NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.0165 8.2601 123.5845 51.8735 19.8198 175.2436 *3 A 3.9572 8.3695 118.8640 51.9847 18.9701 177.5130 4 C 3.7912 8.7509 120.3016 58.3054 40.3885 174.3023 5 S 4.4745 8.1546 117.7236 57.7389 63.9209 173.5562 6 F 4.9442 6.6947 114.8904 54.2522 40.7642 172.4554 7 P 4.4731 0.0000 0.0000 61.3892 32.1017 174.4086 8 P 4.6671 0.0000 0.0000 62.3983 31.9232 176.1925 9 S 4.2626 8.7940 115.1932 58.4758 62.7063 174.4666 10 E 4.1975 8.6925 125.2781 57.9178 30.3378 176.8037 11 I 4.6864 7.8787 112.9210 59.0459 37.5274 175.1445 12 P 4.2003 0.0000 0.0000 66.2546 31.7976 178.7286 13 G 3.6941 7.9170 105.8471 46.5593 0.0000 173.6478 14 S 4.3710 7.9715 116.0325 57.5059 62.9882 175.1781 15 K 4.0910 8.5851 125.6372 58.9466 32.1093 178.1312 16 E 4.3951 8.3830 117.7842 56.3250 29.5622 176.9594 17 C 4.1743 7.8977 120.6194 59.8966 44.8531 175.6178 18 L 3.8823 7.8689 119.6825 57.6689 41.3800 179.0914 19 A 4.0212 7.9742 120.3287 55.1598 18.3699 179.1589 20 E 3.8647 8.6623 118.0711 59.2859 29.6988 178.9015 21 A 3.8993 8.1222 120.9790 54.8922 18.1172 179.3879 22 L 4.1243 8.0755 118.2338 58.3536 42.2742 178.6455 23 Q 4.0807 7.9967 118.4973 59.0694 29.1008 177.8864 24 K 4.2718 7.8202 117.7638 56.6168 32.6507 176.5580 25 H 4.8249 7.6053 116.5869 53.3575 31.0131 174.3856 26 Q 4.0652 8.9291 124.6906 59.0048 28.6514 179.1464 27 G 3.9097 8.1574 106.2610 47.8366 0.0000 175.3845 28 F 4.4697 7.9441 122.4525 60.8174 39.4602 177.3366 29 K 3.4104 7.8999 118.2773 59.0531 31.7215 179.1823 30 K 4.0180 8.3521 119.0001 59.8186 32.0870 179.6191 31 K 4.1310 8.0900 118.1756 59.3722 31.9208 179.8427 32 S 4.2164 8.2434 115.8098 61.9731 62.7942 176.3473 33 Y 4.4605 8.7354 119.5968 60.8535 37.5587 178.0008 34 A 3.4625 8.3462 122.0481 54.8871 18.3591 179.2804 35 L 3.7954 7.8905 118.7464 58.3384 42.0172 179.2604 36 I 3.9669 7.8668 119.5881 64.7561 36.9417 177.6463 37 C 4.2551 8.3865 117.0369 60.1377 39.8337 176.1771 38 A 3.9603 7.9988 121.0628 55.2352 18.2658 178.6722 39 Y 3.6954 8.5726 118.5012 60.7935 38.5509 178.4160 40 L 3.8439 8.0071 118.5933 56.8893 41.9262 178.2684 41 N 4.7734 7.3906 114.7943 53.0593 39.0109 175.8056 42 Y 3.8064 7.5478 124.5307 60.8479 38.5114 178.7015 43 K 4.0150 7.9249 116.7075 58.4070 32.3436 177.2606 44 E 4.3772 7.5921 116.2529 56.4275 30.2343 176.2717 45 D 4.3618 7.3567 117.5143 52.2620 42.5825 175.0755 46 A 3.5518 7.9113 127.9136 54.2119 18.5114 178.9041 47 E 4.1833 8.0226 118.3314 59.0191 29.5394 178.7367 48 N 4.2554 8.7217 117.4062 56.7908 38.9607 176.1838 49 Y 4.0476 7.6937 119.7528 60.8158 38.5032 177.9060 50 E 3.9477 8.5910 119.6823 59.4864 29.4985 179.6796 51 R 4.0600 8.2145 117.8217 59.3384 30.1129 178.9802 52 A 3.9081 8.2207 120.6068 55.0453 18.2504 179.6004 53 A 3.7574 8.0249 119.7384 55.2462 18.4163 179.7369 54 E 4.1346 8.2456 117.1473 59.6013 29.4496 179.3468 55 D 4.5032 8.3835 119.1909 57.3173 40.8480 178.5575 56 F 4.1826 8.5364 121.4089 61.4451 39.4202 176.7112 57 D 4.3798 8.6866 118.9296 57.6717 40.6932 179.2010 58 S 4.0772 8.1910 115.2338 61.5441 62.6289 176.5943 59 A 4.0719 8.0004 122.5135 55.0888 18.5174 179.5072 60 V 3.4904 8.0083 117.2819 66.0090 31.5490 178.3712 61 K 3.9274 7.9483 118.1987 59.7415 31.6509 178.6373 62 C 4.1827 7.7750 115.8918 60.0360 38.5186 176.0045 63 T 3.9311 7.7280 111.1935 62.6585 68.1267 176.4180 64 G 3.9742 7.7680 107.4225 45.3596 0.0000 173.0798 65 C 4.3801 7.8164 117.5425 56.9730 40.6898 174.3579 66 K 3.9595 8.7342 123.9380 58.9300 32.0278 177.9287 67 E 3.9920 8.1702 118.8625 56.2749 30.0425 175.9239 68 G 4.0446 8.4545 114.2115 44.2332 0.0000 173.8153 69 V 4.1676 8.0863 122.2416 60.5994 32.0342 173.5445 70 D 4.5907 8.4167 125.2097 53.0083 40.8609 176.2224 71 L 4.2348 8.5742 127.2736 55.6531 42.5189 176.9448 72 H 4.0371 8.5387 116.1402 56.5570 26.8038 176.3912 73 E 4.2816 8.4837 116.7740 58.5968 29.8995 177.5928 74 G 3.9423 8.1105 106.8593 45.2875 0.0000 173.1672 75 N 4.8527 8.2373 119.6434 50.4955 39.0839 