NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 A 4.3844 8.1233 123.5866 52.2780 21.4690 178.8432 10 N 4.1237 8.0618 111.0594 55.8318 38.7650 175.7749 11 S 4.1534 8.9981 117.3590 62.1272 63.3029 176.5795 12 T 3.8925 7.8732 117.6802 66.6240 68.2446 176.9019 13 V 3.3666 7.6081 120.7506 64.7878 31.2856 178.3079 14 L 3.8454 8.3383 120.3610 57.2461 41.5876 179.3649 15 S 4.1866 8.2942 113.1840 61.3719 62.1348 175.7217 16 F 4.3587 8.1333 121.9054 61.7296 39.3400 176.6812 17 C 3.9508 8.4960 115.9708 62.8427 27.7816 175.6980 18 A 3.6681 8.1261 121.3839 55.1217 17.8869 178.8886 19 F 4.3872 7.4069 111.6364 57.0600 39.7754 176.4233 20 A 4.1302 7.0529 121.6428 51.8806 18.7383 178.1933 21 V 3.7613 8.1822 112.9792 63.6537 32.0951 176.4345 22 D 4.7222 7.5521 118.6117 50.2295 41.5782 173.2377 23 P 4.2190 0.0000 0.0000 65.1998 31.5045 177.2029 24 A 3.9381 8.0673 118.5998 55.3634 18.2403 179.2857 25 K 3.8322 8.4530 117.4579 59.6447 32.0876 178.8384 26 A 4.0952 8.0283 121.0005 55.3054 18.2669 178.9461 27 Y 4.2739 8.2000 118.1077 60.6881 38.8837 177.9570 28 K 3.7706 8.3375 120.5791 59.7981 32.0903 178.2539 29 D 4.3779 8.1789 117.7696 57.7682 41.1008 177.6851 30 Y 4.1608 8.4842 120.0442 60.9599 38.6941 178.0274 31 L 3.5533 8.3064 119.4588 57.9393 41.7272 179.4192 32 A 4.1831 7.7734 117.3492 53.5897 18.2352 178.3827 33 S 4.6426 7.9708 113.4661 57.8353 63.7304 174.7070 34 G 3.7451 7.7012 108.3406 45.9040 0.0000 174.9834 35 G 2.4729 7.2349 107.5719 44.5669 0.0000 173.6217 36 Q 4.1400 8.2162 123.5494 54.5140 29.8124 174.2800 37 P 4.6801 0.0000 0.0000 62.3600 32.1003 176.0831 38 I 4.0453 8.4594 122.6337 61.6729 37.3163 176.2216 39 T 4.5424 8.5507 115.8928 60.6771 71.1860 172.9492 40 N 4.3265 8.6894 114.6979 54.8266 34.7059 174.3924 41 C 4.6746 7.9926 114.9253 57.9309 30.0663 174.5683 42 V 3.8157 8.0736 117.3211 61.8370 32.2477 174.9833 43 K 4.4877 8.5995 125.8523 54.8587 33.9516 175.2552 44 M 4.3937 8.9300 127.1225 54.1993 33.7373 176.3236 45 L 4.2617 8.3804 124.1803 53.9451 41.5149 175.3051 46 C 4.7974 7.9602 119.8518 55.9536 32.3232 174.3238 47 T 3.9152 8.2832 114.0552 63.3592 67.0920 173.8471 48 H 4.1531 8.1449 116.6781 57.0480 26.0539 174.7740 49 T 4.6422 7.8141 105.4611 61.3925 69.3104 173.9414 50 G 3.9571 8.4807 112.4863 45.1931 0.0000 174.5946 51 T 3.8247 8.9776 109.8860 63.1026 68.4295 175.6772 52 G 4.4955 8.3439 108.8374 44.7398 0.0000 173.5479 53 Q 4.0557 7.4938 117.7274 55.4286 29.1417 175.8154 54 A 3.5215 7.9764 121.7130 54.3138 18.4073 176.9067 55 I 5.0175 7.2298 114.1269 59.5429 39.7922 174.6810 56 T 4.8366 8.9586 116.3401 59.9274 72.3799 175.2393 57 V 4.0578 8.6510 114.3009 63.0698 32.0960 176.5028 58 T 4.3570 7.5999 108.2406 59.0842 71.1863 171.1537 59 P 4.1583 0.0000 0.0000 63.6748 31.2895 175.8627 60 E 4.6048 9.2843 123.8329 55.6513 30.5052 176.3811 61 A 4.5252 7.6197 120.9612 52.3502 19.2038 177.8060 62 N 5.1241 8.4360 117.6284 51.0174 40.0246 175.0973 63 M 4.2192 8.6763 116.7140 57.7679 32.1126 176.8035 64 D 4.9248 9.9534 118.8060 53.9245 42.0532 174.9222 65 Q 5.2143 8.3617 118.2959 54.3023 33.7582 173.6519 66 E 5.0494 8.9200 118.7108 54.7717 33.7277 175.5912 67 S 5.2100 8.1832 116.4027 57.0652 65.9048 173.2933 68 F 5.2701 9.4004 124.0404 55.1713 42.3518 175.5207 69 G 3.5897 9.1111 109.7545 46.6572 0.0000 173.9714 70 G 3.9160 9.4328 113.1684 48.3872 0.0000 174.7214 71 A 3.7162 8.0678 122.4769 54.6437 18.2839 179.2003 72 S 4.3315 7.9866 110.1194 60.2066 63.5079 174.5304 73 C 4.4511 8.7969 120.4646 59.9616 29.9232 172.5652 74 C 4.6135 7.8011 119.4769 55.6572 44.6084 173.1072 75 L 3.5295 8.4269 130.6596 58.7319 41.4655 178.4923 76 Y 3.8464 7.3633 115.7055 61.1963 37.6530 178.9441 77 C 4.4436 8.0858 115.9725 59.7247 40.4286 175.6707 78 R 3.8058 7.8257 119.0940 58.3018 29.8915 177.7100 79 C 4.1880 7.8227 114.3930 59.0428 28.8703 173.0006 80 H 4.0537 7.9599 116.9249 57.1263 26.0223 173.7999 81 I 4.4982 7.3497 110.3994 58.5188 40.6028 173.9390 82 D 4.4512 8.2032 120.5517 54.1722 41.5822 175.2762 83 H 4.1279 7.8886 116.1285 53.4967 31.4839 172.3627 84 P 4.5442 0.0000 0.0000 63.0025 33.7454 177.0056 85 N 4.1282 8.1665 114.0524 55.2677 37.1475 176.7706 *89 F 3.8703 8.9089 125.7366 59.8720 40.5928 172.1989 90 C 4.2013 8.0256 127.0676 59.7886 