NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2357 8.1476 120.2495 54.6379 32.6817 174.6131 2 K 4.7404 7.7680 126.0015 56.1866 33.1177 176.4208 3 G 3.8337 8.4803 111.0431 45.1440 0.0000 167.4880 4 D 4.3930 8.5932 131.4323 54.0828 41.2184 174.4479 5 T 3.8308 8.5944 123.7919 66.7705 68.5509 176.1658 6 K 3.7116 8.1870 120.8292 59.5362 32.0458 178.7256 7 V 3.8939 8.1167 117.9164 66.2796 31.6582 178.1814 8 I 3.7858 7.7890 119.2502 63.9923 36.8097 178.2892 9 N 4.2900 8.1342 117.8703 56.3127 38.3439 176.9673 10 Y 4.0735 7.8774 118.0731 61.0729 37.9198 178.6454 11 L 3.8620 8.2520 120.0110 58.0418 41.7925 179.4836 12 N 4.2813 8.0632 116.0340 55.9344 38.3994 177.5271 13 K 3.9109 7.9354 121.2990 59.3407 32.2920 178.9632 14 L 4.0150 8.0538 119.7064 57.5798 41.4022 179.1769 15 L 3.9793 7.6920 120.5184 58.0216 42.1188 179.2516 16 G 3.5887 7.9518 105.5767 47.8837 0.0000 175.2658 17 N 4.3620 8.0228 118.9499 56.1340 38.5111 177.3361 18 E 4.0635 8.1541 119.8107 59.4953 29.3938 179.2615 19 L 4.0211 8.1454 119.3379 57.9240 41.6352 180.1063 20 V 3.6246 7.8073 118.3816 64.6861 31.3892 178.3660 21 A 3.8651 7.8983 121.7987 54.6877 18.2185 179.6363 22 I 3.8402 8.0804 111.8735 64.3150 37.7470 178.3417 23 N 4.3774 7.9319 118.2543 56.0592 38.4177 177.2709 24 Q 3.8851 8.2624 121.0737 59.3787 29.1532 177.7945 25 Y 4.4396 8.1027 117.8801 60.9779 37.9414 178.1251 26 F 3.9818 8.5728 121.8809 60.9234 39.4721 177.1875 27 L 3.9940 8.0506 119.8901 58.3538 41.8823 178.5117 28 H 3.7982 8.2740 115.9474 58.6882 28.5958 177.2422 29 A 4.1660 8.0124 122.3938 55.7494 18.2038 180.0982 30 R 3.8191 7.6672 115.6064 59.0811 30.0596 179.3944 31 M 3.4554 7.6588 119.0553 57.9245 31.8151 178.6301 32 F 4.3684 7.4825 117.8617 60.4646 39.1892 177.2612 33 K 3.7934 8.3165 119.6376 59.9025 31.6895 177.7897 34 N 4.2584 7.6631 115.4145 56.7648 38.8487 176.1593 35 W 4.7938 7.7071 117.5097 57.6462 29.3045 177.2381 36 G 4.0611 8.8538 108.6367 45.5160 0.0000 173.6899 37 L 4.6374 7.9064 122.0354 52.8389 39.4366 177.0381 38 K 3.9272 8.1181 122.6793 59.3485 32.5035 178.3253 39 R 3.8573 8.2606 119.0985 59.5107 30.0231 178.6454 40 L 4.0537 7.7570 118.3160 57.4918 41.5763 178.8645 41 N 4.4453 8.1685 116.9300 56.7976 38.8444 176.5709 42 D 4.3492 8.2050 120.4267 57.4271 41.0573 179.1583 43 V 3.3148 7.6095 118.2926 66.0969 31.4338 177.8955 44 E 3.7986 8.1117 118.2491 59.4071 29.3806 178.9791 45 Y 3.8726 8.1114 119.6423 61.0161 38.9474 177.5943 46 H 4.0566 7.9344 119.1388 59.0337 29.7855 177.0800 47 E 3.6907 7.6017 120.2933 58.9540 29.0632 179.1102 48 S 4.0900 7.3835 113.4215 61.4482 62.5184 176.3470 49 I 3.6388 7.2285 122.0822 64.1030 36.6475 178.2185 50 D 4.1548 7.8340 119.8359 57.4267 40.6040 178.5100 51 E 4.0216 8.2954 119.2529 59.8463 29.3389 179.3539 52 M 4.0434 8.1459 118.5703 58.4467 31.9389 178.9516 53 K 4.0549 7.9075 118.3282 59.2449 32.2307 179.1475 54 H 4.1234 8.3331 116.7309 58.7710 28.6414 177.4232 55 A 4.2187 8.3047 122.7117 55.5429 18.2460 179.1310 56 D 4.3087 7.9328 116.1775 57.4743 41.1672 178.6956 57 R 3.8395 7.7472 118.2402 59.4291 30.0411 178.6261 58 Y 4.2827 7.5410 115.8915 61.2736 38.0367 178.4733 59 I 3.7987 8.0574 120.7657 64.7511 37.2162 178.3764 60 E 4.0781 8.2863 119.2363 59.1533 29.3243 179.3648 61 R 4.0017 8.1377 118.8948 59.5325 30.2001 178.5739 62 I 3.7952 8.3056 120.0624 64.5421 36.9814 178.4652 63 L 4.0901 7.9814 119.5231 57.5435 41.1795 179.3917 64 F 4.2664 8.1025 119.8316 61.3428 39.8073 176.9098 65 L 4.5808 7.9259 118.1171 54.5668 41.4879 176.6162 66 E 3.5690 7.8663 117.3580 57.8515 26.6525 173.4251 67 G 4.1695 8.3292 107.2651 43.4576 0.0000 172.1692 68 L 