NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1970 8.1627 120.2772 54.7544 33.1708 174.0306 2 K 4.1819 8.4899 128.5381 56.0890 32.7930 175.1922 3 G 4.0137 8.5480 115.7780 44.7491 0.0000 171.8126 4 D 4.6092 8.4369 119.3798 54.2553 41.8936 177.2717 5 T 3.8757 8.8291 122.8027 66.7950 68.4951 176.7070 6 K 3.8061 8.1684 121.0248 59.1635 32.2708 178.8659 7 V 3.9264 8.4036 118.7552 66.2472 31.4725 178.0414 8 I 3.8059 7.9664 119.4835 64.5311 36.9169 178.2099 9 N 4.2658 8.3745 117.5465 56.3273 38.2350 176.8936 10 Y 4.1384 8.0357 118.3818 61.3162 38.0108 178.8464 11 L 3.8345 8.5299 119.9766 57.9658 41.6647 179.4918 12 N 4.3318 8.3434 116.4647 55.9407 38.4638 177.3678 13 K 3.8571 8.0997 121.1256 59.5098 32.2641 178.9043 14 L 3.8571 7.9516 119.4431 57.4774 41.3680 179.0468 15 L 4.0195 7.8278 120.8589 58.1878 42.0696 179.2699 16 G 3.6075 8.0679 105.5264 47.9117 0.0000 175.2970 17 N 4.3653 8.1719 118.9012 56.1970 38.5022 177.3758 18 E 4.1093 8.4395 119.9555 59.4287 29.2251 179.4192 19 L 4.0149 8.2400 119.2624 57.5968 41.5586 179.7028 20 V 3.5710 7.7640 117.7293 66.0759 31.5438 177.9801 21 A 3.8403 8.0380 120.4374 54.9808 18.1183 179.3877 22 I 3.7410 8.1658 118.7906 64.9428 37.2026 178.3896 23 N 4.3637 7.8611 116.5706 56.2852 38.3227 177.4333 24 Q 3.7905 8.2781 121.1682 59.4466 29.1291 177.8543 25 Y 4.4255 8.3360 118.2053 60.9692 37.8407 178.3155 26 F 3.8573 8.5846 121.7971 61.1123 39.4626 176.9890 27 L 3.9619 8.2878 120.1308 58.4494 41.8373 178.3605 28 H 3.7301 8.3030 116.1098 58.8185 28.5948 177.3866 29 A 4.1273 8.2576 122.6010 55.5351 18.1622 179.9905 30 R 3.8938 7.7486 116.1041 59.0240 30.0912 179.2705 31 M 3.4864 7.8668 119.1629 58.1326 31.7852 178.5753 32 F 4.6625 7.7305 118.2568 60.6119 39.0998 177.6660 33 K 3.9632 8.4250 119.6348 59.4894 31.7814 178.1789 34 N 4.2852 8.0758 116.5614 56.6030 38.9336 176.1980 35 W 4.7982 8.0166 117.3342 57.2479 29.4477 177.2618 36 G 4.0006 8.3944 108.2063 45.7043 0.0000 174.0872 37 L 4.7802 8.0345 122.3783 52.9021 40.3660 177.3077 38 K 3.9591 8.0487 122.1071 59.4691 32.6057 178.6162 39 R 3.8797 8.2341 119.0148 59.4498 29.9252 178.6456 40 L 4.0877 7.7824 118.3662 57.4739 41.5811 178.4864 41 N 4.5248 8.3751 117.1539 57.0658 38.8744 176.6130 42 D 4.3293 8.2811 120.1056 57.3645 40.8443 179.0538 43 V 3.3313 7.6133 118.3817 66.0326 31.4069 178.0342 44 E 3.7517 8.4011 118.4121 59.0117 29.2477 178.5721 45 Y 3.7939 8.2847 120.2836 61.1735 38.7912 178.1801 46 H 4.0605 8.2565 116.6664 58.4800 28.6899 177.7333 47 E 3.5105 7.9886 121.2176 58.9775 29.0235 179.0792 48 S 4.1482 7.8921 113.4149 61.5162 62.4377 176.2480 49 I 3.5581 7.4913 122.3938 64.4207 36.7503 177.9284 50 D 4.2560 8.1168 119.8008 57.6781 40.6053 178.9878 51 E 4.1171 8.2426 118.6872 59.3412 29.3611 179.2487 52 M 4.0689 8.1084 119.1506 58.3059 32.0066 178.8849 53 K 3.9472 8.1650 118.6364 59.6538 32.2160 179.0082 54 H 4.0763 8.2536 116.3235 58.9207 28.5861 177.5629 55 A 4.2304 8.4038 122.7485 55.2754 18.1316 179.0880 56 D 4.2789 8.3273 116.5296 57.6133 41.2574 178.6538 57 R 3.8774 7.9390 118.4170 59.5410 29.9713 178.6968 58 Y 4.2891 7.8924 116.3160 61.1617 37.8941 178.6472 59 I 3.7843 8.1843 120.9459 64.4964 37.1892 178.3364 60 E 4.0188 8.5782 119.7469 59.4526 29.3126 179.4796 61 R 4.0320 8.3042 118.7932 59.5204 30.1135 178.5773 62 I 3.7915 8.2426 119.9977 64.4603 37.1305 178.4756 63 L 4.0079 8.1150 119.8293 57.6622 41.2289 179.1396 64 F 4.3620 8.2883 119.7845 61.3793 39.6715 176.4505 65 L 4.6819 7.9460 117.2542 53.8758 41.1872 177.1947 66 E 3.6479 7.9851 117.5653 57.3634 27.0495 174.5818 67 G 3.9372 8.0103 108.4077 44.1094 0.0000 173.6869 68 L 4.5733 8.0004 118.8632 51.9496 42.4618 175.1852 69 P 4.3862 0.0000 0.0000 62.5230 31.7788 176.0488 70 N 4.7068 9.2740 122.2884 52.4274 38.6096 173.8486 71 L 4.6164 8.3346 124.0179 54.5135 42.2857 177.3678 72 Q 4.1532 8.5412 122.0688 