NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 24 G 4.0748 8.3431 109.7389 45.5923 0.0000 173.4344 25 G 3.9848 8.8122 109.9445 43.4758 0.0000 172.3885 26 C 4.2111 9.2006 115.0666 59.4015 31.5915 169.2695 27 Q 3.2605 7.9618 125.7778 54.9518 27.8619 173.0344 *41 Q 3.4415 8.3536 120.3770 55.5803 29.8522 174.1622 42 Y 4.4049 7.2931 117.0057 56.3493 39.5726 175.5526 43 W 5.2637 8.2369 121.9208 55.4596 33.1166 174.9205 44 H 4.7317 8.8382 119.4212 54.8601 28.3667 175.6351 45 E 4.2115 8.6768 119.2259 59.7854 29.6103 179.5387 46 D 4.6208 8.0447 117.2995 57.0556 41.3224 177.8862 47 C 4.2178 8.2041 113.5763 60.9572 30.2072 173.4671 48 L 4.1386 7.5119 122.0352 54.8837 42.1369 176.6762 49 S 4.9852 8.4064 118.7447 56.0645 65.6688 173.0657 50 C 3.8856 8.8745 125.6813 59.8951 31.6029 174.1880 51 D 4.5749 8.2232 127.0870 56.7691 40.7074 177.6339 52 L 4.5541 7.8648 118.5000 55.1469 43.4165 176.3957 53 C 4.6540 8.1398 109.6090 57.0939 31.3321 174.4973 54 G 4.0000 8.5182 108.6895 45.6800 0.0000 173.0038 55 C 4.3160 8.1486 117.6728 58.6120 28.6731 173.5389 56 R 4.9283 8.4488 123.8534 55.6054 30.3249 177.1893 57 L 3.9324 8.8301 125.7030 58.2091 42.6035 177.8958 58 G 4.1609 8.2932 105.9721 48.9267 0.0000 174.3969 59 E 4.0277 8.1885 118.0745 58.8018 29.7522 178.1932 60 V 3.6974 7.1857 121.6902 62.5346 29.8183 176.2704 61 G 3.9582 8.4199 114.4278 44.8902 0.0000 170.8067 62 R 4.4611 8.3278 115.0939 55.9588 31.5873 176.9032 63 R 4.5386 7.7275 115.4346 53.8848 33.3421 174.1977 64 L 4.7530 7.9102 121.8495 53.4388 45.0970 174.7747 65 Y 4.4125 8.8277 121.8284 56.2200 40.8156 174.1632 66 Y 4.7972 8.5740 124.7688 55.7255 41.1222 173.9582 67 K 4.3851 7.9666 127.4268 55.5001 35.3724 175.9643 68 L 3.6479 9.3388 123.0145 55.7893 39.2629 175.5895 69 G 3.8300 7.8631 103.1376 45.6984 0.0000 173.8621 70 R 4.6848 7.4044 119.5850 53.6384 32.7517 175.6157 71 K 4.4643 8.7411 123.7692 56.6739 33.2523 176.2118 72 L 5.1597 9.5772 124.5646 52.9637 46.4402 176.2360 73 C 4.7773 8.6647 116.5556 57.4692 31.1767 174.5923 74 R 3.6641 8.8665 119.9474 59.6047 29.5022 178.2331 75 R 2.7314 7.8735 117.7238 59.4904 29.8881 178.0758 76 D 4.2051 7.8499 117.9457 57.2045 40.8639 177.8708 77 Y 4.1774 8.2403 120.3658 60.9167 38.8309 178.3351 78 L 3.8966 8.3277 120.0743 57.8283 41.4987 179.8323 79 R 3.8343 7.8183 117.2479 58.6074 29.9681 178.3568 80 L 3.9185 7.0395 117.4788 55.6838 42.3720 177.4624 81 F 4.6523 7.7567 113.5386 56.5719 40.6672 175.8045 82 G 3.7223 7.4387 109.8017 45.4292 0.0000 172.4505 83 Q 4.6790 8.3154 121.3809 54.1868 30.5983 175.1247 84 D 4.8466 8.6908 126.2262 52.8802 41.7447 174.5679 85 G 4.2424 8.8340 105.1823 44.7282 0.0000 170.9046 86 L 5.0318 8.1462 121.1493 52.7374 44.3787 175.5441 87 C 4.2803 8.7306 127.5305 59.4149 31.8551 174.4993 88 A 3.8409 8.5061 130.1604 54.4578 17.9663 177.8315 89 S 4.5225 7.6041 109.4611 60.0599 63.6096 174.5824 90 C 4.2767 7.9033 113.1759 57.8474 30.2602 173.8657 91 D 4.4429 7.8528 118.1242 55.0027 40.1981 172.8758 92 K 4.6598 7.2714 115.2680 54.5794 34.5593 176.3948 93 R 4.5528 8.5100 120.7245 56.5431 31.4200 176.6118 94 I 4.7193 8.6477 121.7024 58.3432 39.8171 175.8515 95 R 4.2470 8.9576 126.3289 55.8247 30.6831 177.8242 96 A 3.9278 8.6834 123.8702 55.3929 18.2503 177.9763 97 Y 4.5781 7.7987 113.0171 57.4674 39.4451 175.3970 98 E 4.1444 8.0495 119.3450 57.1259 30.3305 175.7936 99 M 4.3194 8.3215 121.5729 55.6812 33.1948 175.5560 100 T 5.0247 8.3301 118.4943 62.1050 73.3074 173.2314 101 M 4.3467 9.0247 124.1645 53.7494 34.1002 175.1371 102 R 4.7653 8.4143 123.5174 55.0126 31.9223 176.8448 103 V 4.3247 8.7950 123.3630 61.6170 34.0877 176.2104 104 K 3.7030 8.3407 130.2408 57.7802 30.9770 178.9371 105 D 4.5084 8.9453 127.9691 56.2009 39.7729 176.4187 106 K 4.5194 7.9876 120.0377 55.7543 34.0419 176.3068 107 V 4.9999 7.7855 120.2779 60.4498 35.0894 173.7008 108 Y 5.1190 9.0758 120.1236 56.2198 42.2176 174.9281 109 H 4.5351 8.9773 120.0619 55.6580 29.9555 175.9819 110 L 3.9588 8.5322 125.7683 58.4693 41.8928 179.1715 111 E 4.1784 8.2106 116.7256 58.6821 29.7437 176.9279 112 C 4.4301 8.2164 115.2888 61.1298 28.7282 174.4203 113 F 4.1497 7.8112 123.1571 56.4983 37.0653 174.0213 114 K 