NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.3309 8.0327 117.3761 63.7064 71.1053 175.4534 3 Q 3.7425 8.0788 121.7276 59.3417 28.8828 176.8851 4 H 4.3902 8.2023 116.9002 58.2569 29.2592 177.0400 5 L 3.9447 7.7481 122.0690 58.3700 42.1284 178.6829 6 T 4.0099 8.1764 116.0792 66.8393 68.3064 176.5810 7 I 3.6507 7.6638 120.8965 64.2534 37.0523 178.3313 8 A 3.0063 7.7109 121.3003 54.9702 18.1045 179.7411 9 Q 3.9090 8.4453 116.8464 59.4323 28.5657 179.1566 10 T 3.9173 8.2020 116.0202 66.6150 68.5608 175.8463 11 Y 4.3806 8.3022 121.6587 61.0013 38.9722 178.2737 12 L 4.0945 8.4911 119.8450 57.5891 41.4949 179.2849 13 A 4.0503 8.3269 120.8259 55.1452 18.0463 179.5692 14 A 3.8637 7.5868 118.2086 55.1770 18.5633 179.7641 15 W 3.8380 7.9292 115.6030 58.9638 29.2292 177.3652 16 N 4.9972 8.0862 114.1049 52.0619 38.6249 174.7178 17 E 4.0782 7.3550 123.1488 55.7668 30.1587 176.1343 18 E 4.0350 8.9048 127.7652 58.8672 30.4408 176.8665 19 D 4.6425 8.6813 119.0539 53.2985 42.8677 176.7071 20 N 4.2815 8.6503 124.3835 56.3508 38.7197 177.3554 21 E 3.8806 8.1035 119.4199 59.6075 29.6618 179.3854 22 R 3.9455 8.0941 117.8923 59.3200 29.9794 179.1411 23 R 3.7796 7.8610 118.0767 59.2324 29.9578 178.7421 24 R 3.7439 7.8350 117.9525 59.4285 30.0625 178.2990 25 H 4.0681 7.9759 117.4246 59.3363 29.7271 177.2708 26 L 3.8692 7.9440 120.6222 57.7950 41.4648 179.6693 27 V 3.6868 7.9916 118.6491 65.7970 31.1511 177.9400 28 G 3.8046 8.4115 104.8347 48.1580 0.0000 175.3689 29 Q 4.1188 7.7270 118.8813 58.7011 29.1975 178.2853 30 A 4.1580 8.4351 121.9098 53.5674 18.6717 177.6370 31 W 4.7498 8.2975 116.1336 55.5927 30.4040 176.3098 32 A 4.4432 8.5493 124.9343 51.5727 18.6386 178.1287 33 E 4.0901 8.8383 119.1366 59.4895 29.6497 177.1847 34 N 4.8106 7.8675 117.9891 52.1373 37.5741 173.7784 35 T 5.3194 7.8210 116.1398 59.1884 72.0341 171.8544 36 R 5.2644 8.5066 124.2361 55.1295 34.1003 172.8529 37 Y 5.4168 9.2215 126.3458 56.0307 42.6990 174.4208 38 V 4.9308 7.7837 124.5094 60.7804 35.2347 172.9272 39 D 5.2240 8.2474 122.8724 50.1020 42.2714 173.3093 40 P 4.3692 0.0000 0.0000 64.7035 31.3818 177.1401 41 L 4.5391 8.5779 116.7679 54.6911 42.7355 175.9940 *43 Q 4.6151 7.7682 116.3487 56.5997 29.9073 174.3633 44 G 4.3536 8.8050 105.5429 45.8549 0.0000 171.9816 45 E 5.1461 8.6220 117.6251 55.8616 32.7737 176.2372 46 G 4.1568 9.0644 106.4559 45.9131 0.0000 174.5617 47 Q 3.8662 8.6436 118.4764 59.0096 28.6450 179.0616 48 Q 3.9703 8.0987 118.4537 59.0751 28.5826 178.9840 49 G 3.6726 7.9481 104.9049 48.1495 0.0000 175.1108 50 I 3.5606 7.4331 120.7396 63.6852 37.3233 177.9462 51 A 3.7239 7.6884 121.4242 54.8804 18.0281 180.3328 52 A 3.6608 7.8408 116.3633 52.9415 18.1954 179.3528 *54 I 3.1056 7.7095 123.2292 62.5041 39.2799 177.8760 55 E 3.7931 7.8625 120.2013 59.1401 29.2222 178.7110 56 A 3.9689 8.2342 120.9122 54.9864 18.2090 179.3240 57 A 4.1087 7.9119 117.6531 55.7328 18.8715 179.7203 58 R 4.2649 8.2451 116.4220 59.5153 29.8834 179.3560 59 Q 4.1148 8.0952 117.2070 58.6664 28.7367 178.4114 60 K 4.2178 7.8283 118.2720 57.4056 33.8268 177.1230 61 F 4.7851 7.9795 117.1054 55.0738 39.2041 172.7829 62 P 4.5750 0.0000 0.0000 63.9606 32.2411 177.9172 63 G 3.9890 9.0001 109.6653 45.7132 0.0000 173.2994 64 Y 4.3817 7.6426 116.2535 58.1240 38.7205 175.2825 65 R 4.6666 8.7141 119.3455 54.4998 35.2590 174.5042 66 F 5.1496 9.1544 119.3826 56.0700 41.0808 174.9935 67 V 4.5607 8.8984 124.8616 60.4866 33.8719 174.8287 68 L 4.7945 8.8546 129.3546 55.4372 42.7946 175.7035 69 A 4.6440 8.9339 127.3773 51.2461 21.6274 177.8837 70 G 3.8308 8.7376 111.3845 45.1567 0.0000 171.9333 71 T 4.5228 8.2125 115.5154 60.8904 69.8036 173.0441 72 P 4.6943 0.0000 0.0000 63.1591 32.2063 175.2821 73 D 4.6627 9.2213 119.0103 52.9352 42.4438 173.8838 74 G 3.4663 7.6582 104.5976 47.6511 0.0000 170.9492 75 H 4.6864 8.4034 111.9527 55.8119 32.2450 174.9717 76 G 4.2434 8.5621 110.4503 47.5004 0.0000 173.7403 77 N 4.6451 8.5242 121.9346 52.4817 37.6616 173.7304 78 F 5.4148 8.3780 118.8408 56.6591 41.2935 174.9259 79 T 5.2030 8.8851 119.2232 61.7446 72.2607 172.9379 80 R 5.2809 9.3477 125.4382 53.5998 33.5180 173.9845 81 F 5.2766 7.8398 118.6145 