57.4916 29.5122 175.5531 73 D 4.6078 8.1402 117.9731 53.0437 41.3090 175.0905 74 L 4.5845 8.3217 126.3936 52.8678 43.9227 176.3890 75 G 3.8891 8.3598 114.8749 44.1667 0.0000 172.6285 76 K 4.0376 8.3100 120.6347 56.2176 32.5864 176.2274 77 L 4.3765 8.2263 125.8379 53.8355 42.8445 176.2386 78 N 4.8067 8.8513 119.7453 51.8542 39.8973 174.5932 79 I 3.7487 8.4018 125.9316 64.1616 37.5828 178.3592 80 G 4.1858 8.2551 102.2319 45.8550 0.0000 172.6212 81 E 4.8233 9.1450 116.3915 55.3869 31.7074 176.3529 82 D 4.9514 7.7700 117.7710 50.3990 43.9900 176.1332 83 V 4.0279 8.4133 119.2377 66.5193 31.4807 177.7229 84 E 3.8806 8.2278 118.3921 59.2513 29.5045 178.1612 85 E 3.9698 8.6825 119.3771 59.4962 29.7047 178.7605 86 M 4.0696 8.3338 118.7771 58.4372 31.9664 178.8031 87 L 4.2113 8.2733 119.1913 57.9377 41.7594 179.7726 88 R 3.9304 8.4450 118.4964 59.2265 29.9695 179.0679 89 S 4.1015 8.3516 113.0404 61.4642 62.3476 175.9184 90 D 4.2534 8.3280 121.6222 57.2177 40.5300 178.5219 91 L 4.0101 8.3302 120.7912 58.2020 42.0769 178.9181 92 A 3.9997 8.2477 120.8359 55.0143 18.2782 179.3708 93 L 3.8901 8.0909 118.8818 58.3142 42.1045 179.0385 94 E 4.0578 8.4438 118.6667 59.5270 29.5028 179.4245 95 L 4.0363 8.2206 119.0849 57.7746 41.5855 179.2338 96 D 4.4787 8.4347 119.1768 57.4763 40.7249 179.2102 97 G 3.6601 8.3997 105.9472 47.5481 0.0000 175.6953 98 A 4.0378 8.3396 123.3106 54.8574 18.4319 179.7444 99 K 3.8852 8.0144 116.9032 59.8632 32.1925 179.3141 100 N 4.4016 8.0272 116.2878 56.1535 38.3530 177.4147 101 L 3.9993 8.1873 120.6083 58.0335 41.7624 179.7896 102 R 3.8933 8.2024 118.0259 59.2022 29.9559 178.8046 103 E 3.8448 8.1383 118.7230 59.2120 29.5924 178.7669 104 A 2.9109 7.7346 120.7713 54.7338 18.4274 179.6990 105 I 3.7202 8.0407 118.8394 64.4649 37.2275 178.9196 106 G 3.6021 8.0128 106.6292 47.8746 0.0000 175.1926 107 Y 3.9408 7.9426 121.7429 60.3265 38.7931 177.6494 108 A 3.8270 8.2506 122.1188 55.1317 18.4167 179.0775 109 D 4.0108 7.8169 115.9074 57.6196 41.1008 178.6527 110 S 4.0045 7.4237 114.2549 61.0818 62.8294 176.1631 111 V 3.9833 6.8137 111.9300 60.7335 31.4581 175.9877 112 H 2.8663 7.2088 114.3365 56.8405 26.8218 176.3769 113 D 4.5353 7.3933 121.3656 53.5647 37.9828 176.0817 114 Y 4.3165 7.5123 121.0638 60.1983 38.4958 177.6876 115 V 3.6502 7.8262 119.2477 66.0754 31.8256 177.9462 116 S 4.1927 8.3209 114.9222 61.5846 62.5823 176.6988 117 R 3.8905 8.0083 121.2747 59.4964 29.9861 177.8995 118 D 4.3256 8.2823 117.8540 57.5906 41.1686 177.8919 119 M 3.9765 8.1535 118.4764 59.1564 32.2335 178.2171 120 M 4.1528 8.2020 118.6571 58.3179 32.0126 178.8493 121 I 3.7484 8.0792 120.3781 64.3296 37.3166 178.2799 122 E 3.9439 8.0621 118.9698 59.4506 29.2072 179.4491 123 I 3.5108 7.6951 119.8331 64.1946 37.0442 178.1584 124 L 3.9246 8.2932 121.5955 58.1074 41.8764 178.8768 125 R 3.8780 8.1731 118.6920 59.6117 30.0054 178.1667 126 D 4.3160 7.9818 118.3036 57.4882 40.7712 178.6582 127 E 3.9621 8.4041 119.2162 59.5637 29.4604 179.3555 128 E 4.1142 8.6975 119.0870 59.1705 29.4727 179.5968 129 G 3.6916 8.1809 105.9938 48.1939 0.0000 175.4646 130 H 4.4604 8.2272 118.6570 58.6788 28.6449 177.9345 131 I 3.8199 8.2031 121.8333 64.4110 36.9896 177.8219 132 D 4.3637 8.3441 118.8349 57.1411 40.9834 178.0464 133 W 4.2090 8.3768 128.6338 60.5915 30.7188 177.8376 134 L 3.7132 8.4380 118.8774 57.7633 41.1301 179.2372 135 E 3.9256 8.4022 118.6494 59.8453 29.4469 179.6996 136 T 3.8055 7.8567 115.4029 66.6373 68.5380 176.5815 137 E 3.7990 7.8549 120.5927 59.3419 28.9326 179.3962 138 L 3.7804 7.7555 118.8906 57.9259 41.6000 179.4104 139 D 4.3578 8.0707 118.7224 57.2733 40.6361 178.8195 140 L 3.9835 7.9206 119.5772 57.6897 41.5984 179.4642 141 I 3.3743 7.4561 119.8399 64.3029 36.7256 178.2711 142 Q 3.8727 7.3367 117.9436 59.1170 29.0048 178.0393 143 K 4.1367 8.0934 118.7444 58.9170 32.2559 178.3625 