NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 25 A 3.7679 8.1227 123.5735 52.0057 20.8281 178.7820 26 K 3.5624 7.8127 116.2659 59.5654 32.2499 176.2463 27 E 3.8968 8.3781 119.8734 60.6339 30.0456 180.2504 28 A 4.1325 7.8170 120.1194 55.4993 18.4224 179.6789 29 I 2.7240 7.6226 118.4596 64.2194 37.0164 178.5543 30 E 3.9115 8.2092 119.3753 59.2200 29.2830 179.3351 31 A 3.9514 8.3544 121.1050 55.0377 18.4469 179.4988 32 A 4.0234 8.0740 119.4476 55.5154 18.3846 179.6677 33 N 4.3574 8.6430 115.1750 56.2741 38.5724 177.5561 34 A 4.0193 8.0002 122.3953 55.3065 18.4917 179.4585 35 D 4.3597 8.1695 117.3377 57.2097 40.7508 178.7750 36 F 3.9368 8.3728 121.3033 61.3682 39.4061 177.4186 37 V 3.7230 8.2197 118.0730 65.7507 31.3304 177.7767 38 K 3.8890 8.2398 119.1879 59.5046 32.0664 178.6074 39 A 3.8861 8.0244 120.9113 55.1697 18.2211 178.7937 40 Y 3.5268 8.0118 118.2634 61.0014 38.7042 178.2261 41 N 4.4898 8.4321 115.2683 55.3337 38.7429 176.5674 42 S 4.3748 7.6863 115.1976 57.3251 63.6062 173.8081 43 K 3.5268 7.7493 120.2668 58.0258 29.5582 176.4349 44 D 4.6984 7.4910 118.0097 51.7197 41.1852 175.5986 45 A 3.9677 8.1312 125.5893 54.5191 18.7903 178.7951 46 A 4.1509 8.0699 118.9790 55.3834 18.2033 179.9884 47 G 3.5414 7.9835 104.5896 47.1603 0.0000 175.8810 48 V 3.1616 7.6598 120.3810 65.6588 31.5423 178.0273 49 A 4.1852 8.2118 120.8843 55.0638 17.9662 179.1718 50 S 4.3728 7.7802 110.9115 60.1797 63.4856 175.7835 51 K 4.3222 8.2710 122.0598 57.7063 32.2802 176.2087 52 Y 4.9644 8.2036 116.8208 57.3767 37.0027 176.9595 *54 D 4.8285 8.7006 125.7297 54.2685 43.5829 175.5620 55 D 4.8836 8.0857 115.5938 53.1014 40.3135 176.9435 56 A 4.5327 8.2865 120.4306 52.9309 20.2851 176.9333 57 A 5.0581 8.9067 119.7117 50.1130 22.7462 175.1813 58 A 5.3980 8.8073 123.0502 50.3104 21.1804 175.5935 59 F 4.8073 9.1696 119.8534 54.8015 39.4365 172.2968 60 P 3.1227 0.0000 0.0000 60.4171 32.6161 175.5960 61 P 4.0271 0.0000 0.0000 63.9973 32.2016 175.9435 62 D 4.1135 8.3457 119.7171 55.3007 37.7855 173.4468 *64 A 4.0124 7.4812 119.6129 51.3220 20.1646 176.7794 65 R 3.7107 8.2774 120.0931 57.0800 30.8309 175.8472 66 V 4.1727 8.5648 125.8571 61.3533 33.4431 173.7735 67 D 4.9287 8.7702 128.0501 53.6171 42.7410 177.3389 68 G 4.0521 9.1841 109.3532 45.9561 0.0000 174.2043 69 R 3.8253 8.5637 121.3833 59.3303 29.5060 179.0522 70 Q 3.9745 8.0380 116.7774 59.6351 28.5434 178.3149 71 N 4.4493 8.0313 117.7990 55.4991 38.7658 177.4089 72 I 3.5813 7.8722 121.6819 64.0972 36.9917 177.9690 73 Q 4.0577 8.2282 120.5532 59.4284 28.7974 178.8218 74 K 3.9636 7.7206 118.1415 59.1210 31.9921 179.0844 75 L 3.8012 7.8539 120.6519 58.1338 41.8269 179.2619 76 W 4.3565 7.9138 117.3186 59.6408 29.0243 178.0224 77 Q 4.2593 8.5089 119.5957 59.1216 28.5355 178.2210 78 G 3.8314 8.2417 105.9050 47.6250 0.0000 175.7758 79 A 4.1500 7.8293 119.0248 52.9037 18.0862 177.7635 *81 D 4.1144 8.0220 117.9800 55.6610 42.2230 176.6908 *83 G 3.9135 8.1615 104.9647 45.0186 0.0000 173.5904 84 I 4.1388 7.8722 121.7313 61.1258 37.4702 175.6376 85 S 4.8814 8.9061 119.2089 57.1126 66.5312 172.9746 86 E 3.9631 8.9237 116.3157 57.3040 26.5639 174.7300 87 L 4.4202 8.3554 119.9910 55.2517 43.2269 176.6476 88 K 4.7998 9.2818 124.7879 54.5745 36.2411 175.0499 89 L 5.3513 8.6719 123.2798 53.2834 44.7054 175.8384 90 T 4.6192 9.1678 120.9822 61.8624 71.2478 173.5916 91 T 4.3056 8.6736 124.1406 63.6947 68.5537 174.5173 92 L 4.5536 8.6596 126.9022 56.3901 43.3236 176.5766 93 D 4.6664 7.5481 115.1090 52.5073 42.4177 174.9414 94 V 4.9574 8.2461 119.1779 61.5051 