NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 Q 4.3552 8.1876 119.6272 55.9040 30.2828 173.4373 16 N 5.3501 8.3147 121.2545 50.6514 40.2799 172.0289 17 Y 4.9110 8.8571 117.6526 55.7091 43.0474 175.9217 18 L 4.4666 8.7737 123.4381 55.7062 43.1191 176.1817 19 F 4.7284 9.1550 126.7878 56.9975 42.6245 173.4743 20 G 4.4425 8.8025 116.4874 45.0976 0.0000 170.4501 21 C 5.0496 7.0752 118.3626 57.3520 30.0219 171.6358 22 E 4.9492 8.1148 123.4601 54.5615 31.1993 174.7129 23 L 4.8810 8.9238 127.3069 53.2207 44.3927 175.7254 24 K 5.1645 8.3964 120.0359 54.1412 36.6952 175.6785 25 A 3.8763 8.5504 123.1916 53.5558 18.7510 177.6568 26 D 4.2468 8.5132 117.2432 53.7283 38.3815 174.2721 27 K 4.5227 7.1358 116.7447 55.6848 34.2287 173.8247 28 D 4.5861 8.1594 120.7010 54.5463 42.2637 176.1318 29 Y 4.6399 8.9899 124.3038 56.3707 40.8906 173.7732 30 H 4.9326 8.0612 123.8710 54.1577 30.7200 174.0638 31 F 4.7833 9.3737 127.8785 56.4565 40.4311 174.3064 32 K 4.6274 8.0227 125.0745 54.9544 35.2267 176.7111 33 V 3.9191 8.1173 122.8577 61.0340 31.6339 175.0147 34 D 4.4780 7.7372 129.6756 51.5169 38.5068 176.6327 *39 E 4.2308 7.8230 122.4152 57.0711 31.9004 174.0381 40 H 4.1333 8.2849 119.6704 55.7781 28.2776 174.0052 41 Q 4.6277 8.8385 124.3031 54.2845 32.9720 173.0714 42 L 4.5034 9.0885 128.6601 53.5651 44.2367 174.8931 43 S 4.9364 8.6837 122.3034 56.2419 64.1468 172.7168 44 L 4.0017 8.6905 128.4834 55.3641 42.0839 176.5155 45 R 4.6225 9.5500 123.3498 56.0951 31.3315 175.3971 46 T 5.1426 8.3034 108.5231 60.0684 72.7763 172.9094 47 V 4.9385 8.5164 124.4789 61.2548 33.8763 174.5861 48 S 5.1953 9.2783 122.1616 56.6596 66.4418 173.6848 49 L 4.0860 8.6342 124.2305 54.8149 40.8896 177.3456 50 G 3.8752 8.8465 110.2117 45.1948 0.0000 174.6632 51 A 4.4131 8.6392 122.3664 54.9258 18.7271 179.5691 52 G 3.5766 8.6006 103.8957 49.2243 0.0000 173.8839 53 A 4.1132 7.0164 120.4040 52.0283 17.9766 177.5539 54 K 4.3433 7.8056 121.9278 56.3244 33.0724 175.9352 55 D 4.8222 8.3340 117.4417 54.6568 41.4376 175.5637 56 E 4.6399 7.8264 114.5289 53.6571 31.9483 175.0608 57 L 4.1371 8.3093 122.0619 56.3887 42.9659 175.9323 58 H 5.1021 9.2376 120.7339 54.1446 33.0360 172.4139 59 I 5.0111 8.4512 122.8324 59.5814 40.8219 174.3409 60 V 4.5661 8.7805 127.9494 61.1996 33.3684 174.3975 61 E 5.2675 9.3596 125.4233 54.5940 33.1703 174.5523 62 A 5.1770 8.9373 122.2388 50.1254 22.9768 174.7851 63 E 5.3033 10.2427 121.8710 53.4779 32.4823 174.6350 64 A 5.0397 8.3138 127.3297 50.3297 23.3286 174.7940 65 M 4.3841 8.6009 119.0730 54.9588 33.1592 176.7870 66 N 4.8168 8.5972 120.3240 51.6953 39.4245 175.1726 67 Y 4.2579 8.7069 118.3787 61.1426 38.7028 176.6428 68 E 4.1142 9.9240 117.5085 56.4291 28.8585 177.2386 69 G 4.2035 7.7585 115.3074 44.9851 0.0000 174.3882 70 S 4.1286 7.6584 113.6831 57.3832 63.5102 171.8622 71 P 4.9307 0.0000 0.0000 61.6230 32.6154 175.4048 72 I 4.5733 8.0830 115.5554 59.2807 40.7088 174.3013 73 K 4.9917 8.5118 122.1906 54.7457 34.0415 175.8491 74 V 4.5506 8.7153 124.3077 61.3216 35.3360 174.1084 75 T 4.7081 8.4449 122.2766 62.9489 69.0069 174.5380 76 L 4.4533 9.3538 127.4788 56.9696 42.3409 176.9766 77 A 4.6994 7.7455 118.2162 50.9829 22.9849 174.9656 78 T 4.8847 8.5469 116.1650 62.1152 70.6235 173.6299 79 L 4.9015 8.7880 126.7636 53.0854 45.7671 176.3368 80 K 4.4151 8.8421 119.8231 57.1118 34.7524 176.0914 81 M 3.7927 8.8547 128.8893 58.7943 32.5322 177.4691 82 S 4.4837 8.3778 109.9927 58.8987 63.6889 174.5053 83 V 4.1926 8.3582 120.0217 64.4819 33.5848 175.5468 84 Q 4.5816 7.3714 119.0893 54.9325 29.9767 171.8451 85 P 4.5214 0.0000 0.0000 64.3379 32.6765 175.7120 86 T 5.2310 7.7015 114.1597 61.9222 73.0261 173.6120 87 V 4.4236 