4.6400 8.0805 120.2089 52.1017 43.7223 174.3745 69 P 4.3827 0.0000 0.0000 62.8166 31.8046 175.6836 70 N 4.7111 9.2527 121.7099 52.4956 38.5515 173.9543 71 L 4.6854 8.3518 124.6107 54.5384 42.3824 177.3751 72 Q 4.2133 8.3326 122.2948 57.3783 29.6792 175.6862 73 D 4.6785 8.0925 117.7211 52.8675 41.7549 175.2171 74 L 4.6219 8.3546 125.9507 53.0773 44.1799 176.2053 75 G 3.9676 8.2041 113.6960 43.9951 0.0000 172.7240 76 K 4.1437 8.3471 118.8914 55.8907 32.5044 176.7107 77 L 4.3443 8.3988 124.1539 53.3532 42.6815 175.8472 78 N 4.7094 8.3905 122.7907 51.7590 38.2045 174.3997 79 I 3.8001 7.7967 125.9857 62.2818 37.8808 177.3683 80 G 4.3032 8.2312 107.8539 45.7764 0.0000 172.8301 81 E 4.7186 8.7775 119.8113 55.9377 30.8900 176.3777 82 D 4.9856 7.8035 118.9895 50.4512 43.8123 176.2997 83 V 4.0758 8.6541 121.6123 65.6864 30.9997 178.2173 84 E 3.8719 8.2227 119.2523 58.7132 29.5638 178.3454 85 E 3.9722 8.4749 119.4426 59.4513 29.7867 178.4887 86 M 4.2194 8.4882 119.1424 58.6673 32.0716 178.7776 87 L 4.2082 8.4334 119.2664 58.0477 41.7940 179.9223 88 R 4.0212 7.9000 118.0089 59.0389 29.9383 179.3587 89 S 4.1275 8.0543 114.7153 61.7694 62.9200 176.1855 90 D 4.2578 8.1216 121.5799 57.3920 40.5738 178.9217 91 L 3.9890 7.9978 120.4139 58.0833 42.1728 178.7912 92 A 4.0013 8.0755 120.7654 55.0221 18.3214 179.3382 93 L 3.8807 8.0191 118.7402 58.4499 42.2167 178.9936 94 E 4.0628 8.1364 118.4326 59.4638 29.3608 179.4782 95 L 4.0364 8.1248 118.9456 57.8580 41.6435 179.2631 96 D 4.4652 8.3103 118.9647 57.2859 40.7410 179.0497 97 G 3.6314 8.1904 105.9473 47.8625 0.0000 175.3830 98 A 4.0282 8.1546 123.5176 54.7761 18.1003 179.5920 99 K 3.8945 7.9297 117.5708 59.8554 32.2951 178.8564 100 N 4.3959 7.9777 116.4069 56.1011 38.3490 177.3451 101 L 3.9920 8.0446 120.5540 58.0293 41.8946 179.8290 102 R 3.8860 8.0480 117.8448 59.0638 29.8211 178.7649 103 E 3.8385 7.8974 118.7820 59.2715 29.6946 178.8169 104 A 2.8662 7.6435 120.7104 54.8066 17.8241 179.6996 105 I 3.7742 7.9995 118.7485 64.4037 37.0026 178.9562 106 G 3.6229 7.9641 106.3030 47.7938 0.0000 175.2746 107 Y 3.9493 7.7630 121.8229 60.3879 38.7730 177.6115 108 A 3.8826 7.9765 121.7463 55.1310 18.3405 179.1418 109 D 4.1404 7.6906 115.4150 57.5689 41.1242 178.4543 110 S 3.9705 7.3033 114.6530 61.4403 62.9755 176.5170 111 V 3.6325 6.9570 118.0829 61.6999 31.5499 176.3503 112 H 2.9571 7.2410 115.6348 56.7700 26.7933 176.1332 113 D 4.4958 7.5201 122.0417 53.4535 38.5410 176.1207 114 Y 4.3730 7.5020 121.7152 60.3312 38.3882 177.4857 115 V 3.7256 7.8510 119.1066 65.8573 31.7985 178.1561 116 S 4.2364 8.3761 115.2308 61.4256 62.7638 176.7377 117 R 4.0669 8.1505 118.7435 58.7703 29.0741 178.5779 118 D 4.2572 8.1955 119.2924 57.5024 41.3129 177.6036 119 M 4.0008 7.9555 118.6906 59.1254 32.1331 178.0624 120 M 4.1165 8.0061 118.4702 58.5758 32.1157 178.8987 121 I 3.7462 7.7343 119.3958 64.0271 37.0235 178.4713 122 E 3.9310 7.9203 119.8609 59.5754 29.3817 179.4010 123 I 3.6137 7.6652 119.8445 64.1720 37.0783 178.3345 124 L 4.0031 8.2628 121.6284 58.0121 41.6884 178.9533 125 R 3.9292 7.8397 118.0285 59.3402 30.2656 178.0511 126 D 4.4543 7.7847 118.9287 57.2321 40.7844 178.4292 127 E 3.9375 8.1833 119.0427 59.6049 29.4408 179.3413 128 E 4.1608 8.4557 118.1214 58.7637 29.2781 179.4638 129 G 3.7146 7.9259 106.1679 47.6423 0.0000 175.7758 130 H 4.5807 8.0038 118.0465 58.8591 28.8204 177.7543 131 I 3.8680 8.3243 122.1344 64.3984 36.9288 178.0298 132 D 4.3598 8.1081 118.9120 56.9981 41.0773 178.0957 133 W 4.1723 8.1990 128.7953 60.4185 30.7003 177.9895 134 L 3.6224 8.1117 118.5962 57.7612 40.9824 179.2481 135 E 3.9114 8.1155 