NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 V 4.0129 8.0549 120.3090 60.7465 31.2019 173.9969 11 L 3.7903 8.2879 126.2626 55.3280 42.3576 174.8056 12 T 4.7701 8.6477 117.9587 60.2159 71.7499 172.5022 13 V 4.4759 9.0771 125.3133 61.1752 34.5880 174.9111 14 S 5.0311 8.7262 123.4241 58.8454 64.3115 173.2489 15 T 4.7134 9.3996 119.1959 62.7029 73.8029 173.1958 16 V 4.6881 8.1608 115.7867 59.6280 33.9880 176.0661 17 N 4.7726 8.6059 123.5809 51.7546 39.5758 174.2304 18 S 4.2585 8.7410 112.9226 61.6931 62.9032 175.4485 19 Q 4.3558 7.6188 115.3706 56.3206 30.7922 176.7355 *22 V 4.0289 7.7296 115.1958 62.1106 32.7203 174.6954 23 T 4.8381 7.1769 105.2411 60.8133 70.6907 173.1819 24 Q 4.6715 8.2455 133.4680 54.1948 31.6879 173.8174 25 K 4.7882 8.8028 125.4588 53.4991 36.4690 174.5215 26 P 4.7081 0.0000 0.0000 62.1232 32.4554 177.7008 27 L 3.7979 8.2810 119.7079 58.4044 41.7853 178.6751 28 R 3.9187 8.1060 115.6625 59.6486 28.9052 178.0401 29 D 4.3449 7.6183 118.8486 57.5752 40.8728 178.8915 30 S 4.1568 8.1395 114.7966 61.7137 62.7197 177.0545 31 V 3.4802 7.5153 120.2081 65.7685 31.3333 177.7597 32 K 3.8261 8.5084 119.7004 59.7578 31.9990 178.4597 33 Q 3.9372 8.4697 118.1766 59.0474 28.6871 178.8725 34 A 3.9586 8.0829 121.6340 55.0730 18.3517 179.6812 35 L 3.5804 8.1650 117.8402 57.6910 41.5465 179.3032 36 K 3.9017 8.4428 119.7048 59.8440 31.8979 178.1426 37 N 4.2818 8.4910 115.9806 56.7693 38.8001 176.4266 38 Y 4.3247 8.2919 120.9683 60.5975 38.7401 178.1027 39 F 4.2079 7.9769 118.5040 60.6923 38.9191 177.5853 40 A 4.0156 7.6655 118.3594 54.8067 18.1706 178.9607 41 Q 4.0544 7.5895 116.7390 57.4044 29.3147 175.8456 42 L 3.8449 7.1468 119.7479 55.3003 42.1379 176.6702 *45 Q 4.2143 8.2260 115.6745 55.1098 29.9650 175.3127 46 D 4.6953 7.9619 115.2625 52.0911 42.2673 174.3777 47 V 4.6502 8.2602 121.6400 61.4019 34.1309 174.8661 48 N 5.1381 8.5715 117.9879 52.8737 40.3765 173.9948 49 D 4.8894 7.8927 119.3820 52.5615 42.1435 176.6448 50 L 4.0108 8.4971 121.4109 58.4947 41.9386 176.4622 51 Y 3.9247 8.1364 119.0634 60.4920 38.9204 177.2047 52 E 3.8898 8.4624 119.8044 59.3177 29.4473 179.0041 53 L 3.8793 7.5402 119.3222 58.0228 42.5727 178.8503 54 V 3.5557 7.4712 118.2042 65.5810 31.3926 177.4088 55 L 3.7069 7.7551 120.3134 58.3785 41.3445 178.9534 56 A 4.3128 7.7805 121.3813 54.5466 18.1536 178.4912 57 E 4.0676 7.6394 114.2452 57.4162 29.8212 177.2110 58 V 4.1793 7.1087 116.0036 64.1815 34.3933 177.2354 59 E 3.8953 8.9917 120.4980 59.2836 29.1753 179.0582 60 Q 3.5997 7.0238 117.5256 58.4161 28.7969 177.2120 61 P 4.1843 0.0000 0.0000 65.7889 31.0769 178.0294 62 L 3.8661 7.5646 120.0034 57.8408 41.9646 178.7964 63 L 3.9543 8.2861 119.1409 58.1689 41.5269 178.8044 64 D 4.4388 8.3176 118.8230 58.0922 40.8382 178.8219 65 M 3.9085 8.1973 118.5013 58.6672 32.0452 179.2957 66 V 3.5259 7.9073 117.8955 66.3912 31.7708 177.9620 67 M 4.0793 8.7509 119.0397 58.3245 31.8992 178.4508 68 Q 3.8032 8.7987 120.2417 59.3503 29.0121 177.6904 69 Y 3.9475 7.6480 119.0665 60.7299 38.9131 177.6564 70 T 4.5680 8.1199 109.3735 61.3790 69.7488 174.1769 71 Y 3.5270 8.5303 116.2260 59.8054 36.1108 172.4545 72 G 3.8398 8.5795 105.2173 46.3062 0.0000 175.2013 73 N 4.5412 9.0136 120.0629 53.0139 38.1520 175.0573 74 Q 3.9784 8.6737 125.9359 59.4801 28.9517 178.8000 75 T 4.0144 7.9894 115.4784 67.2339 68.4267 176.4635 76 R 3.9915 8.0010 117.7696 58.9150 30.5067 178.0538 77 A 4.1584 8.1406 120.7951 55.0736 18.5767 179.3723 78 A 3.9695 8.8121 120.1862 55.2741 18.1957 179.6171 79 L 3.9633 7.7895 117.9831 58.3279 42.1461 178.9989 80 M 4.1711 7.6189 117.8754 58.7088 32.0721 178.3654 81 M 4.2291 7.8675 117.1371 56.2996 32.4632 177.0344 82 G 4.0343 9.0048 106.8668 45.5527 0.0000 172.9298 83 I 4.7224 7.2473 110.1686 57.5811 41.3225 174.8633 84 N 4.6358 8.4203 119.0069 52.4900 39.4701 176.0362 85 R 4.0303 8.7357 121.5248 59.6679 30.1803 179.2168 86 G 3.7150 8.1180 104.6075 48.3007 0.0000 175.2772 87 T 3.8557 7.9327 118.2099 66.1445 68.4564 175.7976 88 L 3.9522 7.7396 121.4830 58.7571 41.9946 179.4762 89 R 3.9159 8.2647 117.6920 58.8920 29.9207 178.9556 90 K 3.8823 8.0353 119.5082 59.4499 32.1855 179.0617 91 K 3.9057 8.1425 118.5574 59.3981 32.0221 