NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -8 H 4.7182 8.4444 120.3676 56.5863 30.4972 170.9754 *-7 H 4.5740 8.6718 126.5848 56.5724 36.8913 169.7283 *-6 E 4.3584 9.1169 114.4748 54.2850 29.1504 174.7629 -5 N 4.3325 8.2628 117.8965 53.2150 38.0058 172.8366 -4 L 4.7315 7.7018 124.4623 53.0169 42.1484 174.1173 -3 Y 4.7296 7.9973 120.0471 56.2350 41.0914 173.5447 -2 F 5.3612 7.8573 125.2369 55.0647 40.7804 177.1474 -1 Q 4.2685 9.2292 124.2179 57.4708 29.3683 177.9829 0 G 3.6107 9.2523 105.2013 46.5386 0.0000 172.7324 *-6 G 3.9684 9.0269 103.0748 42.7850 0.0000 173.0629 -5 I 3.7625 7.8628 119.0965 61.2150 37.9058 174.0366 -4 R 4.7315 7.7718 123.1623 53.9169 30.6484 172.8173 -3 H 4.9096 8.2973 117.9471 53.3350 32.2914 171.7447 -2 I 4.9112 7.5573 124.8369 58.4647 39.9804 177.7474 -1 A 4.2485 9.1492 128.2179 54.2708 19.0683 179.7829 0 L 3.9907 9.0823 118.2013 56.5386 43.6471 175.4324 9 F 5.4893 8.9270 122.4123 55.6817 42.0554 174.5514 10 R 4.4124 8.3815 123.3747 53.8905 31.8647 175.1904 11 W 5.0970 8.7078 127.1996 56.7826 30.2322 176.2780 12 N 4.8134 8.6953 119.9763 51.6589 38.7730 175.5398 13 D 4.4866 8.5002 116.9579 57.3771 40.9674 178.2687 14 T 3.9010 7.7488 115.0804 65.8735 68.6055 174.6739 15 V 3.9792 7.3260 121.2299 62.1245 32.4663 175.7144 16 T 4.6181 8.1334 117.1627 59.1101 72.3910 173.6406 17 P 4.2053 0.0000 0.0000 66.1943 31.3671 178.6306 18 D 4.3305 8.0578 116.8801 57.5126 40.7118 178.8105 19 Q 3.8377 7.7785 118.4853 58.7403 28.5701 178.8285 20 V 3.2732 7.4743 119.2298 65.9066 31.4466 177.8467 21 E 4.0197 8.3912 118.4702 59.5826 29.2655 179.3456 22 Q 3.9370 8.0755 118.0312 58.9439 28.6700 179.1124 23 V 3.4604 7.7295 119.1604 65.9011 31.4992 178.1055 24 I 3.9114 8.0133 119.6613 64.8043 37.0409 178.5242 25 T 3.9014 8.2777 116.5484 66.5975 68.2507 176.5797 26 A 3.9548 8.3436 123.0023 55.2683 18.2141 179.7769 27 L 3.7826 7.7706 116.4766 57.7083 41.5154 179.6453 28 S 4.6867 7.8424 114.7072 61.0251 62.9919 175.9217 29 K 4.4237 8.1140 119.0169 56.2342 33.6106 176.9404 30 L 4.8895 7.9539 119.8270 53.2713 41.4126 175.2012 31 P 4.0549 0.0000 0.0000 62.8922 32.7346 176.0583 32 A 3.3003 8.0607 121.2228 53.3707 16.4927 178.3055 33 A 4.4786 7.5502 123.7198 51.4065 18.2421 178.2251 34 I 4.0151 7.2826 116.7623 59.7261 38.9565 175.8787 35 P 4.3191 0.0000 0.0000 66.1908 31.3971 177.7865 36 E 4.1611 8.2033 116.7194 58.5530 30.7119 176.5352 37 L 4.5520 7.9575 121.8161 54.7149 41.3722 176.4409 38 K 4.3008 9.0490 127.6125 58.4835 33.2746 177.0174 39 N 4.5995 7.9743 114.9202 53.2247 41.9979 172.8718 40 Y 5.5162 8.0923 120.6231 56.3381 41.4134 173.5755 41 A 4.7139 9.2276 120.8683 51.1562 23.0274 175.3085 42 F 5.1378 7.1517 114.5818 55.7351 41.0779 173.3085 43 G 3.9084 7.6953 107.2505 45.8535 0.0000 172.1541 44 A 4.8096 8.3357 121.9659 50.9500 19.4621 177.3302 45 D 4.3582 8.8708 120.7230 54.6612 41.7580 176.5674 46 L 4.2894 8.5057 123.9478 54.5660 42.0421 177.3860 47 G 3.9332 8.4967 106.7618 46.3911 0.0000 174.8527 48 L 4.1923 7.9362 118.2209 55.2488 42.5137 176.9461 49 A 4.3355 7.7116 122.2010 50.3139 21.0497 175.1356 50 A 4.0719 8.7115 125.5241 54.9248 18.4910 177.5079 51 G 4.0458 9.0122 111.1409 45.0926 0.0000 173.3390 52 N 4.5623 7.5516 116.3188 53.1244 39.0725 174.5427 53 Y 4.5687 8.2978 118.1533 58.1481 39.4148 174.8759 54 D 4.8510 8.6902 118.9851 55.6766 42.8372 176.7726 55 F 5.1491 7.6933 118.3553 56.9483 43.0785 172.5597 56 A 5.4629 8.3639 126.1502 50.0114 22.2585 175.3119 57 V 5.1257 8.1872 119.9314 59.9108 34.6407 175.0852 58 V 5.5353 9.3300 123.1478 61.3031 34.7846 174.0466 59 A 5.2453 8.6111 127.9735 50.5520 22.2435 174.6179 60 D 5.6201 9.4497 123.1141 52.7194 43.0886 175.5649 61 L 5.2363 8.3715 122.9691 52.9048 44.8718 176.2847 62 D 4.5805 9.2868 123.8902 54.5762 