34.8786 174.1309 95 Q 4.7196 9.3430 126.5758 54.0999 31.8265 173.9124 96 E 4.7401 8.8468 124.7482 54.8254 31.8211 175.9389 97 S 4.5395 9.5551 121.4000 57.5835 64.4893 174.9028 98 G 3.8974 8.2297 120.1689 47.0945 0.0000 172.5730 99 D 4.4124 8.7616 125.4655 54.1798 41.0324 175.0444 100 F 5.7035 8.3704 118.3498 55.7122 42.9155 174.1211 101 A 4.7862 8.9095 121.6991 50.1892 22.9449 174.9997 102 F 5.3589 9.1753 119.7643 55.7432 41.7765 174.1330 103 E 5.3755 9.7720 125.7958 54.3466 32.3411 174.7618 104 S 5.1598 8.6572 120.5084 57.0408 66.9426 173.2234 105 G 3.8943 7.3737 107.0545 45.8393 0.0000 171.8941 106 S 5.4958 8.6901 114.0525 56.3196 66.4876 173.2383 107 F 5.7898 8.8679 115.8370 55.3965 41.5569 173.6702 108 S 5.3632 8.9854 113.4581 57.3234 66.9892 172.4566 109 L 5.2247 8.5172 119.8647 56.2886 44.1765 173.3586 110 K 5.2831 9.1801 117.6524 54.9060 36.2951 175.6355 111 A 5.2779 8.8115 123.0949 49.7026 23.0297 174.0530 112 P 4.6316 0.0000 0.0000 63.2356 32.3714 177.0384 113 G 4.0335 8.8299 114.5381 45.1095 0.0000 174.7077 114 K 3.9779 8.7616 122.0345 58.1289 32.1101 173.9131 115 D 4.6135 8.2862 117.2547 53.6363 39.8993 182.1099 116 S 3.9371 8.2440 115.8256 60.0008 61.3288 177.8734 117 K 4.3851 7.5895 123.1732 55.9346 32.6734 181.9316 118 L 4.5626 8.5079 123.3633 54.4575 42.7647 176.5037 119 V 4.4595 8.8650 123.0500 60.9420 34.0613 174.6489 120 D 5.1738 8.8430 127.4124 54.5773 41.7256 175.4773 121 A 4.9127 9.1566 122.5583 50.5743 23.2801 174.7895 122 A 4.5877 8.1287 120.1077 50.7064 23.4367 175.5496 123 G 4.0118 6.9058 103.2974 46.4109 0.0000 172.5594 124 K 5.3724 8.5576 119.3242 56.0866 36.6508 174.9482 125 Y 5.6003 8.6083 118.3313 56.0670 42.2262 173.5903 126 V 5.1040 9.1396 119.6253 61.2223 35.1568 174.2760 127 V 4.9210 9.2545 127.2659 61.1185 34.7298 174.1815 128 V 4.6968 8.8516 128.4099 61.9550 32.7170 174.8618 129 W 5.3306 9.4808 128.6818 55.6354 31.4959 175.4334 130 R 5.0939 9.5072 122.3327 54.5423 33.4080 173.7293 131 K 4.0688 8.1521 127.0873 54.1658 33.0925 176.5527 132 G 3.7137 8.5915 119.3443 45.8347 0.0000 174.6762 133 Q 3.9160 8.4138 117.8216 57.7499 28.0800 177.1672 134 D 4.3982 7.8676 114.9905 54.4038 39.5751 177.2191 135 G 3.6757 8.0558 108.8620 45.0080 0.0000 173.4599 136 G 3.8707 8.5720 108.8962 45.0906 0.0000 173.6311 137 W 5.1536 8.7260 125.7214 56.7287 29.9432 175.8982 138 K 5.2275 9.6391 122.8969 54.4165 36.0021 175.7760 139 L 3.5081 8.4201 123.2562 55.1552 42.2076 176.8127 140 Y 4.7997 9.2847 123.5372 58.5395 41.9086 175.5097 141 R 5.2652 8.0639 117.1368 54.3465 34.3145 174.0569 142 D 5.1329 9.5667 122.8525 52.6393 44.3150 173.9431 143 I 5.1615 8.9137 126.3940 59.1339 41.6057 173.9329 144 W 6.0476 7.8706 124.7583 55.9268 31.9554 172.6460 145 N 5.0722 9.4333 117.0178 52.3804 40.5902 173.4841 146 S 5.1523 8.7198 114.7206 58.1584 64.2022 173.8867 147 D 5.0363 8.3829 122.4213 52.0579 42.5335 175.0097 148 P 4.4026 0.0000 0.0000 61.7011 32.3183 175.8994 149 A 3.8683 8.4399 121.4091 53.0055 18.4880 177.7478 150 K 4.1410 8.5914 122.8466 56.4608 32.3718 175.6749 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 25 A 8.12 3.77 0.68 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 0.00 0.00 26 K 7.81 3.56 0.00 1.83 1.70 0.00 1.50 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.53 7.81 27 E 8.38 3.90 0.00 2.01 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 2.31 1.94 0.00 28 A 7.82 4.13 1.30 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 29 I 7.62 2.72 1.49 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.48 0.00 0.00 30 E 8.21 3.91 