8.5960 122.7890 61.7696 35.4575 173.6394 88 S 5.1082 8.6924 124.1007 57.3290 63.1157 174.1313 89 L 4.0866 9.1734 126.7693 54.5155 42.2953 177.4762 90 G 3.7116 8.6894 106.0427 46.6991 0.0000 173.0750 91 G 3.9032 8.2602 100.3764 46.9206 0.0000 175.3570 92 F 4.5388 8.1442 122.7074 57.5927 39.7839 173.7829 93 E 4.9637 8.8678 125.7251 55.8220 30.3249 176.2446 94 I 4.7019 9.2893 125.7444 59.7268 41.2915 174.5461 95 T 4.7393 8.3875 121.5793 61.7285 69.3624 173.4212 96 P 4.5193 0.0000 0.0000 61.6622 32.1352 174.0712 97 P 4.9017 0.0000 0.0000 63.2088 32.6092 175.7445 98 V 4.7652 8.5300 118.2411 60.7366 34.8874 172.6911 99 V 4.8614 8.8763 123.1336 61.1314 34.5049 174.0174 100 L 5.5947 9.1067 127.9184 53.0586 44.1835 175.7692 101 R 5.0035 9.3556 119.9705 54.6158 34.1980 174.3325 102 L 4.7074 8.2575 121.4221 53.0974 41.7060 176.0077 103 K 4.2946 8.5212 120.8504 56.7667 32.6403 175.5529 104 C 4.5657 8.4284 116.0852 60.5302 35.4441 174.0523 105 G 4.0782 9.0909 110.7433 45.6143 0.0000 173.7906 106 S 4.0861 8.3460 115.3973 60.8898 63.4799 174.9941 107 G 3.9902 8.3459 107.5253 42.6095 0.0000 170.2657 108 P 4.8463 0.0000 0.0000 62.7772 33.0843 175.4946 109 V 4.6372 8.5260 120.7597 61.5314 34.7903 173.7959 110 H 5.3442 9.6376 126.0061 54.5060 31.1141 174.0401 111 I 5.0342 8.3339 123.2189 59.5895 40.2481 175.0937 112 S 5.0805 9.5023 121.7072 55.0485 66.6074 173.9846 113 G 3.7770 7.2740 104.2844 46.1111 0.0000 170.9316 114 Q 5.0918 8.1016 117.8207 54.4325 33.5575 174.5639 115 H 5.0941 9.4245 122.5113 54.6263 31.6245 172.9145 116 L 4.8721 8.8941 126.8699 54.2023 42.9919 176.4619 117 V 4.6928 8.8196 122.1251 60.8670 35.1157 175.2538 118 A 4.2254 8.4375 126.7869 52.4667 18.6362 177.4707 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 15 Q 8.19 4.36 0.00 2.24 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 16 N 8.31 5.35 0.00 2.71 2.69 0.00 0.00 6.06 6.66 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 17 Y 8.86 4.91 0.00 3.06 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 18 L 8.77 4.47 0.00 1.74 1.64 0.93 0.64 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 19 F 9.15 4.73 0.00 3.21 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 20 G 8.80 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.08 5.05 0.00 2.43 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 0.00 0.00 0.00 22 E 8.11 4.95 0.00 1.95 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 2.14 2.39 0.00 23 L 8.92 4.88 0.00 1.58 1.55 0.93 0.78 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 24 K 8.40 5.16 0.00 1.58 1.66 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.44 7.81 25 A 8.55 3.88 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 26 D 8.51 4.25 0.00 2.79 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 27 K 7.14 4.52 0.00 1.68 1.90 0.00 1.82 0.00 0.00 1.83 0.00 0.00 3.11 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.29 1.38 7.81 28 D 8.16 4.59 0.00 2.67 2.58 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 29 Y 8.99 4.64 0.00 3.16 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 30 H 8.06 4.93 0.00 2.84 3.08 0.00 5.73 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 9.37 4.78 0.00 3.22 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 32 K 8.02 4.63 0.00 1.58 1.60 0.00 1.45 0.00 0.00 1.52 0.00 0.00 2.82 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.14 1.20 7.81 33 V 8.12 3.92 1.87 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 0.36 0.00 0.00 0.58 0.00 0.00 34 D 7.74 4.48 0.00 2.76 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 *39 E 7.82 4.23 0.00 2.02 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 2.24 2.36 0.00 40 H 8.28 4.13 0.00 