41.4011 176.7425 63 G 4.1036 8.6229 110.3592 45.6978 0.0000 172.5299 64 E 4.0411 8.6684 119.0775 59.5212 29.3910 179.5271 65 D 4.5025 8.2473 118.5302 57.2350 40.8979 178.7960 66 G 3.8133 8.1012 107.0560 47.2445 0.0000 175.2986 67 F 4.3444 8.4652 123.5834 61.1065 39.5514 177.4850 68 R 3.9169 8.5057 117.8713 59.1363 29.6377 178.8621 69 A 4.0243 7.9743 119.6785 55.1464 18.7575 178.8095 70 Y 4.1165 8.1926 118.0302 61.1216 38.7358 178.1875 71 Q 3.5953 7.6607 117.3664 58.6010 28.8520 178.0158 72 D 4.5781 7.4374 116.5259 53.8260 42.0141 176.3989 73 H 4.3143 7.4060 120.7708 55.0327 30.7244 174.1257 74 P 4.2351 0.0000 0.0000 65.8740 30.9939 178.5469 75 D 4.3330 8.3154 117.1493 57.7140 40.7040 178.2621 76 H 3.9025 8.0206 118.0206 59.2863 30.0588 177.3809 77 R 3.7898 8.0262 119.6793 59.0606 29.7712 178.9293 78 A 3.9358 8.2301 120.6404 55.0026 18.3614 179.5900 79 A 3.8531 8.1354 119.5022 55.2226 18.3616 179.7712 80 L 3.8265 8.0157 117.5101 57.8497 41.4047 179.6689 81 A 3.9145 7.5472 119.3879 55.1433 18.3774 179.4957 82 I 3.7240 7.2302 116.9276 64.6181 37.2602 178.5046 83 I 3.7266 7.4296 119.2569 63.8019 36.9429 177.7118 84 A 4.1134 7.8515 121.3104 54.5102 18.6862 178.9768 85 P 4.3805 0.0000 0.0000 61.9678 30.4338 176.7813 *87 L 4.1358 7.7617 116.5013 54.8298 42.9824 177.0402 88 A 4.4594 9.2158 125.2907 53.9786 19.9975 176.6718 89 D 4.7593 7.5917 112.3257 53.4181 45.1196 174.3040 90 R 5.9902 8.5394 122.1294 55.0747 33.0922 174.1423 91 V 4.7119 8.7755 125.0320 61.1534 34.4387 174.1734 92 A 5.8585 8.5682 126.8996 50.6700 22.4886 175.2938 93 V 4.5492 8.2915 117.9057 61.4146 35.0668 174.1565 94 Q 5.6478 8.7753 125.2808 54.1642 30.9006 174.7572 95 F 5.1046 8.3202 117.5849 54.5757 41.6247 174.1836 96 A 4.4757 8.6091 121.8345 51.4119 18.9914 177.3377 97 L 4.1055 8.0598 123.9457 55.3532 41.8755 176.5977 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 -8 H 8.44 4.72 0.00 3.05 3.20 0.00 5.72 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *-7 H 8.67 4.57 0.00 3.12 2.85 0.00 7.30 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *-6 E 9.12 4.36 0.00 1.98 2.39 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 2.15 1.82 0.00 -5 N 8.26 4.33 0.00 2.87 2.82 0.00 0.00 7.49 6.74 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 -4 L 7.70 4.73 0.00 1.52 1.04 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 -3 Y 8.00 4.73 0.00 2.87 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 -2 F 7.86 5.36 0.00 2.93 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 -1 Q 9.23 4.27 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.58 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 0 G 9.25 3.61 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 0.00 0.00 0.00 *-6 G 9.03 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 -5 I 7.86 3.76 1.87 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 1.27 1.24 0.91 0.00 0.00 -4 R 7.77 4.73 0.00 1.76 1.18 0.00 3.29 0.00 0.00 3.22 7.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.10 0.00 -3 H 8.30 4.91 0.00 3.13 2.91 0.00 5.08 0.00 0.00 0.00 0.00 5.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -2 I 7.56 4.91 1.87 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 1.43 1.78 0.91 0.00 0.00 -1 A 9.15 4.25 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 0 L 9.08 3.99 0.00 1.29 1.49 0.92 0.76 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 9 F 8.93 5.49 0.00 2.20 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 0.00 0.00 0.00 10 R 8.38 4.41 0.00 0.67 1.03 0.00 2.89 0.00 0.00 2.44 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.16 0.00 11 W 8.71 5.10 0.00 3.22 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 12 N 8.70 4.81 0.00 2.96 3.01 0.00 0.00 6.05 8.07 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 