NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 23 A 4.1819 8.1233 122.4614 51.0404 21.7344 175.8410 24 F 4.9607 8.3850 113.6227 55.4304 39.5662 172.9484 25 I 4.4724 8.4970 127.1795 60.3735 40.8367 176.7069 26 G 4.0430 8.8508 111.4885 46.1355 0.0000 175.3139 27 V 3.5850 7.5452 120.0894 64.7105 31.8135 176.7758 28 D 4.7843 7.8881 117.8696 54.3202 40.9692 176.8630 29 S 4.4053 7.5081 115.9427 57.4111 64.7409 174.8641 30 A 3.9544 8.4087 123.0396 55.4350 18.0762 179.7486 31 A 3.4987 7.2941 118.7541 54.8194 18.2347 179.8645 32 G 3.6138 7.6213 105.6560 47.4979 0.0000 175.7144 33 N 4.3671 8.3606 118.8535 55.9697 38.4992 177.7577 34 V 3.6756 7.4378 118.8725 65.7786 31.5837 178.2626 35 V 3.6482 7.8437 118.0799 65.8677 31.3100 178.1313 36 K 3.9899 8.2866 118.2954 59.8051 31.9218 179.2828 37 Q 4.0792 8.1850 118.1760 58.8933 28.4985 179.0307 38 F 4.3674 8.4903 121.5932 61.6782 39.5492 176.7388 39 H 3.9867 8.4304 115.6355 59.0311 28.3686 177.6146 40 A 3.9995 8.2121 121.0207 55.1521 18.4761 179.2249 41 A 4.1069 8.3027 119.4172 55.1679 18.2280 179.8618 42 L 3.9544 7.7553 116.6747 57.9344 41.7290 179.8152 43 Q 4.1066 7.6718 114.3441 56.5017 27.8311 176.8518 *45 G 3.6663 7.8986 105.0933 45.4582 0.0000 173.8062 46 N 4.7137 8.3604 121.0949 51.6045 38.4378 174.9138 47 E 4.0511 8.6405 126.1597 58.9882 29.7369 178.7624 48 A 4.0289 8.1060 120.4552 55.3058 18.2658 179.6802 49 I 3.7317 7.7096 116.5324 64.4695 37.6589 178.2761 50 V 4.0443 7.8508 119.1567 66.5403 30.8539 178.3472 51 R 4.0752 8.4927 117.7606 59.2158 29.6563 178.7120 52 Q 4.2061 7.8042 115.9386 57.9463 29.0960 177.8723 53 S 4.3604 8.0666 116.0807 59.0204 63.1839 173.7451 54 L 4.8077 6.7591 121.2847 52.3626 43.4531 176.4250 55 A 4.1107 8.5710 125.9002 51.8274 19.1748 178.4118 56 A 4.0829 8.7280 123.2590 54.7553 18.5310 178.6179 57 N 5.3749 7.7285 112.4068 52.1923 37.7479 175.9587 58 V 3.8582 7.5867 118.6085 63.3182 32.3016 174.8691 59 Q 4.8055 8.7963 124.1882 54.4754 31.5663 174.0702 60 I 4.5813 8.6460 126.6994 59.7000 40.3643 173.8504 61 Y 5.2037 9.0137 126.0877 56.3817 40.1009 174.6826 62 E 4.9611 9.4795 123.7103 55.8276 34.0066 175.3385 63 G 4.0532 9.9283 114.9219 46.7305 0.0000 174.5144 64 G 3.8786 8.4940 106.1018 44.9507 0.0000 174.2013 65 K 4.6530 7.9970 119.3014 54.1970 34.9095 175.4290 66 V 5.0541 8.0979 119.9081 59.9746 34.0644 174.8427 67 E 4.9086 8.9820 122.6199 55.0286 31.7148 176.5112 68 R 4.8760 8.8226 119.2850 55.0811 31.7043 175.9230 69 S 4.6806 7.5019 111.6538 56.2140 66.4661 175.7506 70 L 4.0319 8.5618 125.2603 58.7099 41.8776 179.2043 71 T 3.8646 7.9494 112.5137 65.0849 67.0685 175.2933 72 E 3.9118 7.8825 119.5990 59.5273 29.8320 177.6933 73 Y 4.4301 8.2048 119.1849 61.0023 38.6549 178.2075 74 A 3.8455 8.5328 120.3943 54.9174 18.5197 178.8470 75 N 4.4463 7.9880 114.9238 57.0087 39.3401 174.1604 76 H 4.9465 8.0893 119.0322 57.5744 36.1892 175.7358 77 H 4.3876 