4.5069 7.2024 121.6747 54.0648 35.8845 176.5534 115 C 4.1729 8.5672 121.5318 59.2975 31.7853 174.5210 116 A 3.6463 8.5547 130.8266 55.0238 17.4362 177.8849 117 A 4.3710 6.7199 118.5173 54.3751 19.0683 177.7108 118 C 4.2089 8.1032 108.4410 57.9431 30.6022 175.2501 119 Q 3.6867 8.1949 118.4384 56.3240 26.7569 173.4564 120 K 3.9129 7.1032 119.9027 56.5413 32.7222 176.0394 121 H 4.6072 8.2468 122.1930 54.8159 30.0708 174.7873 122 F 4.7423 8.5115 120.5290 56.4905 41.0720 174.7715 123 C 5.0072 8.5454 117.8188 57.4814 31.1302 174.3407 124 V 3.8110 8.2580 121.9121 64.7314 31.3763 176.5352 125 G 4.0425 8.9738 115.5517 45.2582 0.0000 173.4155 126 D 4.6273 7.8366 119.0735 54.7288 41.1483 175.6691 127 R 4.8751 8.5554 120.2851 54.7566 32.8596 174.7359 128 Y 4.9520 8.0009 120.0957 55.3724 42.0838 173.6614 129 L 4.5824 9.1336 120.8737 53.0602 45.5577 174.7811 130 L 5.0396 8.5728 127.8589 53.8389 43.3028 175.6792 131 I 4.4526 8.4797 128.7417 60.3138 39.4150 176.2178 132 N 4.2273 8.4900 125.5152 54.9030 37.0498 175.3943 133 S 4.8665 9.0281 120.5291 59.0188 63.3645 172.6908 134 D 4.8042 8.5050 122.0597 53.7938 42.6577 175.4007 135 I 4.4681 7.9770 123.5902 59.7633 39.2188 174.6508 136 V 4.4783 8.3805 127.4192 60.5980 33.7725 175.1791 137 C 4.9154 8.7841 122.5233 58.0186 30.7565 174.3892 138 E 4.0425 8.6923 119.5179 59.9173 29.1802 180.0537 139 Q 4.0492 8.2155 115.5562 58.8444 28.9936 177.6649 140 D 4.8816 7.8739 115.1772 54.3353 40.9840 178.4410 141 I 3.8128 7.7010 122.6890 64.5034 37.1554 177.3616 142 Y 4.2385 8.1989 119.8785 61.0256 38.5703 177.8583 143 E 3.7640 8.3276 118.6093 59.3428 29.8754 178.9479 144 W 4.2058 8.5982 128.2524 60.9233 30.4084 178.1686 145 T 4.0001 7.8416 115.0005 66.1196 68.0785 176.5735 146 K 3.9392 7.5849 120.5874 59.3833 32.2548 178.7411 147 I 3.6662 7.8010 119.2258 63.9785 37.1766 175.8705 148 N 4.3837 7.4401 119.6621 53.2147 38.6081 174.8061 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 24 G 8.34 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 25 G 8.81 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 26 C 9.20 4.21 0.00 3.11 3.09 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 27 Q 7.96 3.26 0.00 2.25 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.64 0.00 0.00 0.00 0.00 0.00 2.29 2.40 0.00 *41 Q 8.35 3.44 0.00 0.93 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.78 0.00 0.00 0.00 0.00 0.00 1.99 2.11 0.00 42 Y 7.29 4.40 0.00 2.73 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 43 W 8.24 5.26 0.00 3.41 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 44 H 8.84 4.73 0.00 3.25 3.30 0.00 5.69 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 E 8.68 4.21 0.00 2.09 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 2.44 2.38 0.00 46 D 8.04 4.62 0.00 2.69 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 47 C 8.20 4.22 0.00 3.16 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 48 L 7.51 4.14 0.00 1.66 1.63 0.79 0.24 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 49 S 8.41 4.99 0.00 3.82 3.82 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 50 C 8.87 3.89 0.00 3.04 2.98 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 51 D 8.22 4.57 0.00 2.80 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 52 L 7.86 4.55 0.00 1.56 1.66 0.90 0.86 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 53 C 8.14 4.65 0.00 3.04 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 54 G 8.52 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 55 C 8.15 4.32 0.00 3.01 2.88 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 56 R 8.45 4.93 0.00 1.88 1.87 0.00 3.48 0.00 0.00 3.29 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.58 0.00 57 L 8.83 3.93 0.00 1.56 1.64 0.86 1.08 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 58 G 8.29 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 0.00 0.00 0.00 59 E 8.19 4.03 0.00 1.98 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 2.32 2.30 0.00 60 V 7.19 3.70 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 0.78 0.00 0.00 0.98 0.00 0.00 61 G 8.42 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 0.00 0.00 0.00 62 R 8.33 4.46 0.00 1.78 1.95 0.00 