13 D 8.50 4.49 0.00 2.69 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 14 T 7.75 3.90 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 1.14 0.00 0.00 15 V 7.33 3.98 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 0.07 0.00 0.00 0.73 0.00 0.00 16 T 8.13 4.62 4.19 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 1.20 0.00 0.00 17 P 0.00 4.21 0.00 2.17 2.17 0.00 3.57 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 2.11 2.20 0.00 18 D 8.06 4.33 0.00 2.63 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 19 Q 7.78 3.84 0.00 1.93 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.80 0.00 0.00 0.00 0.00 0.00 2.23 2.23 0.00 20 V 7.47 3.27 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 1.40 0.00 0.00 0.68 0.00 0.00 21 E 8.39 4.02 0.00 2.22 2.01 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 2.52 2.53 0.00 22 Q 8.08 3.94 0.00 2.19 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.47 0.00 23 V 7.73 3.46 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 0.83 0.00 0.00 0.60 0.00 0.00 24 I 8.01 3.91 2.20 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.96 1.21 0.00 0.00 25 T 8.28 3.90 4.41 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 1.23 0.00 0.00 26 A 8.34 3.95 1.27 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 0.00 0.00 27 L 7.77 3.78 0.00 0.31 0.63 0.83 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 28 S 7.84 4.69 0.00 4.14 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 0.00 29 K 8.11 4.42 0.00 1.75 1.88 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.64 7.81 30 L 7.95 4.89 0.00 1.71 1.70 0.87 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 31 P 0.00 4.05 0.00 1.81 1.89 0.00 4.08 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.02 0.00 32 A 8.06 3.30 1.10 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 0.00 0.00 33 A 7.55 4.48 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 34 I 7.28 4.02 2.08 0.00 0.00 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 1.73 0.82 0.99 0.00 0.00 35 P 0.00 4.32 0.00 2.10 2.22 0.00 3.73 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.17 0.00 36 E 8.20 4.16 0.00 2.04 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 0.00 2.46 2.43 0.00 37 L 7.96 4.55 0.00 1.74 1.89 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 38 K 9.05 4.30 0.00 1.59 1.63 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.61 0.94 7.81 39 N 7.97 4.60 0.00 2.66 2.72 0.00 0.00 6.75 7.56 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 40 Y 8.09 5.52 0.00 3.26 2.97 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 41 A 9.23 4.71 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 42 F 7.15 5.14 0.00 3.30 3.20 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 43 G 7.70 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 44 A 8.34 4.81 1.45 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 0.00 0.00 0.00 0.00 0.00 0.00 45 D 8.87 4.36 0.00 2.72 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.51 4.29 0.00 1.67 1.69 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 47 G 8.50 3.93 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 0.00 0.00 0.00 48 L 7.94 4.19 0.00 1.65 1.73 0.92 0.76 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 49 A 7.71 4.34 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 50 A 8.71 4.07 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 51 G 9.01 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 52 N 7.55 4.56 0.00 2.80 2.82 0.00 0.00 6.96 6.74 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 53 Y 8.30 4.57 0.00 2.80 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 54 D 8.69 4.85 0.00 1.96 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 