3.34 3.41 0.00 5.65 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 Q 8.84 4.63 0.00 2.18 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.79 0.00 0.00 0.00 0.00 0.00 2.46 2.37 0.00 42 L 9.09 4.50 0.00 1.35 1.45 -0.73 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 43 S 8.68 4.94 0.00 3.92 3.73 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 44 L 8.69 4.00 0.00 1.63 1.56 0.68 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 45 R 9.55 4.62 0.00 1.82 1.81 0.00 3.24 0.00 0.00 3.31 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.72 0.00 46 T 8.30 5.14 4.25 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 1.22 0.00 0.00 47 V 8.52 4.94 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 0.97 0.00 0.00 0.94 0.00 0.00 48 S 9.28 5.20 0.00 3.84 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 49 L 8.63 4.09 0.00 1.51 1.55 0.91 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 50 G 8.85 3.88 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 0.00 0.00 0.00 51 A 8.64 4.41 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 52 G 8.60 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 53 A 7.02 4.11 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 54 K 7.81 4.34 0.00 2.12 1.80 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.38 7.81 55 D 8.33 4.82 0.00 2.62 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 56 E 7.83 4.64 0.00 2.08 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 2.05 2.19 0.00 57 L 8.31 4.14 0.00 1.67 1.61 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 58 H 9.24 5.10 0.00 3.23 3.12 0.00 5.61 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.45 5.01 1.88 0.00 0.00 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 1.13 1.30 0.93 0.00 0.00 60 V 8.78 4.57 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 1.04 0.00 0.00 0.94 0.00 0.00 61 E 9.36 5.27 0.00 2.17 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 2.18 2.23 0.00 62 A 8.94 5.18 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 63 E 10.24 5.30 0.00 1.85 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 0.00 2.18 2.23 0.00 64 A 8.31 5.04 1.19 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 0.00 0.00 65 M 8.60 4.38 0.00 2.28 2.02 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.53 0.00 66 N 8.60 4.82 0.00 3.04 3.03 0.00 0.00 6.55 7.10 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 67 Y 8.71 4.26 0.00 2.85 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 68 E 9.92 4.11 0.00 2.12 1.92 0.00 0.00 0.00 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 2.28 0.00 69 G 7.76 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 70 S 7.66 4.13 0.00 4.02 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 71 P 0.00 4.93 0.00 2.07 2.02 0.00 3.65 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 1.99 2.06 0.00 72 I 8.08 4.57 1.90 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 1.26 0.88 0.94 0.00 0.00 73 K 8.51 4.99 0.00 1.64 1.95 0.00 1.69 0.00 0.00 1.79 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.40 7.81 74 V 8.72 4.55 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 1.16 0.00 0.00 0.98 0.00 0.00 75 T 8.44 4.71 4.28 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 1.24 0.00 0.00 76 L 9.35 4.45 0.00 1.60 1.73 0.84 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 77 A 7.75 4.70 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 78 T 8.55 4.88 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 79 L 8.79 4.90 0.00 1.54 1.76 0.95 0.51 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 80 K 8.84 4.42 0.00 1.81 1.64 0.00 1.68 0.00 0.00 1.58 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.38 