29.5402 173.5208 91 D 4.5432 7.9414 114.0930 54.6302 39.5862 177.5909 92 L 4.3704 8.3562 121.3286 56.5652 42.8287 176.8419 93 K 3.8649 7.9105 117.7973 58.4424 32.0920 176.4371 94 G 3.8829 9.0597 114.5906 44.8405 0.0000 172.1487 95 K 4.5237 8.2308 119.3300 54.6174 36.0196 174.0336 96 Y 5.1296 8.8630 117.8280 56.6195 41.1593 175.3146 97 V 4.8528 8.9973 124.3688 61.4613 33.6729 174.3867 98 Q 5.6160 9.1424 128.3629 54.6910 29.6670 175.4880 99 I 4.2317 8.3870 124.4494 58.2720 41.0806 172.9482 100 P 4.3908 0.0000 0.0000 63.6241 31.7888 176.9409 101 T 3.7682 8.9814 122.5902 67.2167 68.5531 175.9890 102 T 4.1126 7.8906 106.9093 63.1331 68.6919 173.9859 103 C 4.6599 8.8191 118.8596 59.0907 30.1185 175.2641 104 A 3.9923 7.8685 122.3137 53.5783 17.9339 177.9548 105 N 4.6211 7.8283 112.9807 54.1886 38.8671 175.2743 106 D 4.7718 8.2511 119.1564 51.4837 41.6083 173.5222 107 P 3.9983 0.0000 0.0000 65.2598 31.2540 178.4916 108 V 4.1095 7.1242 118.0109 65.6206 31.4890 178.3156 109 G 3.9007 9.4489 105.9967 47.4642 0.0000 175.4069 110 F 3.8332 8.2720 123.2282 61.4534 39.2228 177.2489 111 T 3.7682 7.3670 107.6270 64.8083 68.4499 175.9176 112 L 4.1556 7.3311 119.7959 57.7588 41.7615 179.3896 113 R 4.0413 7.8431 116.8469 57.7995 30.2464 176.7937 114 N 4.6898 7.5846 115.3219 52.1610 40.3139 174.1092 115 T 4.8767 8.1152 114.3807 62.0348 72.5625 173.6830 116 V 4.0978 8.5468 126.2826 62.2790 32.7224 174.9492 117 C 4.4406 8.8259 129.2623 59.3314 31.8483 174.6868 118 T 3.8580 8.7229 116.6831 64.4582 68.9045 175.9876 119 V 3.7547 7.8746 121.4334 65.4646 31.7562 176.4206 120 C 4.3103 8.0453 111.4878 57.7907 30.6504 174.6004 121 G 3.8445 8.4712 109.0902 45.7695 0.0000 172.8461 122 M 4.6885 7.3880 118.8975 52.6879 34.2182 175.4255 123 W 4.9614 8.6064 120.8463 57.0675 29.6433 175.8483 124 K 4.1376 9.5513 125.9704 58.1624 31.9429 176.6330 125 G 3.8503 10.2090 113.2402 46.2240 0.0000 174.2100 126 Y 4.8364 8.2132 113.9317 56.2084 40.0120 174.5058 127 G 4.1266 8.3811 107.5904 45.9967 0.0000 173.1048 128 C 4.2071 8.2037 119.7275 60.2085 32.3366 173.0299 129 S 4.0279 8.7372 118.8224 58.9033 62.9881 171.6652 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 9 A 8.12 4.38 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 10 N 8.06 4.12 0.00 2.83 2.86 0.00 0.00 6.88 6.68 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 11 S 9.00 4.15 0.00 3.88 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 12 T 7.87 3.89 4.44 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 1.22 0.00 0.00 13 V 7.61 3.37 1.56 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 0.96 0.00 0.00 0.14 0.00 0.00 14 L 8.34 3.85 0.00 1.68 1.67 0.85 0.60 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 15 S 8.29 4.19 0.00 4.02 4.20 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 16 F 8.13 4.36 0.00 3.09 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 17 C 8.50 3.95 0.00 3.02 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 18 A 8.13 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 F 7.41 4.39 0.00 3.04 3.08 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 20 A 7.05 4.13 1.06 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 21 V 8.18 3.76 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 0.70 0.00 0.00 0.92 0.00 0.00 22 D 7.55 4.72 0.00 2.61 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 23 P 0.00 4.22 0.00 2.02 1.90 0.00 3.72 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 2.12 2.19 0.00 24 A 8.07 3.94 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 25 K 8.45 3.83 0.00 1.99 2.03 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.48 1.50 7.81 26 A 8.03 4.10 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 27 Y 8.20 4.27 0.00 2.97 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 28 K 8.34 3.77 0.00 1.90 2.05 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.48 7.81 29 D 8.18 4.38 0.00 2.94 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 30 Y 8.48 4.16 0.00 3.15 3.14 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 0.00 0.00 0.00 31 L 8.31 3.55 0.00 1.66 1.52 0.68 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.77 4.18 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 33 S 7.97 4.64 0.00 3.74 