55 F 7.69 5.15 0.00 3.10 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 56 A 8.36 5.46 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 57 V 8.19 5.13 2.36 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 0.89 0.00 0.00 1.20 0.00 0.00 58 V 9.33 5.54 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 1.00 0.00 0.00 0.95 0.00 0.00 59 A 8.61 5.25 1.11 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 0.00 0.00 60 D 9.45 5.62 0.00 2.66 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 61 L 8.37 5.24 0.00 1.45 1.56 0.50 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 62 D 9.29 4.58 0.00 2.95 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 63 G 8.62 4.10 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 0.00 0.00 0.00 64 E 8.67 4.04 0.00 2.06 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 0.00 2.40 2.40 0.00 65 D 8.25 4.50 0.00 2.72 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 66 G 8.10 3.81 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 0.00 0.00 0.00 67 F 8.47 4.34 0.00 3.04 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 68 R 8.51 3.92 0.00 1.86 1.94 0.00 3.43 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.82 0.00 69 A 7.97 4.02 1.41 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 70 Y 8.19 4.12 0.00 3.13 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 71 Q 7.66 3.60 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.57 0.00 0.00 0.00 0.00 0.00 1.94 1.67 0.00 72 D 7.44 4.58 0.00 2.69 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 73 H 7.41 4.31 0.00 3.33 3.09 0.00 5.60 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.24 0.00 2.13 2.04 0.00 3.11 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.09 0.00 75 D 8.32 4.33 0.00 2.74 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 76 H 8.02 3.90 0.00 2.79 3.26 0.00 5.87 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 77 R 8.03 3.79 0.00 1.85 1.90 0.00 3.14 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 78 A 8.23 3.94 1.33 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 0.00 0.00 79 A 8.14 3.85 1.27 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 0.00 0.00 80 L 8.02 3.83 0.00 1.73 1.65 0.83 1.01 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 81 A 7.55 3.91 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 82 I 7.23 3.72 1.90 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.65 0.78 0.00 0.00 83 I 7.43 3.73 1.66 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 1.30 0.32 0.28 0.00 0.00 84 A 7.85 4.11 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 85 P 0.00 4.38 0.00 1.98 2.03 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.05 0.00 *87 L 7.76 4.14 0.00 1.75 1.64 0.79 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 88 A 9.22 4.46 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 89 D 7.59 4.76 0.00 2.80 2.43 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 90 R 8.54 5.99 0.00 1.98 1.86 0.00 3.42 0.00 0.00 3.30 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.07 0.00 91 V 8.78 4.71 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 0.83 0.00 0.00 1.00 0.00 0.00 92 A 8.57 5.86 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 93 V 8.29 4.55 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 0.94 0.00 0.00 0.93 0.00 0.00 94 Q 8.78 5.65 0.00 1.70 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.58 0.00 0.00 0.00 0.00 0.00 1.27 2.21 0.00 95 F 8.32 5.10 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 96 A 8.61 4.48 1.20 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 97 L 8.06 4.11 0.00 1.28 1.24 0.86 0.95 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 * Residues marked with a * may have inaccurate shift predictions.