NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 40 S 4.5135 8.3193 115.4140 58.7057 64.1988 173.0381 41 T 4.4412 8.1095 107.6993 60.4453 70.0504 172.9020 42 Q 4.2297 8.1577 122.0131 56.0583 30.4022 176.3355 43 S 4.6321 8.0824 114.4106 57.4412 65.7500 174.2415 44 H 4.9773 8.3206 122.8474 54.2158 26.9807 175.7775 *46 F 4.6471 7.9725 118.0883 56.4712 40.6103 174.7035 47 D 4.3492 8.0673 122.1153 56.1694 40.9513 177.5678 48 G 4.0120 8.8780 110.3962 46.0659 0.0000 172.9417 49 I 4.1847 7.4163 121.1933 59.8378 37.8691 175.6529 50 S 4.4526 8.6454 120.7551 57.5699 63.7773 173.4823 51 L 4.9090 8.1754 124.8452 52.6086 44.2952 176.8455 52 T 4.2020 8.6229 112.3103 61.2674 70.8048 175.4142 53 E 3.8878 8.6105 121.6764 59.7808 29.6362 178.3584 54 H 4.2298 8.1771 117.8040 59.1848 29.7590 177.1716 55 Q 3.8529 7.9488 119.1074 58.9575 28.6722 178.2971 56 R 3.9605 7.9530 118.5930 59.3493 30.3725 177.9808 57 Q 4.1450 8.2977 119.5097 59.1727 29.0512 179.2429 58 Q 4.1758 7.7721 116.9881 56.2425 28.3665 178.2945 *60 R 4.1864 7.9068 121.5264 56.5846 32.1065 176.3564 61 D 4.4775 8.2060 117.4608 57.5673 41.0250 179.3907 62 L 3.9919 8.2540 115.8025 55.7852 41.1402 178.9254 *64 Q 4.2481 8.1208 120.4693 56.0850 30.8912 177.5096 65 Q 3.9351 8.2737 118.2208 58.9429 28.7824 177.9049 66 A 4.0270 7.9700 121.0583 55.1557 18.6809 179.5436 67 R 3.9978 7.9372 115.9719 59.7284 30.0525 178.2264 68 H 4.0236 8.2129 116.8646 59.7085 29.8697 176.4542 69 E 4.2771 8.1722 117.4417 56.6256 29.5677 176.3790 70 Q 4.3027 7.4871 121.1628 53.9543 29.5627 173.7430 71 P 4.4181 0.0000 0.0000 61.4887 32.0330 174.3067 72 P 4.4500 0.0000 0.0000 61.9607 31.9794 176.1474 73 V 3.4475 8.2298 117.8526 63.9365 31.6308 176.4461 74 N 4.6456 8.5632 125.1864 52.5381 37.8712 175.6042 75 V 3.6898 8.0503 127.7736 64.3384 31.7194 178.3100 76 S 4.4073 7.9776 115.8086 60.8591 62.6267 176.2518 77 E 3.9703 8.3266 121.4300 58.9563 29.2367 178.8382 78 L 4.1568 7.5737 118.0515 57.8163 41.4481 179.0722 79 E 4.2105 8.3586 118.4756 59.6221 29.3730 180.3538 80 T 3.8628 7.9132 112.8142 64.5460 68.5184 175.5456 *82 H 4.6825 8.1343 122.7950 56.3553 31.5608 175.5935 83 R 3.9920 8.1744 117.2813 59.0821 29.9101 178.7679 84 L 4.1072 7.9799 119.0652 57.8039 41.4305 179.6508 85 V 4.0739 7.8887 116.5764 64.9439 31.5763 176.9427 86 T 4.4867 7.1814 106.7412 60.4746 69.2895 174.3293 87 A 4.2029 7.0537 124.1236 52.1794 19.0759 178.0751 88 E 3.9858 8.8586 121.3082 58.4042 29.8592 176.5354 89 N 4.8616 7.7769 115.9302 50.7162 39.6299 173.5582 90 F 4.0501 8.8201 125.8633 58.1890 40.0256 174.8383 91 D 4.5440 7.4682 126.7479 51.8577 42.2099 175.5323 92 E 3.6448 8.2225 127.9102 58.9656 29.7429 178.0054 93 N 4.2751 8.0950 115.9684 56.2033 38.6345 177.0615 94 A 3.9152 8.0408 122.0230 54.9559 18.3824 179.8322 95 V 3.4478 7.7312 116.9310 66.1058 31.5279 178.2720 96 R 3.8615 8.3445 118.6263 59.3590 29.9523 178.2859 97 A 4.2431 8.0880 122.0251 54.6930 18.1216 179.4502 98 Q 3.8952 8.0899 117.0387 59.1893 29.2149 177.8465 99 A 4.1387 8.2130 121.4218 55.0425 18.7752 179.1543 100 E 4.1071 8.5647 117.5699 59.3464 29.3234 180.0158 101 K 3.8464 7.8924 115.5665 57.5531 32.0322 177.8602 *103 A 4.3813 7.9631 122.6136 51.8595 20.7696 179.5926 104 N 4.3633 8.0746 113.1421 56.3775 38.4987 177.5288 105 E 4.0022 7.9035 118.9037 59.2621 29.4479 179.0812 106 Q 3.9583 8.0186 119.2174 59.1238 29.1701 178.0736 107 I 3.6644 8.0264 120.8087 64.4374 37.3135 178.1597 108 A 3.9985 7.8719 121.0994 55.2671 17.9566 179.9134 109 R 3.8873 7.7106 115.3350 59.6420 30.2545 179.1068 110 Q 4.1372 8.2448 117.0097 58.7746 28.9331 178.6752 111 V 3.7974 8.0014 119.6062 65.6505 31.5455 178.1556 112 E 3.9317 7.9843 116.9335 56.5469 29.3890 178.2187 *114 A 4.2807 7.9909 121.8861 51.6910 20.8737 180.0037 115 K 3.9656 8.1451 115.2450 59.7023 31.8552 179.7698 116 V 3.6222 7.5629 117.1093 66.1406 31.5305 178.0216 117 R 4.2974 7.9578 116.4025 59.1573 30.2830 177.9892 118 