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 34 G 7.70 3.75 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 0.00 0.00 0.00 35 G 7.23 2.47 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 Q 8.22 4.14 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.96 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 37 P 0.00 4.68 0.00 2.23 2.07 0.00 3.76 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 2.04 2.11 0.00 38 I 8.46 4.05 1.81 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.64 0.83 0.00 0.00 39 T 8.55 4.54 4.28 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 1.31 0.00 0.00 40 N 8.69 4.33 0.00 2.94 3.07 0.00 0.00 6.76 7.66 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 41 C 7.99 4.67 0.00 3.11 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 42 V 8.07 3.82 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 0.80 0.00 0.00 1.04 0.00 0.00 43 K 8.60 4.49 0.00 1.63 1.54 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.94 0.41 7.81 44 M 8.93 4.39 0.00 1.82 1.90 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.81 0.00 45 L 8.38 4.26 0.00 1.54 1.57 0.90 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 46 C 7.96 4.80 0.00 2.92 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 47 T 8.28 3.92 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 1.16 0.00 0.00 48 H 8.14 4.15 0.00 3.34 3.37 0.00 5.70 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 T 7.81 4.64 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 1.30 0.00 0.00 50 G 8.48 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 51 T 8.98 3.82 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 1.28 0.00 0.00 52 G 8.34 4.50 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 0.00 0.00 0.00 53 Q 7.49 4.06 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.48 2.30 0.00 54 A 7.98 3.52 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.23 5.02 1.77 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 1.38 0.39 0.97 0.00 0.00 56 T 8.96 4.84 4.31 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 1.21 0.00 0.00 57 V 8.65 4.06 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 0.77 0.00 0.00 0.97 0.00 0.00 58 T 7.60 4.36 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 1.23 0.00 0.00 59 P 0.00 4.16 0.00 1.79 1.86 0.00 3.10 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.07 0.00 60 E 9.28 4.60 0.00 1.95 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 2.45 2.35 0.00 61 A 7.62 4.53 1.24 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 62 N 8.44 5.12 0.00 2.96 3.13 0.00 0.00 6.10 7.66 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 63 M 8.68 4.22 0.00 2.04 2.20 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.66 0.00 64 D 9.95 4.92 0.00 2.68 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 65 Q 8.36 5.21 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.71 6.65 0.00 0.00 0.00 0.00 0.00 2.35 2.60 0.00 66 E 8.92 5.05 0.00 2.03 1.48 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 2.28 2.50 0.00 67 S 8.18 5.21 0.00 3.62 3.75 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 68 F 9.40 5.27 0.00 3.04 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 69 G 9.11 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 70 G 9.43 3.92 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 0.00 0.00 0.00 71 A 8.07 3.72 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 72 S 7.99 4.33 0.00 4.11 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 73 C 8.80 4.45 0.00 3.07 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 74 C 7.80 4.61 0.00 3.09 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 75 L 8.43 3.53 0.00 1.36 0.94 0.33 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 7.36 3.85 0.00 3.00 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 77 C 8.09 4.44 0.00 3.20 3.18 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 78 R 7.83 3.81 0.00 1.83 1.82 0.00 3.23 0.00 0.00 3.16 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 79 C 7.82 4.19 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 80 H 7.96 4.05 0.00 3.29 3.36 0.00 5.59 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.35 4.50 1.77 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.69 