144 M 4.4074 8.2780 114.4018 53.8057 32.4686 176.9747 145 G 4.1347 7.5863 106.0213 46.0136 0.0000 174.4888 146 L 3.9864 8.3137 121.3955 57.9077 42.0795 179.4932 147 Q 3.9836 8.0085 117.5685 59.1838 28.8126 178.4198 148 N 4.3576 8.1164 116.9539 56.2724 38.4031 176.6190 149 Y 3.9889 7.9744 120.1559 60.7995 39.2042 178.0210 150 L 4.0714 8.3634 120.1629 57.7897 41.4014 179.1275 151 Q 3.9374 8.1035 119.3362 59.1514 28.7537 177.9111 152 A 4.1170 7.8213 119.2754 53.5215 18.6757 178.2183 153 Q 4.3106 7.7888 116.0640 55.6881 29.4326 177.3674 154 I 4.2175 7.2973 112.4626 61.9033 38.1846 176.2668 155 R 4.6188 7.5141 119.3546 53.8677 31.9513 175.8539 156 E 4.1076 8.5848 120.7438 56.8501 29.9963 175.1693 157 E 4.2908 8.4849 119.1311 57.5663 32.0044 176.1416 *158 G 3.7389 7.8811 110.9247 45.7498 0.0000 172.2358 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 4.20 0.00 1.32 1.80 0.00 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.42 0.00 2 K 8.49 4.18 0.00 2.09 1.66 0.00 1.93 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.42 1.08 7.81 3 G 8.55 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.44 4.61 0.00 2.77 2.62 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 5 T 8.83 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 8.17 3.81 0.00 1.71 1.99 0.00 1.37 0.00 0.00 0.64 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.94 1.00 7.81 7 V 8.40 3.93 2.34 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 1.05 0.00 0.00 1.17 0.00 0.00 8 I 7.97 3.81 2.03 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 0.57 0.92 0.00 0.00 9 N 8.37 4.27 0.00 2.65 2.66 0.00 0.00 7.02 8.28 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 10 Y 8.04 4.14 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 8.53 3.83 0.00 1.82 1.80 1.06 0.93 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 8.34 4.33 0.00 2.92 2.81 0.00 0.00 6.63 7.31 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 13 K 8.10 3.86 0.00 1.76 1.96 0.00 1.59 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.43 1.45 7.81 14 L 7.95 3.86 0.00 0.92 1.21 0.91 0.84 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 7.83 4.02 0.00 1.69 1.81 1.06 1.02 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 16 G 8.07 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.17 4.37 0.00 2.99 2.91 0.00 0.00 7.06 7.26 0.00 0.00 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 8.44 4.11 0.00 2.26 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 2.76 2.88 0.00 19 L 8.24 4.01 0.00 1.82 1.72 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.76 3.57 2.22 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 1.09 0.00 0.00 1.01 0.00 0.00 21 A 8.04 3.84 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 22 I 8.17 3.74 2.06 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 1.61 0.76 0.91 0.00 0.00 23 N 7.86 4.36 0.00 2.93 2.85 0.00 0.00 6.75 7.70 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 8.28 3.79 0.00 1.98 1.87 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 2.15 2.10 0.00 25 Y 8.34 4.43 0.00 3.13 3.03 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 0.00 0.00 0.00 26 F 8.58 3.86 0.00 3.29 3.06 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 27 L 8.29 3.96 0.00 1.82 1.68 0.87 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.30 3.73 0.00 3.52 3.07 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 8.26 4.13 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 30 R 7.75 3.89 0.00 1.77 1.91 0.00 3.19 0.00 0.00 3.05 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.85 0.00 31 M 7.87 3.49 0.00 0.92 1.53 0.00 0.00 0.00 0.00 0.00 1.60 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 7.73 4.66 0.00 3.24 3.25 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 0.00 0.00 0.00 33 K 8.42 3.96 0.00 1.95 1.93 0.00 1.57 0.00 0.00 