N 4.6130 8.6428 117.4695 56.5420 38.7902 177.2926 119 Q 3.8385 8.1403 117.9543 57.0742 28.9529 177.0487 *121 Y 4.8490 7.8674 121.5121 57.3432 40.4552 177.0013 122 R 4.0910 7.9982 116.9992 58.1507 30.2617 177.4887 123 L 4.1818 7.2920 116.4837 56.0046 42.0283 177.2846 124 L 4.4516 7.2686 118.9566 53.9735 42.5553 177.3767 125 T 4.1704 8.8107 112.5691 60.7966 70.9567 173.9275 126 P 4.4293 0.0000 0.0000 65.1456 31.3371 178.8144 127 E 3.9718 8.0686 116.7174 59.6670 29.4257 179.3281 128 Q 4.0560 8.1850 117.9902 58.9966 28.8497 178.7975 129 Q 3.9948 8.4707 119.3945 58.8266 28.6867 178.6707 130 A 4.1517 8.1703 121.9758 54.9383 18.3181 179.8766 131 V 3.5398 7.7795 116.7464 66.0023 31.6230 177.9324 132 L 3.9597 8.1720 120.2417 58.4720 41.8737 178.8186 133 N 4.3748 8.5049 116.5293 56.1369 38.3733 177.1472 134 E 3.9353 8.3863 120.9035 59.1693 29.7218 178.9806 135 K 3.9484 8.4405 119.0171 59.6320 31.8584 178.7913 136 H 4.0136 8.1640 117.6415 59.1746 29.8723 176.7072 137 Q 4.1207 8.0754 120.2967 59.5200 28.9878 178.1304 138 Q 4.1855 8.0568 117.7603 58.6552 29.0660 179.0373 139 R 4.0034 7.8626 117.8404 56.8521 29.9993 177.6250 *141 E 4.3207 8.2233 119.8801 55.6593 31.2564 177.6535 142 Q 4.1235 7.8914 117.5173 58.9059 28.8193 177.9951 143 L 4.3572 7.9915 115.0218 56.0994 41.8982 177.3682 144 R 4.5341 8.1174 116.7543 55.5417 30.9881 175.2817 145 D 4.8147 7.9430 118.1222 51.5173 41.9061 176.4357 146 V 3.9136 8.3831 127.9517 64.8447 31.4897 178.0040 147 T 4.3294 8.0508 110.9178 63.6117 68.4953 175.9682 148 Q 4.0951 7.9310 119.4069 56.6980 28.8646 176.2616 149 W 4.7020 7.9102 118.1987 56.2686 30.5532 175.5910 150 Q 4.2730 7.8666 123.1247 56.0856 28.2915 175.4637 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 40 S 8.32 4.51 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 41 T 8.11 4.44 4.26 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 0.00 0.00 0.00 1.22 0.00 0.00 42 Q 8.16 4.23 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.77 0.00 0.00 0.00 0.00 0.00 2.37 2.29 0.00 43 S 8.08 4.63 0.00 3.81 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 44 H 8.32 4.98 0.00 3.25 3.23 0.00 5.98 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *46 F 7.97 4.65 0.00 3.14 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 8.07 4.35 0.00 2.83 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 48 G 8.88 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 49 I 7.42 4.18 2.01 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 1.77 1.04 0.99 0.00 0.00 50 S 8.65 4.45 0.00 3.99 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 51 L 8.18 4.91 0.00 1.62 1.58 0.89 1.02 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 52 T 8.62 4.20 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 1.26 0.00 0.00 53 E 8.61 3.89 0.00 2.10 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 2.38 2.44 0.00 54 H 8.18 4.23 0.00 3.22 3.27 0.00 5.75 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 55 Q 7.95 3.85 0.00 2.21 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.73 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 56 R 7.95 3.96 0.00 1.77 2.08 0.00 3.26 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 57 Q 8.30 4.14 0.00 2.27 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.87 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 58 Q 7.77 4.18 0.00 2.17 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.17 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 *60 R 7.91 4.19 0.00 1.86 2.16 0.00 3.23 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.64 0.00 61 D 8.21 4.48 0.00 2.91 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 62 L 8.25 3.99 0.00 1.60 1.65 0.88 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 *64 Q 8.12 4.25 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.92 0.00 0.00 0.00 0.00 0.00 2.34 2.48 0.00 65 Q 8.27 3.94 0.00 2.16 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 