118.4550 59.7863 29.5310 179.6614 136 T 3.8281 7.8827 115.5395 66.5356 68.4531 176.5179 137 E 3.7945 7.7560 120.3900 59.5003 29.0920 179.5218 138 L 3.8163 7.7863 118.7521 57.7611 41.5891 179.3245 139 D 4.4167 7.7694 118.9729 56.8948 40.7930 178.7462 140 L 4.0611 7.7014 119.3097 57.7906 41.6070 179.5596 141 I 3.4969 7.1959 119.4395 64.1489 36.6953 178.3018 142 Q 3.8756 7.2447 118.2100 59.0930 28.9816 178.0795 143 K 4.1586 8.2418 118.9291 58.7834 32.4025 178.3725 144 M 4.3920 8.5584 114.9927 54.2077 32.5362 177.3167 145 G 4.0527 7.4992 105.5814 45.6119 0.0000 174.3720 146 L 4.0259 8.3558 120.6832 58.1431 42.1371 179.3930 147 Q 4.1062 8.0239 117.6276 58.9808 28.7185 178.2668 148 N 4.3964 8.1125 117.1780 56.2700 38.4830 176.7017 149 Y 3.9601 7.7703 119.8076 60.6486 39.2242 177.8490 150 L 4.1079 8.5531 120.3204 57.9101 41.9275 179.3131 151 Q 3.9888 8.2286 119.2082 58.8503 28.7490 177.3507 152 A 4.2333 7.6218 118.9512 53.0078 18.6133 178.0328 153 Q 4.4147 7.7004 116.5657 55.5812 30.1286 177.0634 154 I 4.1840 7.0687 110.8867 61.6733 37.7849 176.2314 155 R 4.6299 7.4387 119.9700 54.2585 33.7684 174.6241 156 E 4.1407 8.5978 120.4393 55.8670 30.6605 177.3436 157 E 4.0885 8.2960 121.5039 55.5752 31.5088 176.8383 *158 G 3.7267 8.5802 107.7350 46.1109 0.0000 172.6577 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 1.98 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 2.05 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 6.55 0.00 0.00 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 0.52 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 8.15 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 3.89 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 0.93 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 0.86 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 1.20 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 4.45 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 8.21 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 -0.68 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 4.15 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 8.30 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 4.05 0.00 1.92 1.80 0.00 1.62 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 8.31 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 0.91 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 9.25 4.71 0.00 2.60 2.80 0.00 0.00 7.03 7.62 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 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 6.20 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 8.05 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 4.47 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 8.19 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 8.15 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 3.89 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 8.04 3.99 0.00 1.90 1.73 0.96 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 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 2.00 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 0.81 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 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 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 1.92 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 7.78 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 1.06 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 7.76 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 2.02 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 7.70 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.