56.2490 41.4254 172.7000 82 S 5.2880 8.8761 114.6894 56.6825 67.0756 173.0201 83 W 5.8435 8.2776 117.7332 55.3832 32.0433 173.7606 84 R 5.0652 9.6834 119.7404 54.4529 33.2703 174.8575 85 L 5.0057 9.3218 125.2158 54.1437 43.7010 175.0433 86 I 4.9954 8.4788 128.2146 59.4237 39.3102 176.0373 87 S 3.6231 9.1823 121.9779 56.9906 63.0463 172.8946 88 P 4.0875 0.0000 0.0000 65.7767 31.0040 177.3525 89 D 4.4062 7.7954 114.0915 53.9860 39.5971 176.8812 90 G 3.9516 8.2795 109.2865 45.3179 0.0000 173.6954 91 D 4.4208 8.2308 120.3197 53.8460 41.4565 175.3336 92 D 5.0996 8.5429 122.6872 53.6825 40.8949 176.1145 93 V 4.0895 8.1817 120.5878 62.1255 32.9689 175.7091 94 A 4.2773 7.3454 118.6727 53.0981 24.6134 174.5517 95 G 3.5841 7.6392 102.4799 46.1583 0.0000 172.2480 96 G 3.9061 6.1208 106.0929 44.9765 0.0000 171.8002 97 T 5.0955 8.5954 114.8599 61.8540 73.0323 173.4658 98 D 5.2081 8.6269 124.2046 52.3669 45.7317 174.6579 99 V 4.6589 8.3396 120.8416 61.2038 34.1431 174.4010 100 V 4.9520 8.8333 128.0841 61.2183 34.3984 174.2846 101 S 5.1129 8.9478 122.6485 56.7009 65.9929 172.9861 102 L 4.9865 8.1762 124.1912 53.1025 43.6349 176.5443 103 N 4.7136 8.7749 121.0506 51.8125 38.7398 175.8366 104 T 4.0660 8.3228 106.6420 63.2991 68.6369 174.4485 105 E 4.4613 8.2125 120.8192 56.2054 29.9154 176.8181 106 G 3.8882 8.0790 106.0235 45.7338 0.0000 174.2100 107 R 4.6287 7.8849 118.7416 53.8530 32.4203 175.5320 108 I 4.1651 8.5157 122.8680 61.8627 37.5133 176.1460 109 D 4.9754 9.0606 126.8157 53.4393 41.6855 175.6286 110 N 5.3053 7.6902 117.3505 52.7539 42.7340 173.0479 111 V 4.8689 9.0904 125.6588 61.1745 35.5949 173.9839 112 V 4.2966 8.7344 127.2730 61.1221 33.9164 174.4732 113 G 4.3718 8.3643 115.4973 44.6647 0.0000 171.8787 114 F 4.9826 9.0436 118.9921 55.5193 43.7158 173.8094 115 L 5.0712 8.5777 120.1324 53.5366 43.6171 175.7529 116 D 4.8870 8.8231 121.6665 51.4138 44.8684 175.6118 117 G 4.2041 8.6621 113.6815 45.4678 0.0000 173.7253 118 A 4.2259 8.6338 128.5972 51.9715 19.0583 177.1998 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 2 T 8.03 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 1.21 0.00 0.00 3 Q 8.08 3.74 0.00 2.10 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.89 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 4 H 8.20 4.39 0.00 3.25 3.36 0.00 5.67 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 L 7.75 3.94 0.00 1.77 1.81 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 6 T 8.18 4.01 4.36 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 1.20 0.00 0.00 7 I 7.66 3.65 1.88 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.79 0.90 0.00 0.00 8 A 7.71 3.01 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 Q 8.45 3.91 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 10 T 8.20 3.92 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 1.26 0.00 0.00 11 Y 8.30 4.38 0.00 3.07 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 12 L 8.49 4.09 0.00 1.79 1.81 1.07 1.13 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 13 A 8.33 4.05 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 14 A 7.59 3.86 1.21 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 0.00 0.00 0.00 15 W 7.93 3.84 0.00 3.02 2.66 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 16 N 8.09 5.00 0.00 2.87 2.95 0.00 0.00 6.95 7.18 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 17 E 7.35 4.08 0.00 1.99 1.95 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 2.28 2.41 0.00 18 E 8.90 4.04 0.00 1.98 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 2.30 2.25 0.00 19 D 8.68 4.64 0.00 2.79 2.59 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 20 N 8.65 4.28 0.00 2.72 2.83 0.00 0.00 7.16 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 21 E 8.10 3.88 0.00 2.20 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 2.36 2.31 0.00 22 R 8.09 3.95 0.00 1.99 1.98 0.00 3.26 0.00 0.00 3.08 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.80 0.00 23 R 7.86 3.78 0.00 1.97 1.90 0.00 2.76 0.00 0.00 2.96 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.57 0.00 24 R 7.83 3.74 0.00 1.99 1.89 0.00 3.13 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.74 