0.00 2.05 1.96 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 2.29 2.36 0.00 31 A 8.35 3.95 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 32 A 8.07 4.02 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 33 N 8.64 4.36 0.00 2.95 2.89 0.00 0.00 6.92 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 34 A 8.00 4.02 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 35 D 8.17 4.36 0.00 2.98 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 36 F 8.37 3.94 0.00 3.19 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 37 V 8.22 3.72 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 1.11 0.00 0.00 1.01 0.00 0.00 38 K 8.24 3.89 0.00 2.01 1.95 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.47 7.81 39 A 8.02 3.89 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 Y 8.01 3.53 0.00 2.86 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.43 4.49 0.00 2.83 2.91 0.00 0.00 7.15 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 42 S 7.69 4.37 0.00 3.94 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 43 K 7.75 3.53 0.00 1.79 1.75 0.00 1.49 0.00 0.00 1.50 0.00 0.00 2.90 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.27 1.42 7.81 44 D 7.49 4.70 0.00 2.64 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 45 A 8.13 3.97 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.07 4.15 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 47 G 7.98 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.66 3.16 1.85 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 -0.61 0.00 0.00 0.62 0.00 0.00 49 A 8.21 4.19 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 50 S 7.78 4.37 0.00 4.09 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 51 K 8.27 4.32 0.00 1.89 1.99 0.00 1.71 0.00 0.00 1.69 0.00 0.00 3.09 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.64 1.70 7.81 52 Y 8.20 4.96 0.00 3.15 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.70 4.83 0.00 2.70 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 55 D 8.09 4.88 0.00 2.79 2.84 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.29 4.53 1.60 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 57 A 8.91 5.06 0.98 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 58 A 8.81 5.40 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 59 F 9.17 4.81 0.00 2.74 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 P 0.00 3.12 0.00 1.97 1.92 0.00 3.27 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.97 0.00 61 P 0.00 4.03 0.00 2.02 1.95 0.00 3.41 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.02 0.00 62 D 8.35 4.11 0.00 2.80 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 *64 A 7.48 4.01 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 R 8.28 3.71 0.00 1.53 1.61 0.00 2.54 0.00 0.00 2.82 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.50 0.00 66 V 8.56 4.17 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 0.91 0.00 0.00 0.85 0.00 0.00 67 D 8.77 4.93 0.00 2.50 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.18 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 69 R 8.56 3.83 0.00 1.98 1.99 0.00 3.15 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.91 0.00 70 Q 8.04 3.97 0.00 2.31 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.70 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 71 N 8.03 4.45 0.00 2.88 2.83 0.00 0.00 7.12 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 I 7.87 3.58 1.72 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.81 0.30 0.00 0.00 73 Q 8.23 4.06 0.00 2.13 