7.81 81 M 8.85 3.79 0.00 2.17 2.07 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.65 0.00 82 S 8.38 4.48 0.00 4.02 3.98 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 83 V 8.36 4.19 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 0.79 0.00 0.00 0.94 0.00 0.00 84 Q 7.37 4.58 0.00 2.08 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 6.69 0.00 0.00 0.00 0.00 0.00 2.33 2.45 0.00 85 P 0.00 4.52 0.00 2.11 2.07 0.00 3.59 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.29 0.00 86 T 7.70 5.23 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 1.26 0.00 0.00 87 V 8.60 4.42 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 0.96 0.00 0.00 0.94 0.00 0.00 88 S 8.69 5.11 0.00 3.80 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 89 L 9.17 4.09 0.00 1.87 1.95 0.97 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 90 G 8.69 3.71 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 0.00 0.00 0.00 91 G 8.26 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 0.00 0.00 0.00 92 F 8.14 4.54 0.00 3.14 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 93 E 8.87 4.96 0.00 1.98 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 2.34 2.58 0.00 94 I 9.29 4.70 1.77 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.52 0.88 0.00 0.00 95 T 8.39 4.74 4.29 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 1.26 0.00 0.00 96 P 0.00 4.52 0.00 2.04 2.04 0.00 3.76 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.36 0.00 97 P 0.00 4.90 0.00 2.07 2.02 0.00 3.80 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 1.99 1.95 0.00 98 V 8.53 4.77 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 0.86 0.00 0.00 0.91 0.00 0.00 99 V 8.88 4.86 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 0.91 0.00 0.00 0.76 0.00 0.00 100 L 9.11 5.59 0.00 1.76 1.60 1.04 0.73 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 0.00 101 R 9.36 5.00 0.00 1.89 2.02 0.00 2.89 0.00 0.00 3.11 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.56 0.00 102 L 8.26 4.71 0.00 1.80 1.61 1.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 103 K 8.52 4.29 0.00 1.87 1.81 0.00 2.05 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.46 1.40 7.81 104 C 8.43 4.57 0.00 3.03 2.79 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 0.00 105 G 9.09 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 0.00 0.00 0.00 106 S 8.35 4.09 0.00 4.04 4.13 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 0.00 107 G 8.35 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 0.00 108 P 0.00 4.85 0.00 2.04 2.20 0.00 3.71 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.92 0.00 109 V 8.53 4.64 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 0.96 0.00 0.00 0.84 0.00 0.00 110 H 9.64 5.34 0.00 3.05 3.08 0.00 5.61 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 I 8.33 5.03 1.80 0.00 0.00 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 1.27 0.85 0.97 0.00 0.00 112 S 9.50 5.08 0.00 3.81 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 G 7.27 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 0.00 0.00 0.00 114 Q 8.10 5.09 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.69 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 115 H 9.42 5.09 0.00 3.39 3.58 0.00 5.77 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 L 8.89 4.87 0.00 1.74 1.58 0.98 0.63 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 0.00 117 V 8.82 4.69 2.20 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 0.68 0.00 0.00 0.96 0.00 0.00 118 A 8.44 4.23 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 * Residues marked with a * may have inaccurate shift predictions.