1.53 0.00 0.00 2.85 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.43 7.81 34 N 8.08 4.29 0.00 2.67 2.72 0.00 0.00 7.32 8.29 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 35 W 8.02 4.80 0.00 3.74 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 36 G 8.39 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 0.00 0.00 0.00 37 L 8.03 4.78 0.00 1.89 1.64 1.21 0.79 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 8.05 3.96 0.00 1.88 1.86 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.60 7.81 39 R 8.23 3.88 0.00 2.05 2.08 0.00 3.09 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 40 L 7.78 4.09 0.00 1.49 0.80 0.47 0.72 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 41 N 8.38 4.52 0.00 3.11 3.02 0.00 0.00 7.21 7.91 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 42 D 8.28 4.33 0.00 2.86 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 43 V 7.61 3.33 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 -0.50 0.00 0.00 0.77 0.00 0.00 44 E 8.40 3.75 0.00 2.33 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 2.58 3.11 0.00 45 Y 8.28 3.79 0.00 2.89 3.01 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 0.00 0.00 0.00 46 H 8.26 4.06 0.00 3.18 3.23 0.00 5.87 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 7.99 3.51 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 2.02 1.70 0.00 48 S 7.89 4.15 0.00 3.95 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 49 I 7.49 3.56 1.81 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.21 0.84 0.00 0.00 50 D 8.12 4.26 0.00 2.83 2.64 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 51 E 8.24 4.12 0.00 2.19 2.23 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 2.74 2.80 0.00 52 M 8.11 4.07 0.00 2.03 2.23 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.56 0.00 53 K 8.17 3.95 0.00 1.87 1.82 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 1.43 1.61 7.81 54 H 8.25 4.08 0.00 3.51 3.33 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 8.40 4.23 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 56 D 8.33 4.28 0.00 2.91 2.85 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 57 R 7.94 3.88 0.00 1.82 1.79 0.00 3.13 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.77 0.00 58 Y 7.89 4.29 0.00 3.20 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 8.18 3.78 2.07 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 1.58 1.03 0.95 0.00 0.00 60 E 8.58 4.02 0.00 2.06 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 2.57 0.00 61 R 8.30 4.03 0.00 2.08 2.18 0.00 3.34 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.87 0.00 62 I 8.24 3.79 1.94 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 1.59 0.70 0.99 0.00 0.00 63 L 8.11 4.01 0.00 1.93 1.77 0.99 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.29 4.36 0.00 2.98 3.35 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 65 L 7.95 4.68 0.00 1.86 1.61 0.99 0.55 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 66 E 7.99 3.65 0.00 2.08 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 2.15 2.23 0.00 67 G 8.01 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 68 L 8.00 4.57 0.00 1.61 1.61 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.39 0.00 2.06 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 2.06 2.11 0.00 70 N 9.27 4.71 0.00 2.59 2.81 0.00 0.00 7.09 7.42 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 71 L 8.33 4.62 0.00 1.63 1.64 0.94 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 8.54 4.15 0.00 1.96 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.49 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 73 D 8.14 4.61 0.00 2.69 2.58 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 74 L 8.32 4.58 0.00 1.54 1.52 0.91 1.09 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 75 G 8.36 3.89 