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 74 K 7.72 3.96 0.00 2.02 1.82 0.00 1.85 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.57 7.81 75 L 7.85 3.80 0.00 1.60 1.66 0.77 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 76 W 7.91 4.36 0.00 3.36 3.33 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 77 Q 8.51 4.26 0.00 2.12 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.95 0.00 0.00 0.00 0.00 0.00 2.38 2.60 0.00 78 G 8.24 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 79 A 7.83 4.15 1.57 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 0.00 0.00 *81 D 8.02 4.11 0.00 2.88 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 *83 G 8.16 3.91 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 0.00 0.00 0.00 84 I 7.87 4.14 2.22 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 1.43 0.66 0.94 0.00 0.00 85 S 8.91 4.88 0.00 4.00 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 86 E 8.92 3.96 0.00 2.27 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 2.36 2.34 0.00 87 L 8.36 4.42 0.00 1.45 1.61 0.80 0.01 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 88 K 9.28 4.80 0.00 1.75 1.68 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.43 7.81 89 L 8.67 5.35 0.00 1.48 1.60 0.36 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 90 T 9.17 4.62 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 1.21 0.00 0.00 91 T 8.67 4.31 4.39 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 1.19 0.00 0.00 92 L 8.66 4.55 0.00 1.54 1.66 0.84 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 93 D 7.55 4.67 0.00 2.74 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 94 V 8.25 4.96 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 0.60 0.00 0.00 0.80 0.00 0.00 95 Q 9.34 4.72 0.00 2.26 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.57 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 96 E 8.85 4.74 0.00 1.90 1.85 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 2.34 2.40 0.00 97 S 9.56 4.54 0.00 4.05 4.02 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 98 G 8.23 3.90 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 0.00 0.00 0.00 99 D 8.76 4.41 0.00 2.35 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 0.00 0.00 0.00 0.00 100 F 8.37 5.70 0.00 3.04 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 0.00 101 A 8.91 4.79 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 F 9.18 5.36 0.00 3.17 3.04 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 0.00 103 E 9.77 5.38 0.00 2.23 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 2.38 2.32 0.00 104 S 8.66 5.16 0.00 3.81 3.91 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 0.00 105 G 7.37 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 0.00 106 S 8.69 5.50 0.00 3.77 3.84 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.87 5.79 0.00 3.20 3.26 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 0.00 108 S 8.99 5.36 0.00 3.91 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 0.00 109 L 8.52 5.22 0.00 1.98 1.86 1.03 0.54 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 0.00 110 K 9.18 5.28 0.00 1.72 1.74 0.00 1.88 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.53 1.41 7.81 111 A 8.81 5.28 1.26 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 0.00 0.00 0.00 112 P 0.00 4.63 0.00 2.11 2.10 0.00 3.81 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 113 G 8.83 4.03 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 0.00 0.00 0.00 114 K 8.76 3.98 0.00 1.79 1.75 0.00 1.80 