8.0803 118.7854 56.1849 29.6463 177.1597 *79 L 4.1776 8.0504 118.8322 54.2822 43.6878 178.4483 80 A 4.1925 7.9748 121.0605 55.4267 18.5317 180.0051 81 D 4.4706 8.4147 113.0804 55.0362 39.9077 178.2779 *83 A 4.2661 8.1268 124.3647 52.5056 20.3380 179.2643 84 Y 3.7367 8.3245 116.9902 60.7080 39.0307 178.4494 85 L 3.6053 8.1602 119.3322 56.9148 41.9744 179.2378 86 K 3.8354 7.6462 118.9608 58.8988 32.2126 177.4756 87 G 3.9352 7.6746 105.3530 45.1926 0.0000 172.4864 88 L 4.9292 7.4644 121.9138 53.6585 44.5228 176.7145 89 T 4.4079 8.6613 116.6197 60.0852 70.4593 174.2224 90 I 4.4092 8.3432 128.6447 59.2993 38.5610 175.6547 91 T 4.4954 8.7147 126.1022 60.9382 70.0787 172.8409 92 P 4.6455 0.0000 0.0000 62.5563 31.3333 176.4637 93 K 4.6734 9.1500 124.2490 57.7949 33.9903 176.4564 94 E 3.7916 7.6858 115.1733 55.4909 33.1184 174.2104 95 H 5.1319 8.4647 120.1569 55.6659 33.8904 172.1950 96 Q 4.9983 9.3507 125.3491 54.1276 31.9405 174.4534 97 I 4.9742 8.5525 124.9080 59.7185 39.8822 175.2295 98 T 4.6206 8.8804 123.0654 61.7259 71.8356 172.8357 99 I 4.7983 8.3885 126.4054 59.9589 39.8360 175.9005 100 T 4.4727 9.0167 123.3327 62.2240 71.0820 176.2018 101 G 3.7993 8.3092 119.0854 47.0913 0.0000 172.0554 102 D 4.6192 8.9407 124.8934 53.8608 41.0724 174.8593 103 I 5.3117 7.9120 120.7559 59.5242 40.2551 174.5043 104 A 5.1470 9.2347 126.8277 50.1417 22.6135 174.8678 105 I 4.8006 8.7571 121.6724 59.4506 40.6963 174.4578 106 S 5.2270 9.3778 122.5042 56.5906 64.8344 172.5889 107 T 5.2613 9.1221 118.0664 59.9615 70.9439 173.1913 108 S 5.1722 9.1886 120.4848 56.5381 66.7985 173.4058 109 I 4.9065 8.5108 120.8208 59.9178 40.6658 174.8022 110 S 5.0948 9.2017 121.5432 57.1559 67.9991 172.2561 111 H 5.0157 9.3476 122.5551 55.1163 31.4049 173.5648 112 A 5.0705 9.4860 130.8030 50.9043 21.2359 175.8092 113 Q 4.7873 9.5381 122.7337 52.3484 32.3853 171.5953 114 G 4.3880 7.8860 111.6263 44.9001 0.0000 171.5643 115 E 4.9391 7.8995 121.8799 55.7829 32.5823 174.1288 116 Y 4.7021 8.3827 119.0859 57.6129 41.7120 174.2275 117 K 3.2421 7.8395 120.8896 58.4621 31.5582 175.2072 *120 S 4.2913 7.7808 112.2247 58.3582 63.6292 172.6971 121 I 4.4347 8.4737 127.1465 59.6633 39.2407 174.8679 122 D 5.0517 8.6603 127.1401 52.4759 42.3232 174.3855 123 S 4.3950 9.3595 129.7157 57.5465 67.9643 173.9136 *125 T 4.1216 8.3712 108.9038 61.2307 70.5806 171.3489 *127 E 4.7147 8.4017 120.3469 56.9014 31.2600 174.9503 128 T 5.0213 8.7875 123.5051 61.8256 71.2562 173.1496 129 L 5.0786 9.1067 126.7451 52.7998 45.0798 175.5110 130 V 4.7753 8.5002 122.8639 61.1142 34.0054 174.3231 131 L 5.4011 9.0066 127.0945 53.0347 45.6844 175.4251 132 I 5.0517 8.7899 122.7812 59.1295 40.7938 174.7029 133 K 3.4173 8.2274 129.3813 56.1049 32.3229 177.0042 134 Q 4.1839 8.7676 127.3324 54.6456 29.7443 176.9042 135 A 3.8740 8.3937 121.8183 55.1201 18.2814 178.2168 136 D 4.4925 7.9496 112.7271 53.5356 