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 0.00 0.00 0.00 76 K 8.31 4.04 0.00 1.98 1.72 0.00 1.89 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.42 1.03 7.81 77 L 8.23 4.38 0.00 1.65 1.53 0.90 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 78 N 8.85 4.81 0.00 2.61 2.69 0.00 0.00 7.19 8.06 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 79 I 8.40 3.75 1.88 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.90 0.92 0.00 0.00 80 G 8.26 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 0.00 0.00 0.00 81 E 9.15 4.82 0.00 1.99 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 2.30 2.26 0.00 82 D 7.77 4.95 0.00 2.85 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 83 V 8.41 4.03 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 1.16 0.00 0.00 1.23 0.00 0.00 84 E 8.23 3.88 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 8.68 3.97 0.00 2.21 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 2.35 2.38 0.00 86 M 8.33 4.07 0.00 1.75 2.39 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.58 0.00 87 L 8.27 4.21 0.00 1.72 1.75 0.82 1.15 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 88 R 8.45 3.93 0.00 1.85 1.99 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 8.35 4.10 0.00 3.99 4.09 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 90 D 8.33 4.25 0.00 3.09 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 91 L 8.33 4.01 0.00 1.81 1.87 0.99 1.24 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 92 A 8.25 4.00 1.37 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 0.00 0.00 93 L 8.09 3.89 0.00 1.83 1.79 0.91 0.73 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 94 E 8.44 4.06 0.00 2.29 2.10 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 2.62 2.74 0.00 95 L 8.22 4.04 0.00 1.86 1.74 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 96 D 8.43 4.48 0.00 2.87 2.73 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 97 G 8.40 3.66 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 0.00 0.00 0.00 98 A 8.34 4.04 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 99 K 8.01 3.89 0.00 2.06 1.90 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.66 7.81 100 N 8.03 4.40 0.00 2.89 2.91 0.00 0.00 7.08 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 0.00 101 L 8.19 4.00 0.00 1.95 1.74 0.98 1.27 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 0.00 102 R 8.20 3.89 0.00 1.99 1.98 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 1.66 1.85 0.00 103 E 8.14 3.84 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 2.24 2.35 0.00 104 A 7.73 2.91 1.08 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 0.00 0.00 105 I 8.04 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 1.46 0.96 0.91 0.00 0.00 106 G 8.01 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 7.94 3.94 0.00 3.10 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 8.25 3.83 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 7.82 4.01 0.00 2.75 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 0.00 110 S 7.42 4.00 0.00 3.69 3.76 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 0.00 111 V 6.81 3.98 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 0.40 0.00 0.00 0.74 0.00 0.00 112 H 7.21 2.87 0.00 3.15 3.30 0.00 5.84 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.39 4.54 0.00 2.62 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 7.51 4.32 0.00 3.10 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 0.00 115 V 7.83 3.65 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 1.10 0.00 0.00 1.00 0.00 0.00 116 S 8.32 4.19 0.00 4.21 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 8.01 3.89 0.00 1.91 2.16 0.00 3.34 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 118 D 8.28 4.33 0.00 2.99 2.85 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 0.00 119 M 8.15 3.98 0.00 