0.00 25 H 7.98 4.07 0.00 3.22 3.49 0.00 5.78 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 26 L 7.94 3.87 0.00 1.81 1.71 0.91 0.70 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 27 V 7.99 3.69 1.78 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 0.60 0.00 0.00 0.14 0.00 0.00 28 G 8.41 3.80 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 0.00 0.00 0.00 29 Q 7.73 4.12 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.94 0.00 0.00 0.00 0.00 0.00 2.47 2.35 0.00 30 A 8.44 4.16 1.47 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 31 W 8.30 4.75 0.00 3.53 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 32 A 8.55 4.44 1.32 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 0.00 0.00 0.00 0.00 0.00 0.00 33 E 8.84 4.09 0.00 2.07 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 2.42 2.36 0.00 34 N 7.87 4.81 0.00 2.71 2.82 0.00 0.00 6.57 7.54 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 35 T 7.82 5.32 4.62 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 1.51 0.00 0.00 36 R 8.51 5.26 0.00 2.00 1.97 0.00 3.43 0.00 0.00 3.32 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.76 0.00 37 Y 9.22 5.42 0.00 3.26 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 38 V 7.78 4.93 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 0.51 0.00 0.00 0.89 0.00 0.00 39 D 8.25 5.22 0.00 2.54 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 40 P 0.00 4.37 0.00 2.08 2.15 0.00 3.63 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.07 0.00 41 L 8.58 4.54 0.00 1.74 1.75 0.99 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 *43 Q 7.77 4.62 0.00 2.27 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.79 0.00 0.00 0.00 0.00 0.00 2.28 2.44 0.00 44 G 8.80 4.35 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 0.00 45 E 8.62 5.15 0.00 2.18 1.93 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 2.19 2.34 0.00 46 G 9.06 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 47 Q 8.64 3.87 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.82 0.00 0.00 0.00 0.00 0.00 2.52 2.67 0.00 48 Q 8.10 3.97 0.00 2.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.41 2.35 0.00 49 G 7.95 3.67 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 0.00 0.00 0.00 50 I 7.43 3.56 1.50 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.58 0.03 0.00 0.00 51 A 7.69 3.72 1.16 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 52 A 7.84 3.66 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 *54 I 7.71 3.11 1.23 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.30 0.00 0.00 0.00 55 E 7.86 3.79 0.00 1.90 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 56 A 8.23 3.97 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 57 A 7.91 4.11 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 58 R 8.25 4.26 0.00 1.93 2.10 0.00 3.49 0.00 0.00 3.13 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.96 0.00 59 Q 8.10 4.11 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.01 0.00 0.00 0.00 0.00 0.00 2.41 2.63 0.00 60 K 7.83 4.22 0.00 2.08 1.81 0.00 1.79 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.72 7.81 61 F 7.98 4.79 0.00 3.06 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 62 P 0.00 4.58 0.00 2.24 2.12 0.00 3.87 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.01 0.00 63 G 9.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.64 4.38 0.00 2.99 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 65 R 8.71 4.67 0.00 1.64 1.73 0.00 3.05 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 66 F 9.15 5.15 0.00 2.74 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 67 V 8.90 4.56 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 0.86 0.00 0.00 1.00 0.00 0.00 68 L 8.85 4.79 0.00 1.78 1.65 1.01 0.99 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 A 8.93 4.64 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 70 G 8.74 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 71 T 8.21 4.52 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 72 P 0.00 4.69 0.00 2.11 2.13 0.00 3.69 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.17 0.00 73 D 9.22 4.66 