3.15 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 63 R 7.73 4.54 0.00 1.57 1.35 0.00 3.10 0.00 0.00 3.02 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.47 0.00 64 L 7.91 4.75 0.00 1.43 1.28 0.83 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 65 Y 8.83 4.41 0.00 2.96 2.38 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 66 Y 8.57 4.80 0.00 2.94 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 67 K 7.97 4.39 0.00 1.58 1.10 0.00 1.51 0.00 0.00 1.38 0.00 0.00 2.89 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.30 0.86 7.81 68 L 9.34 3.65 0.00 1.77 1.68 1.12 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 69 G 7.86 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 70 R 7.40 4.68 0.00 1.65 1.93 0.00 3.29 0.00 0.00 3.15 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 71 K 8.74 4.46 0.00 1.73 1.68 0.00 1.58 0.00 0.00 1.38 0.00 0.00 2.59 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.40 1.58 7.81 72 L 9.58 5.16 0.00 1.79 1.65 1.14 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 73 C 8.66 4.78 0.00 3.15 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 74 R 8.87 3.66 0.00 2.18 2.15 0.00 3.35 0.00 0.00 3.49 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.70 0.00 75 R 7.87 2.73 0.00 1.46 1.64 0.00 3.08 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.50 0.00 76 D 7.85 4.21 0.00 2.72 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 77 Y 8.24 4.18 0.00 2.99 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 78 L 8.33 3.90 0.00 1.94 1.76 1.06 1.25 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 79 R 7.82 3.83 0.00 1.80 1.83 0.00 3.05 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 80 L 7.04 3.92 0.00 1.39 0.20 0.71 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 81 F 7.76 4.65 0.00 1.95 2.71 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 82 G 7.44 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 0.00 0.00 0.00 83 Q 8.32 4.68 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.94 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 84 D 8.69 4.85 0.00 2.89 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 85 G 8.83 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 0.00 0.00 0.00 0.00 86 L 8.15 5.03 0.00 1.57 1.49 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 87 C 8.73 4.28 0.00 2.92 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 88 A 8.51 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 S 7.60 4.52 0.00 4.15 4.04 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 0.00 0.00 0.00 90 C 7.90 4.28 0.00 3.17 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 91 D 7.85 4.44 0.00 2.84 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 92 K 7.27 4.66 0.00 1.89 1.73 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.60 7.81 93 R 8.51 4.55 0.00 1.70 1.86 0.00 3.14 0.00 0.00 3.47 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 94 I 8.65 4.72 1.79 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 1.53 0.86 0.00 0.00 95 R 8.96 4.25 0.00 2.01 1.88 0.00 3.36 0.00 0.00 3.36 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.65 0.00 96 A 8.68 3.93 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 97 Y 7.80 4.58 0.00 2.84 2.98 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 98 E 8.05 4.14 0.00 2.31 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 99 M 8.32 4.32 0.00 1.92 1.93 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.45 0.00 100 T 8.33 5.02 4.21 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 1.20 0.00 0.00 101 M 9.02 4.35 0.00 0.86 1.70 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 2.36 0.00 102 R 8.41 4.77 0.00 1.67 1.87 0.00 3.14 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 103 V 8.80 4.32 2.41 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 1.27 0.00 0.00 1.07 0.00 0.00 104 K 8.34 3.70 0.00 1.99 1.01 0.00 1.84 0.00 0.00 1.78 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.40 1.41 7.81 105 D 8.95 4.51 0.00 2.79 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 0.00 106 K 7.99 4.52 0.00 1.97 1.55 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.45 1.47 7.81 107 V 