172.5063 76 P 4.2292 0.0000 0.0000 65.4485 31.6605 178.7916 77 E 4.0490 8.0694 114.7928 58.1505 29.7896 177.3788 78 L 4.6248 8.0697 118.3395 54.3271 42.9799 178.1288 79 I 3.6931 7.5402 121.0445 64.4200 36.7988 178.0420 80 E 4.0627 8.0243 119.0053 59.4630 29.4736 179.0979 81 E 4.1002 8.2650 117.3540 59.3745 29.6773 179.2408 82 G 3.7862 8.4357 108.2257 47.1092 0.0000 175.5580 83 F 4.1250 8.6210 123.4184 60.9463 39.3202 177.1863 84 E 3.9043 8.6379 118.6907 59.0324 29.1059 179.2073 85 K 3.9132 8.2268 119.8797 59.2727 32.2948 178.4114 86 F 4.0969 8.1666 120.9509 61.5394 39.1250 177.1956 87 L 3.4312 7.7653 118.1543 57.4071 41.1523 179.4619 88 A 3.8909 8.0107 120.8017 55.3167 18.1357 179.9618 89 S 4.0838 8.1057 112.8601 61.1493 63.0278 175.9819 90 L 4.2970 7.5454 118.5575 53.4065 42.2499 176.4115 91 K 3.7316 7.2946 117.4110 57.4201 29.9276 175.5844 92 I 4.2132 7.5633 119.0472 59.4272 38.7051 175.8660 93 D 4.4227 8.4287 125.3189 53.7134 41.7109 176.9312 94 R 3.9145 8.6614 126.0405 59.3871 29.8218 178.6310 95 K 4.0369 8.6604 117.6484 58.5698 32.2592 178.0006 96 A 4.3752 8.0584 119.9412 52.1720 18.8420 178.8615 97 L 4.0598 7.6832 119.2797 57.7508 41.8075 179.5926 98 G 3.6685 8.0885 104.9410 47.9066 0.0000 175.3109 99 S 4.0806 7.9862 115.4777 61.0681 62.2529 176.0945 100 L 3.5018 7.6700 120.2641 57.5865 41.5344 178.3348 101 C 4.4728 8.2522 118.6995 59.9902 41.8856 175.7897 102 T 3.7582 8.0204 111.0982 64.6384 68.1870 175.7844 103 L 4.1310 7.7916 120.4818 56.2390 41.5123 178.5099 104 F 4.3253 8.1977 120.9893 61.5466 39.3411 176.2582 105 Q 3.9855 7.5606 118.0166 59.2057 28.8648 178.1168 106 K 4.1191 7.8444 119.1436 58.6218 32.8443 177.1328 107 L 4.2626 7.7100 118.7935 53.6593 42.4741 176.7709 *109 A 4.1009 7.5121 120.3955 51.8944 19.9341 176.7643 110 I 4.6775 7.9368 114.8130 58.0823 40.5797 173.6242 111 P 4.5588 0.0000 0.0000 63.0234 32.0574 176.3078 112 H 4.4362 8.1622 114.0334 56.1971 28.2323 173.3480 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 1 A 8.26 4.02 1.29 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 0.00 0.00 *3 A 8.37 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 4 C 8.75 3.79 0.00 2.78 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 5 S 8.15 4.47 0.00 3.98 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 6 F 6.69 4.94 0.00 2.66 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 7 P 0.00 4.47 0.00 2.22 2.09 0.00 3.79 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.99 0.00 8 P 0.00 4.67 0.00 2.17 2.05 0.00 3.74 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.91 0.00 9 S 8.79 4.26 0.00 3.78 3.78 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 10 E 8.69 4.20 0.00 2.00 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 0.00 2.31 2.30 0.00 11 I 7.88 4.69 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.77 0.90 0.00 0.00 12 P 0.00 4.20 0.00 2.22 2.38 0.00 3.76 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 2.06 1.95 0.00 13 G 7.92 3.69 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 0.00 0.00 0.00 14 S 7.97 4.37 0.00 3.86 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 15 K 8.59 4.09 0.00 1.78 1.86 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.46 7.81 16 E 8.38 4.40 0.00 1.98 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 2.27 2.29 0.00 17 C 7.90 4.17 0.00 3.24 3.09 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 18 L 7.87 3.88 0.00 1.80 1.90 1.12 0.68 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 19 A 7.97 4.02 1.36 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 20 E 8.66 3.86 0.00 2.16 2.05 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 2.28 2.45 0.00 21 A 8.12 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 L 8.08 4.12 0.00 1.97 2.00 0.79 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 23 Q 8.00 4.08 0.00 2.09 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.71 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 24 K 7.82 4.27 0.00 1.40 