 M 8.17 4.04 0.00 2.03 2.20 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.55 0.00 53 K 7.92 4.05 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 1.61 7.81 54 H 8.35 4.13 0.00 3.46 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 8.29 4.23 1.47 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 0.00 0.00 0.00 56 D 7.94 4.30 0.00 2.75 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 7.76 3.84 0.00 2.00 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 7.53 4.27 0.00 3.23 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 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 1.49 0.95 0.00 0.00 60 E 8.27 4.07 0.00 2.18 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 0.00 2.35 2.70 0.00 61 R 8.12 4.00 0.00 2.13 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 8.32 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 0.71 0.92 0.00 0.00 63 L 8.00 4.11 0.00 2.12 1.79 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 64 F 8.11 4.28 0.00 2.99 3.31 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 65 L 7.94 4.57 0.00 1.99 1.68 0.99 0.73 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 3.50 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 8.38 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.07 4.63 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 1.57 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.40 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 9.27 4.72 0.00 2.59 2.79 0.00 0.00 7.02 7.74 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 71 L 8.37 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 1.22 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.37 4.22 0.00 1.99 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.19 6.74 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 73 D 8.10 4.67 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 4.61 0.00 1.57 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 8.34 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 8.39 4.36 0.00 1.61 1.56 0.91 0.98 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 78 N 8.39 4.70 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 7.74 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 0.92 0.95 0.00 0.00 80 G 8.22 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 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 4.98 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 8.64 4.07 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 1.11 0.00 0.00 1.12 0.00 0.00 84 E 8.23 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 8.51 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 8.48 4.22 0.00 1.80 2.42 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.42 0.00 87 L 8.43 4.21 0.00 1.87 1.74 1.22 0.92 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 7.91 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 8.05 4.13 0.00 4.16 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 8.10 4.26 0.00 3.09 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 91 L 8.00 3.98 0.00 1.93 1.87 0.98 1.03 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 8.10 4.00 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 8.01 3.89 0.00 1.87 1.80 0.89 0.65 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 8.15 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 2.59 2.71 0.00 95 L 8.14 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 8.29 4.47 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 8.18 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 8.15 4.04 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 7.94 3.89 0.00 1.98 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 2.94 2.89 0.00 0.00 7.05 8.09 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 0.00 101 L 8.02 3.99 0.00 1.91 1.73 0.96 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 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 7.57 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 2.02 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 2.28 2.36 0.00 104 A 7.62 2.88 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 3.78 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 1.14 0.92 0.00 0.00 106 G 7.94 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 Y 7.76 3.93 0.00 3.04 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 7.96 3.88 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 0.00 109 D 7.69 4.14 0.00 2.86 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 7.33 3.96 0.00 3.54 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 0.00 111 V 6.97 3.65 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 0.64 0.00 0.00 0.84 0.00 0.00 112 H 7.27 2.99 0.00 3.14 3.23 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 7.56 4.49 0.00 2.60 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 7.49 4.36 0.00 3.09 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 0.00 115 V 7.87 3.72 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 1.09 0.00 0.00 0.99 0.00 0.00 116 S 8.33 4.24 0.00 4.10 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 8.12 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 8.21 4.27 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 7.95 3.99 0.00 2.29 2.03 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 120 M 8.01 4.13 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 2.18 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 7.76 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 0.83 0.92 0.00 0.00 122 E 7.93 3.92 0.00 2.21 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 7.66 3.62 1.93 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.86 0.69 0.00 0.00 124 L 8.28 4.00 0.00 1.85 1.82 0.94 1.14 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 7.83 3.92 0.00 2.04 2.12 0.00 3.32 0.00 0.00 3.22 7.58 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 7.80 4.45 0.00 2.97 2.70 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 0.00 127 E 8.20 3.93 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 2.52 2.55 0.00 128 E 8.47 4.22 0.00 2.26 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 7.97 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 H 8.00 4.57 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 8.35 3.85 2.10 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 8.12 4.37 0.00 2.96 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 W 8.18 4.17 0.00 3.44 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 8.15 3.63 0.00 1.87 1.73 1.24 1.23 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 8.16 3.92 0.00 2.17 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 2.34 2.65 0.00 136 T 7.89 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 1.18 0.00 0.00 137 E 7.76 3.80 0.00 1.57 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 1.62 0.88 0.85 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 0.00 139 D 7.76 4.44 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 4.04 0.00 2.08 1.85 0.94 0.72 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 0.00 141 I 7.18 3.50 1.54 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.06 0.67 0.00 0.00 142 Q 7.21 3.87 0.00 2.01 2.20 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 8.25 4.16 0.00 1.78 1.84 0.00 1.72 0.00 0.00 1.92 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 8.55 4.40 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 2.17 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 7.51 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 8.35 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 4.10 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.69 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 148 N 8.11 4.39 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 3.97 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 8.57 4.11 0.00 2.01 1.71 1.11 0.76 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 8.25 3.99 0.00 2.21 2.23 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 7.67 4.22 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 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 7.72 4.41 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 154 I 7.06 4.17 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 1.21 0.92 0.00 0.00 155 R 7.43 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 8.59 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 8.61 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.