7.79 5.00 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 0.87 0.00 0.00 0.92 0.00 0.00 108 Y 9.08 5.12 0.00 3.01 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 0.00 109 H 8.98 4.54 0.00 3.34 3.26 0.00 5.84 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 L 8.53 3.96 0.00 1.86 1.72 0.90 1.27 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 0.00 111 E 8.21 4.18 0.00 1.97 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 2.30 2.45 0.00 112 C 8.22 4.43 0.00 3.37 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 0.00 113 F 7.81 4.15 0.00 2.94 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 0.00 114 K 7.20 4.51 0.00 1.74 1.23 0.00 1.49 0.00 0.00 1.48 0.00 0.00 2.92 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.36 1.26 7.81 115 C 8.57 4.17 0.00 2.73 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 0.00 116 A 8.55 3.65 0.55 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 0.00 0.00 0.00 0.00 0.00 0.00 117 A 6.72 4.37 1.38 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 0.00 0.00 118 C 8.10 4.21 0.00 2.90 3.27 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 0.00 119 Q 8.19 3.69 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.88 0.00 0.00 0.00 0.00 0.00 2.24 2.23 0.00 120 K 7.10 3.91 0.00 1.63 1.39 0.00 1.35 0.00 0.00 0.96 0.00 0.00 2.79 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.84 1.14 7.81 121 H 8.25 4.61 0.00 3.13 3.20 0.00 5.74 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 0.00 122 F 8.51 4.74 0.00 3.19 3.09 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 0.00 123 C 8.55 5.01 0.00 3.37 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 0.00 124 V 8.26 3.81 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 0.78 0.00 0.00 0.92 0.00 0.00 125 G 8.97 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 126 D 7.84 4.63 0.00 3.04 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 0.00 127 R 8.56 4.88 0.00 1.96 1.77 0.00 3.43 0.00 0.00 3.37 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 128 Y 8.00 4.95 0.00 2.74 2.40 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 0.00 129 L 9.13 4.58 0.00 1.67 1.63 0.91 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 130 L 8.57 5.04 0.00 1.83 1.63 1.18 1.11 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 0.00 131 I 8.48 4.45 2.07 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.44 1.05 0.00 0.00 132 N 8.49 4.23 0.00 2.97 2.08 0.00 0.00 7.02 7.57 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 0.00 133 S 9.03 4.87 0.00 4.01 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 0.00 134 D 8.51 4.80 0.00 2.76 2.44 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 0.00 135 I 7.98 4.47 1.50 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 -0.27 -0.15 0.00 0.00 136 V 8.38 4.48 1.89 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 0.83 0.00 0.00 -0.13 0.00 0.00 137 C 8.78 4.92 0.00 3.33 3.09 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 0.00 138 E 8.69 4.04 0.00 2.15 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 2.37 2.33 0.00 139 Q 8.22 4.05 0.00 2.06 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 7.09 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 140 D 7.87 4.88 0.00 2.78 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 0.00 141 I 7.70 3.81 2.05 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 1.46 0.86 1.00 0.00 0.00 142 Y 8.20 4.24 0.00 3.02 3.02 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 0.00 143 E 8.33 3.76 0.00 2.35 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 0.00 2.46 2.52 0.00 144 W 8.60 4.21 0.00 3.60 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 0.00 145 T 7.84 4.00 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 1.23 0.00 0.00 146 K 7.58 3.94 0.00 1.68 1.64 0.00 0.88 0.00 0.00 1.38 0.00 0.00 2.92 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.26 1.19 7.81 147 I 7.80 3.67 1.48 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.60 0.52 0.00 0.00 148 N 7.44 4.38 0.00 2.47 2.50 0.00 0.00 7.00 6.85 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 * Residues marked with a * may have inaccurate shift predictions.