NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 A 4.6108 8.2116 122.9245 52.6882 19.8527 174.9311 5 E 4.2799 7.6473 117.1905 54.0614 33.0618 176.6167 6 F 4.5912 7.8064 122.1984 57.1352 45.7728 172.8074 7 D 4.2769 9.4979 130.0628 54.9028 37.7543 176.7095 8 A 4.9811 9.5372 130.6777 51.8262 20.1261 178.4947 9 D 3.7141 7.1430 111.2227 57.9783 41.1694 177.8426 10 V 3.9477 6.4806 126.7334 61.6799 32.1729 174.8905 11 I 4.1435 8.0579 128.6742 60.2152 34.7443 174.9120 12 V 4.7175 8.9908 125.7085 60.9575 35.2309 173.5276 13 D 5.2695 8.5799 122.9541 51.7533 42.3606 175.1811 14 A 4.7765 8.9557 121.2326 53.9042 22.1038 177.5579 15 R 4.2090 8.9724 113.0969 59.0998 29.5024 177.2646 16 D 3.7704 9.4221 121.5123 55.9512 41.1617 173.5340 17 C 3.7608 8.2626 114.3828 57.8917 30.9349 173.0284 18 I 4.1864 8.0680 118.6442 59.5329 38.4068 174.4894 19 M 4.0682 8.0359 130.9628 55.6513 29.1666 174.9467 20 G 4.1796 8.1167 113.1154 44.7413 0.0000 172.2459 21 R 4.4703 8.5228 125.1351 57.2971 30.7447 178.4413 22 V 3.4633 7.4627 118.4162 66.0604 31.5218 177.3305 23 A 3.8792 8.1007 120.1263 55.3613 18.1442 179.8713 24 S 3.9211 8.3301 112.1920 61.4499 63.1908 176.9962 25 Q 3.8746 8.8615 122.7393 59.1508 28.3118 179.4733 26 V 3.3569 7.6327 118.0457 65.5298 32.2818 177.0675 27 A 3.8235 9.0208 121.2882 53.5461 17.7320 180.1219 28 E 3.6927 7.5558 116.8823 57.9212 30.2645 179.7107 29 Q 3.8869 8.4997 118.3452 59.5006 28.8880 177.8128 30 A 3.9586 8.1184 121.9265 55.7688 18.0730 179.4180 31 L 3.4571 7.9591 113.0456 57.6372 42.0483 179.6243 32 D 4.5933 8.1211 122.9572 58.4056 42.2808 176.7912 33 G 3.1302 6.7838 105.7348 45.5857 0.0000 174.8413 34 E 4.4713 8.5351 119.7261 53.9562 32.2928 176.1518 35 T 4.3503 8.4738 115.4553 61.9786 69.8263 173.2106 36 V 4.8679 8.6251 126.0713 60.7897 34.5950 173.9696 37 A 5.1811 9.0114 128.6529 50.2835 21.7486 175.1405 38 V 5.6898 8.8420 121.2926 61.4644 35.8341 173.9443 39 V 5.0715 9.0202 117.6934 59.9833 36.1755 174.3329 40 N 3.8492 10.0925 122.5285 53.3139 39.3143 180.0852 41 A 3.1781 9.1565 116.8821 52.7598 19.6480 179.4079 42 E 4.2130 8.3446 123.3682 61.3978 31.7915 179.6784 43 R 4.1523 8.3802 119.5033 56.5868 31.0000 177.1461 44 A 4.5620 7.9417 121.3121 52.7976 20.3879 175.7810 45 V 5.0044 7.2456 110.9231 63.3118 36.0726 174.4483 46 I 4.0996 10.8724 118.9545 61.8404 41.5167 175.6369 47 T 3.3735 7.9690 114.7058 59.5722 69.7896 174.5451 48 G 3.8903 8.3673 113.4463 46.6931 0.0000 172.2273 49 R 3.8442 7.9471 112.5559 61.0762 27.6357 179.3895 50 E 3.7995 7.7241 118.8600 59.3332 29.9733 178.0129 51 E 3.8174 8.7585 115.8136 60.0205 29.1746 178.6573 52 Q 4.6658 8.5646 123.4436 59.0068 29.4100 178.7115 53 I 3.6312 7.8700 119.5689 64.1017 37.9161 177.5855 54 V 3.6505 8.2647 119.1857 67.0831 31.3308 177.3302 55 E 3.4889 8.8314 112.6827 59.3725 29.2462 179.8226 56 K 4.1436 7.8523 120.6677 60.4244 32.8721 178.2613 57 Y 3.7981 8.5124 116.8596 61.1330 37.7926 178.6190 58 E 4.0065 8.8322 119.7839 58.7785 29.4376 179.2545 59 K 3.7990 8.1328 119.4251 59.8449 31.9272 178.5436 60 R 3.7728 7.7525 116.1888 60.1992 30.1164 178.9663 61 V 3.3807 7.6255 116.7697 65.3054 32.2540 176.5058 62 D 4.6593 8.0609 118.8344 53.2314 40.2350 176.4486 63 I 3.6000 6.7884 123.0162 61.2689 35.4694 173.5178 64 G 4.1586 7.8759 108.4976 43.4901 0.0000 169.4353 65 N 4.9789 8.7278 122.7294 50.6211 41.0660 173.7619 66 D 4.0323 8.1895 115.2250 57.9198 41.4479 179.3018 67 N 4.3062 7.5015 123.3729 55.6268 41.2130 174.5380 