0.00 2.74 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 74 G 7.66 3.47 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 75 H 8.40 4.69 0.00 3.40 3.41 0.00 5.61 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 G 8.56 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 77 N 8.52 4.65 0.00 2.78 2.87 0.00 0.00 5.87 8.12 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 78 F 8.38 5.41 0.00 2.93 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 79 T 8.89 5.20 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 1.50 0.00 0.00 80 R 9.35 5.28 0.00 1.74 1.88 0.00 3.07 0.00 0.00 3.22 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.39 0.00 81 F 7.84 5.28 0.00 3.23 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 82 S 8.88 5.29 0.00 3.74 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 83 W 8.28 5.84 0.00 3.73 3.41 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 84 R 9.68 5.07 0.00 1.81 1.93 0.00 3.21 0.00 0.00 3.07 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.80 0.00 85 L 9.32 5.01 0.00 2.21 1.86 0.63 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 86 I 8.48 5.00 1.86 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 1.17 0.84 0.92 0.00 0.00 87 S 9.18 3.62 0.00 3.75 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 88 P 0.00 4.09 0.00 1.93 2.01 0.00 3.19 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.81 0.00 89 D 7.80 4.41 0.00 2.74 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 90 G 8.28 3.95 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 0.00 0.00 0.00 91 D 8.23 4.42 0.00 2.89 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 92 D 8.54 5.10 0.00 2.66 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 93 V 8.18 4.09 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 0.96 0.00 0.00 1.23 0.00 0.00 94 A 7.35 4.28 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 95 G 7.64 3.58 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 0.00 0.00 0.00 96 G 6.12 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 97 T 8.60 5.10 4.15 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 1.13 0.00 0.00 98 D 8.63 5.21 0.00 1.58 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 0.00 0.00 0.00 99 V 8.34 4.66 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 0.97 0.00 0.00 0.90 0.00 0.00 100 V 8.83 4.95 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 0.86 0.00 0.00 0.86 0.00 0.00 101 S 8.95 5.11 0.00 3.95 3.39 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 0.00 102 L 8.18 4.99 0.00 1.40 1.48 0.82 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 103 N 8.77 4.71 0.00 2.90 3.11 0.00 0.00 6.68 7.98 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 0.00 104 T 8.32 4.07 4.22 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 1.18 0.00 0.00 105 E 8.21 4.46 0.00 2.03 1.95 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 2.20 2.25 0.00 106 G 8.08 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 0.00 107 R 7.88 4.63 0.00 1.87 1.88 0.00 3.14 0.00 0.00 3.17 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.55 0.00 108 I 8.52 4.17 0.74 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 0.97 0.30 0.55 0.00 0.00 109 D 9.06 4.98 0.00 2.89 2.87 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 0.00 110 N 7.69 5.31 0.00 2.87 2.69 0.00 0.00 6.58 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 0.00 111 V 9.09 4.87 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 0.87 0.00 0.00 1.16 0.00 0.00 112 V 8.73 4.30 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 0.55 0.00 0.00 0.87 0.00 0.00 113 G 8.36 4.37 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 0.00 114 F 9.04 4.98 0.00 2.86 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 0.00 115 L 8.58 5.07 0.00 1.53 1.55 0.95 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 116 D 8.82 4.89 0.00 2.29 2.37 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 0.00 117 G 8.66 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 0.00 0.00 0.00 118 A 8.63 4.23 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 * Residues marked with a * may have inaccurate shift predictions.