2.28 2.03 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.43 0.00 120 M 8.20 4.15 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.85 0.00 121 I 8.08 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 0.73 0.91 0.00 0.00 122 E 8.06 3.94 0.00 2.17 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 2.53 0.00 123 I 7.70 3.51 1.92 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.67 0.73 0.00 0.00 124 L 8.29 3.92 0.00 1.83 1.85 0.94 0.74 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 8.17 3.88 0.00 1.91 2.11 0.00 3.15 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 126 D 7.98 4.32 0.00 2.96 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 8.40 3.96 0.00 2.11 2.21 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 2.63 2.56 0.00 128 E 8.70 4.11 0.00 2.01 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 2.50 0.00 129 G 8.18 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 8.23 4.46 0.00 3.56 3.54 0.00 5.65 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 8.20 3.82 2.13 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 0.90 0.97 0.00 0.00 132 D 8.34 4.36 0.00 3.00 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 0.00 133 W 8.38 4.21 0.00 3.49 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 8.44 3.71 0.00 1.99 1.78 1.20 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.40 3.93 0.00 2.19 2.00 0.00 0.00 0.00 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 2.55 0.00 136 T 7.86 3.81 4.25 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 0.00 0.00 1.17 0.00 0.00 137 E 7.85 3.80 0.00 1.51 1.67 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 1.47 1.47 0.00 138 L 7.76 3.78 0.00 1.74 1.62 0.91 0.86 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 0.00 139 D 8.07 4.36 0.00 2.81 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 0.00 140 L 7.92 3.98 0.00 1.91 1.84 0.94 0.67 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 0.00 141 I 7.46 3.37 1.70 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 0.02 0.69 0.00 0.00 142 Q 7.34 3.87 0.00 2.01 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.97 0.00 0.00 0.00 0.00 0.00 2.33 2.50 0.00 143 K 8.09 4.14 0.00 1.75 1.85 0.00 1.72 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.59 7.81 144 M 8.28 4.41 0.00 2.18 2.19 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 2.66 2.86 0.00 145 G 7.59 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 146 L 8.31 3.99 0.00 1.73 1.66 0.93 0.70 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 0.00 147 Q 8.01 3.98 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.68 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 148 N 8.12 4.36 0.00 2.92 2.88 0.00 0.00 6.69 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 7.97 3.99 0.00 2.99 3.13 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 0.00 0.00 0.00 150 L 8.36 4.07 0.00 1.71 1.69 0.88 0.97 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 0.00 151 Q 8.10 3.94 0.00 2.11 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.86 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 152 A 7.82 4.12 1.19 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 0.00 0.00 153 Q 7.79 4.31 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.77 0.00 0.00 0.00 0.00 0.00 2.05 2.16 0.00 154 I 7.30 4.22 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 1.54 1.53 1.02 0.00 0.00 155 R 7.51 4.62 0.00 1.79 1.86 0.00 3.20 0.00 0.00 3.21 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 156 E 8.58 4.11 0.00 1.94 1.88 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 2.40 2.29 0.00 157 E 8.48 4.29 0.00 1.89 1.90 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 2.18 2.26 0.00 *158 G 7.88 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 * Residues marked with a * may have inaccurate shift predictions.