1.47 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.43 1.64 7.81 25 H 7.61 4.82 0.00 2.69 2.63 0.00 5.63 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.93 4.07 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 27 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 28 F 7.94 4.47 0.00 2.41 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 29 K 7.90 3.41 0.00 1.78 0.99 0.00 1.64 0.00 0.00 1.49 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.18 1.58 7.81 30 K 8.35 4.02 0.00 2.04 2.07 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.63 7.81 31 K 8.09 4.13 0.00 1.95 2.04 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.76 1.78 7.81 32 S 8.24 4.22 0.00 3.91 4.08 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 33 Y 8.74 4.46 0.00 3.14 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 34 A 8.35 3.46 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 35 L 7.89 3.80 0.00 1.68 1.53 0.53 -0.18 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 36 I 7.87 3.97 2.18 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.93 1.12 0.00 0.00 37 C 8.39 4.26 0.00 3.04 3.11 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 0.00 0.00 0.00 0.00 38 A 8.00 3.96 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Y 8.57 3.70 0.00 2.56 2.75 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 40 L 8.01 3.84 0.00 1.81 1.68 0.97 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 41 N 7.39 4.77 0.00 2.65 2.73 0.00 0.00 6.49 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 42 Y 7.55 3.81 0.00 2.66 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 43 K 7.92 4.01 0.00 1.70 1.80 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.42 7.81 44 E 7.59 4.38 0.00 1.88 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 0.00 2.18 2.14 0.00 45 D 7.36 4.36 0.00 2.59 2.41 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 46 A 7.91 3.55 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 47 E 8.02 4.18 0.00 2.00 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 2.39 2.19 0.00 48 N 8.72 4.26 0.00 3.00 2.97 0.00 0.00 6.87 8.37 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 49 Y 7.69 4.05 0.00 3.32 3.36 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 50 E 8.59 3.95 0.00 2.24 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 2.57 2.67 0.00 51 R 8.21 4.06 0.00 1.98 1.96 0.00 3.13 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.88 0.00 52 A 8.22 3.91 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 53 A 8.02 3.76 1.04 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 0.00 0.00 54 E 8.25 4.13 0.00 2.19 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 2.34 2.45 0.00 55 D 8.38 4.50 0.00 2.90 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 56 F 8.54 4.18 0.00 3.12 3.19 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 0.00 0.00 0.00 0.00 57 D 8.69 4.38 0.00 2.90 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 58 S 8.19 4.08 0.00 4.06 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 59 A 8.00 4.07 1.59 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 60 V 8.01 3.49 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 0.98 0.00 0.00 0.50 0.00 0.00 61 K 7.95 3.93 0.00 2.02 1.79 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.63 7.81 62 C 7.78 4.18 0.00 2.81 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 63 T 7.73 3.93 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 0.67 0.00 0.00 64 G 7.77 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 C 7.82 4.38 0.00 2.94 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 66 K 8.73 3.96 0.00 1.80 1.86 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.46 1.45 7.81 67 E 8.17 3.99 0.00 1.93 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 2.33 2.34 0.00 68 G 8.45 4.04 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 0.00 0.00 0.00 69 V 8.09 4.17 2.40 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 1.07 