68 G 3.6725 8.7459 108.3769 46.3131 0.0000 174.0138 69 Y 3.3028 7.7299 115.2743 57.5174 33.9849 169.2095 70 F 4.2036 7.2908 115.3145 58.3571 38.8848 175.9755 71 Y 3.6348 9.2717 131.8233 57.8357 35.0571 166.7251 72 P 4.2465 0.0000 0.0000 62.8929 31.5091 176.6319 73 K 4.5016 8.6768 117.3613 56.4307 33.4485 175.9980 74 R 5.1105 7.7464 119.7055 52.3535 34.1048 174.6099 75 P 4.1269 0.0000 0.0000 67.6050 30.7630 178.5363 76 D 3.9890 7.4889 117.1151 56.4972 40.8292 179.1512 77 G 3.6569 8.3142 105.5751 48.6148 0.0000 175.9470 78 I 3.9573 7.9443 122.5814 63.5766 37.1324 177.9076 79 F 4.3107 9.1706 118.8486 61.4149 38.7728 178.0210 80 K 4.1808 8.4797 116.9610 60.0285 31.8670 178.4072 81 R 3.9428 8.9482 118.3240 60.1100 30.0787 179.1230 82 T 3.8008 8.5921 108.0916 65.2646 68.6541 175.5001 83 I 3.5682 8.2891 116.3748 63.5751 37.4408 177.9581 84 R 3.9893 8.4252 120.8791 58.7942 29.8684 178.9441 85 G 4.3598 8.2322 105.7375 47.3740 0.0000 174.7645 86 M 4.3098 8.8332 119.8627 58.3269 32.8329 177.1147 87 L 4.4770 8.4545 120.7077 53.4758 43.5783 173.6677 88 P 4.8651 0.0000 0.0000 62.0490 33.9888 174.6999 *90 K 3.6500 8.6558 122.8563 56.0106 33.9170 176.0649 91 K 4.0198 7.9299 117.6571 56.9572 33.6563 175.9300 92 Q 3.4926 8.8092 115.9403 59.5095 28.8055 179.0845 93 R 4.0028 8.0724 117.8186 60.0484 30.7365 178.1679 94 G 4.5440 8.4755 105.2305 48.4663 0.0000 175.1718 95 R 3.3206 8.5077 118.6629 58.8396 30.4888 178.0115 96 E 4.9461 9.2989 119.3406 59.2458 29.9014 179.2714 97 A 3.9939 8.4005 120.7470 55.6624 18.3472 179.3520 98 F 3.9715 8.7778 115.6300 61.0008 39.0323 177.8227 99 E 4.0134 8.5705 118.0658 59.8414 29.4128 179.7878 100 S 4.4722 8.4856 114.7757 59.4957 62.5520 173.7890 101 V 4.4063 6.9529 121.8036 61.6059 32.1537 175.7035 102 R 4.5793 9.0572 127.2038 54.6362 34.0964 174.6199 103 V 5.4167 7.7285 122.2489 60.6023 35.3501 173.5448 104 Y 4.3677 8.3944 119.6772 58.4280 42.5344 177.7361 105 L 2.9383 7.8211 114.2438 55.5042 41.9514 176.6714 106 G 3.9107 8.3488 103.3447 45.1503 0.0000 173.2284 107 N 4.8015 7.8297 125.9877 51.0198 41.3221 172.6362 108 P 4.5846 0.0000 0.0000 62.2632 32.8377 174.4155 109 Y 4.6544 7.3372 116.1020 56.6262 42.3976 172.4992 110 D 4.6766 8.8051 125.9664 54.7157 41.6534 179.0118 *131 T 4.1860 7.3186 110.1737 61.4836 70.0475 174.6297 132 L 5.0235 8.4226 135.0000 54.3288 43.0500 177.2329 133 G 4.1191 7.9593 105.4109 45.8004 0.0000 174.4884 134 E 3.8813 8.4834 120.1762 59.4903 29.5967 178.9014 135 I 4.4400 7.5634 120.3099 63.4731 37.4886 178.1496 136 S 4.1784 8.0305 113.5533 61.8208 62.2558 174.9256 137 E 3.9415 8.4815 122.0106 59.4537 29.1644 178.9174 138 T 3.8823 8.4739 109.6786 64.6737 68.8605 175.0948 139 L 4.6297 8.3336 121.1903 54.3825 41.0412 177.1459 140 G 5.0572 7.8581 120.1412 46.1746 0.0000 172.8027 141 A 4.4890 8.0023 128.6567 51.7211 18.2943 178.2039 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 4 A 8.21 4.61 1.13 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 5 E 7.65 4.28 0.00 2.15 1.82 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 2.28 2.38 0.00 6 F 7.81 4.59 0.00 2.66 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 7 D 9.50 4.28 0.00 2.80 2.53 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 8 A 9.54 4.98 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 9 D 7.14 3.71 0.00 2.87 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 10 V 6.48 3.95 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.99 0.00 0.00 11 I 