179.1527 92 L 4.0621 8.1371 119.4732 57.9682 41.6345 179.6034 93 K 4.0793 8.2079 119.3435 59.3759 31.8671 178.5960 94 K 3.8018 7.7968 118.9109 59.2069 32.3153 177.4697 95 Y 4.6943 8.2127 115.6899 56.3237 39.1465 175.9798 96 G 4.0936 7.5345 107.2246 47.4585 0.0000 173.7606 97 M 4.6400 8.6092 114.4903 54.9410 34.5357 176.6505 98 N 4.5416 8.1448 120.8646 53.0140 37.6192 174.8032 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 10 V 8.05 4.01 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 0.91 0.00 0.00 0.92 0.00 0.00 11 L 8.29 3.79 0.00 1.73 1.67 0.90 0.20 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 12 T 8.65 4.77 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 1.28 0.00 0.00 13 V 9.08 4.48 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 0.91 0.00 0.00 0.91 0.00 0.00 14 S 8.73 5.03 0.00 3.79 3.76 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 15 T 9.40 4.71 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 1.20 0.00 0.00 16 V 8.16 4.69 2.08 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 0.76 0.00 0.00 0.93 0.00 0.00 17 N 8.61 4.77 0.00 2.83 2.86 0.00 0.00 6.28 7.64 0.00 0.00 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 S 8.74 4.26 0.00 3.88 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.62 4.36 0.00 2.08 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.82 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 *22 V 7.73 4.03 2.08 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 0.81 0.00 0.00 1.04 0.00 0.00 23 T 7.18 4.84 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 24 Q 8.25 4.67 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.84 0.00 0.00 0.00 0.00 0.00 2.23 2.44 0.00 25 K 8.80 4.79 0.00 1.68 1.63 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.51 7.81 26 P 0.00 4.71 0.00 2.17 1.99 0.00 3.77 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.06 0.00 27 L 8.28 3.80 0.00 1.72 1.63 0.89 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.11 3.92 0.00 2.07 2.20 0.00 3.03 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.75 0.00 29 D 7.62 4.34 0.00 2.88 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 30 S 8.14 4.16 0.00 3.94 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 31 V 7.52 3.48 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 0.99 0.00 0.00 0.97 0.00 0.00 32 K 8.51 3.83 0.00 1.82 1.97 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.53 7.81 33 Q 8.47 3.94 0.00 2.28 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.52 0.00 34 A 8.08 3.96 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 35 L 8.17 3.58 0.00 1.75 1.36 0.92 0.59 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 36 K 8.44 3.90 0.00 1.88 2.02 0.00 1.68 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.57 7.81 37 N 8.49 4.28 0.00 2.82 2.90 0.00 0.00 7.11 7.32 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 38 Y 8.29 4.32 0.00 2.87 2.88 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 39 F 7.98 4.21 0.00 3.24 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 40 A 7.67 4.02 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 41 Q 7.59 4.05 0.00 2.14 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 42 L 7.15 3.84 0.00 1.74 1.58 0.85 0.78 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 *45 Q 8.23 4.21 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.65 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 46 D 7.96 4.70 0.00 2.74 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 47 V 8.26 4.65 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 1.15 0.00 0.00 1.05 0.00 0.00 48 N 8.57 5.14 0.00 2.83 2.88 0.00 0.00 5.76 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 49 D 7.89 4.89 0.00 2.71 2.61 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 50 L 8.50 4.01 0.00 2.00 1.82 0.87 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 51 Y 8.14 3.92 0.00 3.18 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 52 E 8.46 3.89 0.00 2.26 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 0.00 2.42 2.48 0.00 53 L 7.54 3.88 0.00 1.88 1.69 0.88 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.47 3.56 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 