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.01 7.81 115 D 8.29 4.61 0.00 2.60 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 0.00 116 S 8.24 3.94 0.00 3.80 3.87 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 0.00 0.00 0.00 117 K 7.59 4.39 0.00 1.48 1.72 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.37 1.30 7.81 118 L 8.51 4.56 0.00 1.55 1.66 0.96 0.87 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 0.00 119 V 8.86 4.46 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 1.01 0.00 0.00 0.96 0.00 0.00 120 D 8.84 5.17 0.00 2.62 2.61 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 0.00 121 A 9.16 4.91 1.30 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 0.00 122 A 8.13 4.59 1.09 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 0.00 0.00 123 G 6.91 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 0.00 124 K 8.56 5.37 0.00 1.78 1.82 0.00 1.30 0.00 0.00 1.79 0.00 0.00 3.09 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.46 7.81 125 Y 8.61 5.60 0.00 3.40 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 0.00 126 V 9.14 5.10 2.16 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 1.09 0.00 0.00 0.98 0.00 0.00 127 V 9.25 4.92 2.32 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 0.02 0.00 0.00 0.83 0.00 0.00 128 V 8.85 4.70 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 1.30 0.00 0.00 1.20 0.00 0.00 129 W 9.48 5.33 0.00 3.23 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 0.00 130 R 9.51 5.09 0.00 1.71 1.63 0.00 2.21 0.00 0.00 2.71 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.65 0.00 131 K 8.15 4.07 0.00 0.79 0.91 0.00 1.40 0.00 0.00 0.74 0.00 0.00 2.32 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.79 0.45 7.81 132 G 8.59 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 0.00 133 Q 8.41 3.92 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.98 0.00 0.00 0.00 0.00 0.00 2.28 1.92 0.00 134 D 7.87 4.40 0.00 2.73 2.78 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 0.00 0.00 0.00 0.00 135 G 8.06 3.68 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 0.00 0.00 0.00 136 G 8.57 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 137 W 8.73 5.15 0.00 3.07 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 0.00 138 K 9.64 5.23 0.00 1.80 1.85 0.00 1.74 0.00 0.00 1.93 0.00 0.00 2.87 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.50 1.52 7.81 139 L 8.42 3.51 0.00 0.75 1.06 0.30 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 140 Y 9.28 4.80 0.00 3.11 3.26 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 0.00 141 R 8.06 5.27 0.00 1.81 1.85 0.00 3.53 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 142 D 9.57 5.13 0.00 3.05 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 0.00 143 I 8.91 5.16 1.59 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.36 0.87 0.00 0.00 144 W 7.87 6.05 0.00 3.89 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 N 9.43 5.07 0.00 2.89 2.95 0.00 0.00 7.38 7.03 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 0.00 146 S 8.72 5.15 0.00 3.86 3.90 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 0.00 147 D 8.38 5.04 0.00 2.44 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 P 0.00 4.40 0.00 2.17 2.05 0.00 3.78 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 149 A 8.44 3.87 1.28 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 0.00 0.00 150 K 8.59 4.14 0.00 1.94 1.64 0.00 1.93 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.32 0.96 7.81 * Residues marked with a * may have inaccurate shift predictions.