66 A 7.97 4.03 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 67 R 7.94 4.00 0.00 2.02 2.00 0.00 3.16 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 68 H 8.21 4.02 0.00 3.18 3.59 0.00 5.94 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 E 8.17 4.28 0.00 2.02 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 2.40 2.53 0.00 70 Q 7.49 4.30 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.92 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 71 P 0.00 4.42 0.00 2.07 1.96 0.00 3.73 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 72 P 0.00 4.45 0.00 2.17 2.06 0.00 3.78 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 73 V 8.23 3.45 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.93 0.00 0.00 74 N 8.56 4.65 0.00 2.79 2.71 0.00 0.00 6.96 7.71 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 75 V 8.05 3.69 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.93 0.00 0.00 76 S 7.98 4.41 0.00 4.07 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 77 E 8.33 3.97 0.00 2.10 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 2.54 2.49 0.00 78 L 7.57 4.16 0.00 1.78 1.74 0.92 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 79 E 8.36 4.21 0.00 2.19 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 2.33 2.46 0.00 80 T 7.91 3.86 4.38 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 1.21 0.00 0.00 *82 H 8.13 4.68 0.00 3.33 3.54 0.00 5.87 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 R 8.17 3.99 0.00 1.98 1.99 0.00 3.23 0.00 0.00 3.24 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.88 0.00 84 L 7.98 4.11 0.00 1.70 1.64 0.89 0.76 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 85 V 7.89 4.07 2.11 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 0.90 0.00 0.00 1.05 0.00 0.00 86 T 7.18 4.49 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 1.10 0.00 0.00 87 A 7.05 4.20 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 88 E 8.86 3.99 0.00 1.95 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 2.31 2.35 0.00 89 N 7.78 4.86 0.00 2.69 2.75 0.00 0.00 6.83 7.45 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 90 F 8.82 4.05 0.00 2.96 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 91 D 7.47 4.54 0.00 2.56 2.28 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 0.00 0.00 0.00 0.00 92 E 8.22 3.64 0.00 2.15 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 2.39 2.51 0.00 93 N 8.09 4.28 0.00 2.85 2.81 0.00 0.00 7.05 7.09 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 94 A 8.04 3.92 1.27 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 0.00 0.00 95 V 7.73 3.45 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 1.10 0.00 0.00 0.68 0.00 0.00 96 R 8.34 3.86 0.00 1.94 2.03 0.00 3.14 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.64 0.00 97 A 8.09 4.24 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 98 Q 8.09 3.90 0.00 2.08 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.91 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 99 A 8.21 4.14 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 0.00 100 E 8.56 4.11 0.00 2.16 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 2.33 2.44 0.00 101 K 7.89 3.85 0.00 1.83 1.93 0.00 1.81 0.00 0.00 1.84 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.46 7.81 *103 A 7.96 4.38 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 0.00 104 N 8.07 4.36 0.00 2.94 2.88 0.00 0.00 6.96 7.33 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 0.00 105 E 7.90 4.00 0.00 2.06 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 2.33 2.31 0.00 106 Q 8.02 3.96 0.00 2.16 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.89 0.00 0.00 0.00 0.00 0.00 2.43 2.51 0.00 107 I 8.03 3.66 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 1.45 0.55 0.91 0.00 0.00 108 A 7.87 4.00 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 0.00 109 R 7.71 3.89 0.00 1.98 2.01 0.00 3.32 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.86 0.00 110 Q 8.24 4.14 0.00 2.