8.06 4.14 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.93 0.95 0.00 0.00 12 V 8.99 4.72 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 1.01 0.00 0.00 0.99 0.00 0.00 13 D 8.58 5.27 0.00 3.01 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 14 A 8.96 4.78 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 R 8.97 4.21 0.00 1.95 2.31 0.00 3.31 0.00 0.00 3.36 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 16 D 9.42 3.77 0.00 2.69 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 17 C 8.26 3.76 0.00 2.83 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 18 I 8.07 4.19 1.83 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.35 0.87 0.00 0.00 19 M 8.04 4.07 0.00 1.90 2.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 1.99 0.00 20 G 8.12 4.18 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 0.00 21 R 8.52 4.47 0.00 1.87 1.96 0.00 3.43 0.00 0.00 3.19 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.58 0.00 22 V 7.46 3.46 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 0.98 0.00 0.00 0.92 0.00 0.00 23 A 8.10 3.88 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 24 S 8.33 3.92 0.00 4.02 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 0.00 25 Q 8.86 3.87 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.53 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 26 V 7.63 3.36 2.26 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 0.72 0.00 0.00 0.88 0.00 0.00 27 A 9.02 3.82 1.17 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 0.00 0.00 28 E 7.56 3.69 0.00 1.96 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 2.53 2.53 0.00 29 Q 8.50 3.89 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.64 0.00 0.00 0.00 0.00 0.00 2.35 2.49 0.00 30 A 8.12 3.96 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 31 L 7.96 3.46 0.00 1.79 1.61 0.90 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.12 4.59 0.00 2.76 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 33 G 6.78 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 0.00 0.00 0.00 34 E 8.54 4.47 0.00 2.12 1.82 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 2.20 2.19 0.00 35 T 8.47 4.35 4.18 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 1.19 0.00 0.00 36 V 8.63 4.87 2.04 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 1.04 0.00 0.00 0.98 0.00 0.00 37 A 9.01 5.18 1.03 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 38 V 8.84 5.69 2.12 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 1.13 0.00 0.00 0.93 0.00 0.00 39 V 9.02 5.07 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.10 0.00 0.00 40 N 10.09 3.85 0.00 3.06 3.15 0.00 0.00 7.49 6.69 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 41 A 9.16 3.18 1.08 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 0.00 0.00 42 E 8.34 4.21 0.00 2.17 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 0.00 2.56 2.28 0.00 43 R 8.38 4.15 0.00 1.91 1.98 0.00 3.11 0.00 0.00 3.18 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 44 A 7.94 4.56 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 45 V 7.25 5.00 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 1.05 0.00 0.00 0.97 0.00 0.00 46 I 10.87 4.10 1.74 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.28 0.79 0.00 0.00 47 T 7.97 3.37 4.23 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 1.20 0.00 0.00 48 G 8.37 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 49 R 7.95 3.84 0.00 2.05 