0.80 0.00 0.00 0.82 0.00 0.00 55 L 7.76 3.71 0.00 1.27 1.68 0.92 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 56 A 7.78 4.31 1.52 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 0.00 0.00 57 E 7.64 4.07 0.00 1.98 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 2.21 2.25 0.00 58 V 7.11 4.18 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 0.92 0.00 0.00 0.84 0.00 0.00 59 E 8.99 3.90 0.00 1.90 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 2.35 2.47 0.00 60 Q 7.02 3.60 0.00 1.86 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.77 0.00 0.00 0.00 0.00 0.00 1.94 1.16 0.00 61 P 0.00 4.18 0.00 2.18 2.23 0.00 3.47 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.07 0.00 62 L 7.56 3.87 0.00 1.74 1.91 0.88 0.59 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 63 L 8.29 3.95 0.00 1.78 1.71 1.02 1.08 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 64 D 8.32 4.44 0.00 2.81 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 M 8.20 3.91 0.00 2.01 2.23 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.88 0.00 66 V 7.91 3.53 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 1.03 0.00 0.00 1.01 0.00 0.00 67 M 8.75 4.08 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.81 0.00 68 Q 8.80 3.80 0.00 2.12 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.76 0.00 0.00 0.00 0.00 0.00 2.21 2.25 0.00 69 Y 7.65 3.95 0.00 3.11 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 70 T 8.12 4.57 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 1.48 0.00 0.00 71 Y 8.53 3.53 0.00 3.11 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 72 G 8.58 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 73 N 9.01 4.54 0.00 2.83 2.87 0.00 0.00 7.16 7.11 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 74 Q 8.67 3.98 0.00 2.12 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.58 0.00 0.00 0.00 0.00 0.00 2.49 2.45 0.00 75 T 7.99 4.01 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 1.23 0.00 0.00 76 R 8.00 3.99 0.00 2.05 2.04 0.00 3.54 0.00 0.00 3.37 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 77 A 8.14 4.16 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 78 A 8.81 3.97 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 79 L 7.79 3.96 0.00 1.83 1.90 0.93 1.07 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 80 M 7.62 4.17 0.00 1.98 2.22 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.48 0.00 81 M 7.87 4.23 0.00 1.98 2.12 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.58 0.00 82 G 9.00 4.03 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 0.00 83 I 7.25 4.72 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 1.48 0.77 0.92 0.00 0.00 84 N 8.42 4.64 0.00 2.95 2.99 0.00 0.00 5.94 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 85 R 8.74 4.03 0.00 1.88 2.06 0.00 3.15 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 86 G 8.12 3.72 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 0.00 0.00 0.00 87 T 7.93 3.86 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 1.23 0.00 0.00 88 L 7.74 3.95 0.00 1.80 1.89 0.95 0.83 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 89 R 8.26 3.92 0.00 2.04 1.97 0.00 3.20 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.91 0.00 90 K 8.04 3.88 0.00 1.83 2.01 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.46 7.81 91 K 8.14 3.91 0.00 2.07 2.04 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.71 7.81 92 L 8.14 4.06 0.00 1.70 1.77 1.00 1.16 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 93 K 8.21 4.08 0.00 1.94 1.94 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.44 7.81 94 K 7.80 3.80 0.00 1.66 1.62 0.00 1.57 0.00 0.00 1.08 0.00 0.00 2.44 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.49 1.13 7.81 95 Y 8.21 4.69 0.00 3.03 2.88 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 96 G 7.53 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 0.00 0.00 0.00 97 M 8.61 4.64 0.00 1.96 2.13 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.48 0.00 98 N 8.14 4.54 0.00 2.84 2.82 0.00 0.00 5.93 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 * Residues marked with a * may have inaccurate shift predictions.