0.00 0.00 1.11 0.00 0.00 70 D 8.42 4.59 0.00 2.66 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 71 L 8.57 4.23 0.00 2.01 1.79 0.90 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 72 H 8.54 4.04 0.00 3.36 3.35 0.00 5.62 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 E 8.48 4.28 0.00 2.13 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 0.00 2.33 2.38 0.00 74 G 8.11 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 0.00 0.00 0.00 75 N 8.24 4.85 0.00 2.75 2.87 0.00 0.00 7.14 7.28 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 76 P 0.00 4.23 0.00 2.25 2.20 0.00 3.70 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.25 0.00 77 E 8.07 4.05 0.00 2.01 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 2.51 2.26 0.00 78 L 8.07 4.62 0.00 1.64 1.56 0.65 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 79 I 7.54 3.69 1.46 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 1.64 0.16 0.22 0.00 0.00 80 E 8.02 4.06 0.00 2.07 2.05 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 2.39 2.38 0.00 81 E 8.26 4.10 0.00 2.22 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 2.56 2.44 0.00 82 G 8.44 3.79 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 0.00 0.00 0.00 83 F 8.62 4.12 0.00 3.09 2.99 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 84 E 8.64 3.90 0.00 2.20 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 2.37 2.53 0.00 85 K 8.23 3.91 0.00 1.92 2.06 0.00 1.56 0.00 0.00 1.60 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.55 7.81 86 F 8.17 4.10 0.00 2.88 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 87 L 7.77 3.43 0.00 1.68 1.67 0.88 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 88 A 8.01 3.89 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 89 S 8.11 4.08 0.00 3.87 4.11 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 0.00 0.00 0.00 0.00 90 L 7.55 4.30 0.00 1.23 1.47 1.05 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 91 K 7.29 3.73 0.00 1.83 1.84 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.35 7.81 92 I 7.56 4.21 1.58 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.42 0.82 0.00 0.00 93 D 8.43 4.42 0.00 2.65 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 0.00 0.00 0.00 0.00 94 R 8.66 3.91 0.00 1.93 1.94 0.00 3.30 0.00 0.00 3.38 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.82 0.00 95 K 8.66 4.04 0.00 1.82 1.86 0.00 1.81 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.50 7.81 96 A 8.06 4.38 1.29 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 0.00 0.00 97 L 7.68 4.06 0.00 1.76 1.86 1.16 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 98 G 8.09 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 99 S 7.99 4.08 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 0.00 100 L 7.67 3.50 0.00 1.38 0.71 0.78 0.43 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 0.00 101 C 8.25 4.47 0.00 3.04 3.25 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 0.00 102 T 8.02 3.76 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 1.26 0.00 0.00 103 L 7.79 4.13 0.00 1.98 1.95 0.94 0.74 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 0.00 104 F 8.20 4.33 0.00 3.17 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 0.00 105 Q 7.56 3.99 0.00 2.11 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 106 K 7.84 4.12 0.00 1.81 1.97 0.00 1.84 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.43 1.53 7.81 107 L 7.71 4.26 0.00 1.62 1.60 0.95 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 *109 A 7.51 4.10 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 0.00 110 I 7.94 4.68 1.88 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 1.42 0.78 0.94 0.00 0.00 111 P 0.00 4.56 0.00 2.06 2.02 0.00 3.68 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 2.02 2.06 0.00 112 H 8.16 4.44 0.00 3.16 3.21 0.00 5.75 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 * Residues marked with a * may have inaccurate shift predictions.