2.02 0.00 3.16 0.00 0.00 3.34 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 50 E 7.72 3.80 0.00 2.03 2.25 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 2.40 2.46 0.00 51 E 8.76 3.82 0.00 2.01 1.83 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 2.42 2.44 0.00 52 Q 8.56 4.67 0.00 2.10 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.88 0.00 0.00 0.00 0.00 0.00 2.69 2.32 0.00 53 I 7.87 3.63 1.97 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.15 1.00 0.00 0.00 54 V 8.26 3.65 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 1.15 0.00 0.00 1.03 0.00 0.00 55 E 8.83 3.49 0.00 2.45 1.84 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 2.36 2.59 0.00 56 K 7.85 4.14 0.00 2.03 2.00 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.18 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.97 1.77 7.81 57 Y 8.51 3.80 0.00 3.12 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 58 E 8.83 4.01 0.00 2.01 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 2.35 2.40 0.00 59 K 8.13 3.80 0.00 1.94 1.83 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.52 7.81 60 R 7.75 3.77 0.00 1.97 2.33 0.00 3.75 0.00 0.00 3.32 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.39 0.00 61 V 7.63 3.38 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 0.78 0.00 0.00 0.99 0.00 0.00 62 D 8.06 4.66 0.00 2.77 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 6.79 3.60 0.56 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.35 0.88 0.00 0.00 64 G 7.88 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 65 N 8.73 4.98 0.00 2.69 2.64 0.00 0.00 7.04 8.31 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 66 D 8.19 4.03 0.00 2.77 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 67 N 7.50 4.31 0.00 2.73 2.93 0.00 0.00 6.92 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 68 G 8.75 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 69 Y 7.73 3.30 0.00 3.42 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 F 7.29 4.20 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 71 Y 9.27 3.63 0.00 3.03 3.28 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 72 P 0.00 4.25 0.00 2.19 2.10 0.00 3.72 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 2.05 2.05 0.00 73 K 8.68 4.50 0.00 1.85 1.93 0.00 1.66 0.00 0.00 1.86 0.00 0.00 3.01 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.71 1.67 7.81 74 R 7.75 5.11 0.00 1.89 1.98 0.00 3.68 0.00 0.00 3.35 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.72 0.00 75 P 0.00 4.13 0.00 1.69 2.16 0.00 3.66 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.95 0.00 76 D 7.49 3.99 0.00 2.65 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 77 G 8.31 3.66 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 0.00 0.00 0.00 78 I 7.94 3.96 2.34 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.86 1.33 0.00 0.00 79 F 9.17 4.31 0.00 3.15 3.07 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 80 K 8.48 4.18 0.00 1.90 1.85 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.88 1.68 7.81 81 R 8.95 3.94 0.00 2.07 1.96 0.00 3.14 0.00 0.00 3.16 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 82 T 8.59 3.80 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 1.45 0.00 0.00 83 I 8.29 3.57 1.70 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 1.77 0.91 0.85 0.00 0.00 84 R 8.43 3.99 0.00 2.08 2.77 0.00 3.35 0.00 0.00 3.94 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.06 