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.97 0.00 0.00 0.00 0.00 0.00 2.59 2.51 0.00 111 V 8.00 3.80 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.98 0.00 0.00 112 E 7.98 3.93 0.00 2.17 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 0.00 2.31 2.38 0.00 *114 A 7.99 4.28 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 0.00 115 K 8.15 3.97 0.00 2.04 1.89 0.00 1.68 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.64 7.81 116 V 7.56 3.62 2.11 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 0.84 0.00 0.00 0.99 0.00 0.00 117 R 7.96 4.30 0.00 1.90 2.15 0.00 3.32 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.80 0.00 118 N 8.64 4.61 0.00 2.76 3.08 0.00 0.00 6.79 6.78 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 0.00 119 Q 8.14 3.84 0.00 2.19 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.16 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 *121 Y 7.87 4.85 0.00 3.34 3.29 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 0.00 122 R 8.00 4.09 0.00 2.09 2.00 0.00 3.37 0.00 0.00 3.48 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.79 0.00 123 L 7.29 4.18 0.00 1.72 1.66 0.85 0.94 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 0.00 124 L 7.27 4.45 0.00 1.54 1.51 1.08 0.97 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 0.00 125 T 8.81 4.17 4.34 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 1.23 0.00 0.00 126 P 0.00 4.43 0.00 2.16 2.14 0.00 3.85 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.02 0.00 127 E 8.07 3.97 0.00 2.04 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 2.40 2.46 0.00 128 Q 8.18 4.06 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 129 Q 8.47 3.99 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 1.34 2.21 0.00 130 A 8.17 4.15 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 0.00 131 V 7.78 3.54 2.24 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 1.09 0.00 0.00 1.02 0.00 0.00 132 L 8.17 3.96 0.00 1.93 1.95 0.78 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 133 N 8.50 4.37 0.00 2.87 2.87 0.00 0.00 6.71 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 0.00 134 E 8.39 3.94 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 135 K 8.44 3.95 0.00 1.97 1.85 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.63 7.81 136 H 8.16 4.01 0.00 3.23 3.43 0.00 5.76 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 Q 8.08 4.12 0.00 2.17 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 138 Q 8.06 4.19 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 7.38 0.00 0.00 0.00 0.00 0.00 2.39 2.51 0.00 139 R 7.86 4.00 0.00 2.00 1.91 0.00 3.05 0.00 0.00 3.02 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 *141 E 8.22 4.32 0.00 2.21 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 2.28 2.42 0.00 142 Q 7.89 4.12 0.00 2.46 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.19 6.66 0.00 0.00 0.00 0.00 0.00 2.59 2.54 0.00 143 L 7.99 4.36 0.00 1.66 1.70 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 144 R 8.12 4.53 0.00 1.79 1.91 0.00 3.11 0.00 0.00 3.16 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 145 D 7.94 4.81 0.00 2.79 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 V 8.38 3.91 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 0.89 0.00 0.00 1.00 0.00 0.00 147 T 8.05 4.33 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 1.23 0.00 0.00 148 Q 7.93 4.10 0.00 1.82 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.85 0.00 0.00 0.00 0.00 0.00 2.26 2.47 0.00 149 W 7.91 4.70 0.00 3.40 3.24 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 0.00 150 Q 7.87 4.27 0.00 2.23 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.55 0.00 0.00 0.00 0.00 0.00 2.39 2.57 0.00 * Residues marked with a * may have inaccurate shift predictions.