0.76 0.00 0.00 82 D 8.20 4.45 0.00 2.59 2.55 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 83 H 7.89 4.13 0.00 2.37 2.54 0.00 5.88 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 P 0.00 4.54 0.00 2.05 1.99 0.00 2.45 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 85 N 8.17 4.13 0.00 2.70 2.55 0.00 0.00 6.86 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 *89 F 8.91 3.87 0.00 2.99 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 90 C 8.03 4.20 0.00 3.06 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 D 7.94 4.54 0.00 2.83 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 92 L 8.36 4.37 0.00 1.74 1.77 1.02 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 93 K 7.91 3.86 0.00 1.75 1.95 0.00 1.88 0.00 0.00 1.79 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.49 7.81 94 G 9.06 3.88 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 0.00 0.00 0.00 95 K 8.23 4.52 0.00 1.74 1.93 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.34 7.81 96 Y 8.86 5.13 0.00 2.95 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 97 V 9.00 4.85 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 1.51 0.00 0.00 1.07 0.00 0.00 98 Q 9.14 5.62 0.00 2.24 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.35 0.00 0.00 0.00 0.00 0.00 2.61 2.29 0.00 99 I 8.39 4.23 1.82 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 1.15 0.86 0.01 0.00 0.00 100 P 0.00 4.39 0.00 1.72 2.05 0.00 2.20 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 2.12 0.00 101 T 8.98 3.77 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 1.26 0.00 0.00 102 T 7.89 4.11 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 1.24 0.00 0.00 103 C 8.82 4.66 0.00 2.52 2.74 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 0.00 104 A 7.87 3.99 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.83 4.62 0.00 2.83 2.96 0.00 0.00 5.82 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 0.00 106 D 8.25 4.77 0.00 2.63 2.54 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 0.00 107 P 0.00 4.00 0.00 1.73 1.15 0.00 3.47 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.47 0.00 108 V 7.12 4.11 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 0.96 0.00 0.00 0.78 0.00 0.00 109 G 9.45 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 0.00 110 F 8.27 3.83 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 0.00 111 T 7.37 3.77 4.48 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 1.53 0.00 0.00 112 L 7.33 4.16 0.00 1.91 1.81 0.92 0.91 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 0.00 113 R 7.84 4.04 0.00 1.80 1.79 0.00 3.09 0.00 0.00 3.19 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 114 N 7.58 4.69 0.00 1.44 2.44 0.00 0.00 6.81 7.40 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 0.00 115 T 8.12 4.88 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 1.28 0.00 0.00 116 V 8.55 4.10 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 0.50 0.00 0.00 0.34 0.00 0.00 117 C 8.83 4.44 0.00 3.12 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 0.00 118 T 8.72 3.86 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 1.21 0.00 0.00 119 V 7.87 3.75 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 0.84 0.00 0.00 0.94 0.00 0.00 120 C 8.05 4.31 0.00 3.12 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 0.00 121 G 8.47 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 0.00 0.00 0.00 122 M 7.39 4.69 0.00 2.18 2.03 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.54 0.00 123 W 8.61 4.96 0.00 3.68 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 0.00 124 K 9.55 4.14 0.00 2.06 1.87 0.00 1.84 0.00 0.00 1.78 0.00 0.00 3.14 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.52 7.81 125 G 10.21 3.85 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 0.00 0.00 0.00 126 Y 8.21 4.84 0.00 3.22 3.05 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 0.00 127 G 8.38 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 0.00 128 C 8.20 4.21 0.00 3.15 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 0.00 129 S 8.74 4.03 0.00 3.98 3.75 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 * Residues marked with a * may have inaccurate shift predictions.