0.00 85 G 8.23 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 0.00 0.00 0.00 0.00 86 M 8.83 4.31 0.00 1.82 2.13 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.69 0.00 87 L 8.45 4.48 0.00 2.15 1.84 -0.11 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 88 P 0.00 4.87 0.00 2.19 2.14 0.00 4.06 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 2.13 1.99 0.00 *90 K 8.66 3.65 0.00 1.69 1.87 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.74 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.15 1.29 7.81 91 K 7.93 4.02 0.00 1.84 1.77 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.51 7.81 92 Q 8.81 3.49 0.00 2.12 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.72 0.00 0.00 0.00 0.00 0.00 2.45 2.56 0.00 93 R 8.07 4.00 0.00 1.92 2.02 0.00 3.22 0.00 0.00 3.35 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.77 0.00 94 G 8.48 4.54 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 95 R 8.51 3.32 0.00 2.00 1.84 0.00 3.14 0.00 0.00 3.10 8.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.83 0.00 96 E 9.30 4.95 0.00 2.03 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 2.47 2.43 0.00 97 A 8.40 3.99 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 98 F 8.78 3.97 0.00 3.16 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 99 E 8.57 4.01 0.00 2.11 2.04 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 2.37 2.74 0.00 100 S 8.49 4.47 0.00 3.97 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 0.00 101 V 6.95 4.41 1.98 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 0.70 0.00 0.00 0.84 0.00 0.00 102 R 9.06 4.58 0.00 1.69 1.97 0.00 2.99 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 103 V 7.73 5.42 1.90 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 0.96 0.00 0.00 0.97 0.00 0.00 104 Y 8.39 4.37 0.00 3.17 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 0.00 105 L 7.82 2.94 0.00 1.81 1.55 0.96 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 106 G 8.35 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 0.00 107 N 7.83 4.80 0.00 2.66 2.74 0.00 0.00 6.67 8.02 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 0.00 108 P 0.00 4.58 0.00 1.94 2.06 0.00 3.93 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 2.47 2.19 0.00 109 Y 7.34 4.65 0.00 3.25 3.03 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 0.00 110 D 8.81 4.68 0.00 2.72 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 *131 T 7.32 4.19 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 1.20 0.00 0.00 132 L 8.42 5.02 0.00 1.75 2.05 0.92 0.92 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 0.00 133 G 7.96 4.12 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 0.00 0.00 0.00 134 E 8.48 3.88 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 2.39 2.42 0.00 135 I 7.56 4.44 1.87 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.27 1.10 0.00 0.00 136 S 8.03 4.18 0.00 3.93 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 0.00 137 E 8.48 3.94 0.00 2.21 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 2.33 2.35 0.00 138 T 8.47 3.88 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 1.30 0.00 0.00 139 L 8.33 4.63 0.00 1.83 1.86 1.07 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 140 G 7.86 5.06 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 0.00 141 A 8.00 4.49 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 * Residues marked with a * may have inaccurate shift predictions.