40.0054 177.3437 137 G 3.8368 8.0773 109.4264 45.1079 0.0000 174.1666 138 R 4.2596 7.9011 119.4935 55.7458 31.3778 175.8982 139 W 4.8845 8.7849 122.5979 56.1425 30.4834 175.9538 140 K 4.8399 8.7843 122.3141 54.4686 36.0780 175.6785 141 I 4.3145 8.7709 126.3384 61.7675 37.4820 176.5547 142 T 4.3228 9.1264 117.5654 62.2156 71.2206 173.8542 143 H 5.0602 7.7326 121.7654 54.5711 33.6894 171.9450 144 V 4.2924 8.3313 125.2183 61.0433 34.5931 173.4981 145 H 5.0872 8.9229 127.3540 54.3656 32.4327 171.7865 146 W 5.4899 9.0693 126.5611 55.0482 31.3444 176.6555 147 S 4.2463 8.6154 117.2872 58.8413 62.3308 173.8071 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 23 A 8.12 4.18 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 24 F 8.39 4.96 0.00 3.09 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 25 I 8.50 4.47 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.73 0.90 0.00 0.00 26 G 8.85 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 27 V 7.55 3.59 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 1.03 0.00 0.00 0.99 0.00 0.00 28 D 7.89 4.78 0.00 2.67 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 29 S 7.51 4.41 0.00 3.90 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 30 A 8.41 3.95 1.50 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 0.00 0.00 31 A 7.29 3.50 0.20 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 32 G 7.62 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 33 N 8.36 4.37 0.00 2.92 2.90 0.00 0.00 6.63 7.48 0.00 0.00 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 V 7.44 3.68 2.24 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 1.09 0.00 0.00 1.15 0.00 0.00 35 V 7.84 3.65 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 0.97 0.00 0.00 0.98 0.00 0.00 36 K 8.29 3.99 0.00 2.11 1.88 0.00 1.85 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.46 1.36 7.81 37 Q 8.18 4.08 0.00 2.36 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.82 0.00 0.00 0.00 0.00 0.00 2.43 2.51 0.00 38 F 8.49 4.37 0.00 3.15 3.34 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 0.00 0.00 0.00 0.00 39 H 8.43 3.99 0.00 3.42 3.31 0.00 5.70 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.21 4.00 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 41 A 8.30 4.11 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.76 3.95 0.00 1.54 1.58 0.51 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 43 Q 7.67 4.11 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.24 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 *45 G 7.90 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 46 N 8.36 4.71 0.00 2.71 2.76 0.00 0.00 7.28 7.35 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 47 E 8.64 4.05 0.00 2.08 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 2.41 2.39 0.00 48 A 8.11 4.03 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 49 I 7.71 3.73 1.94 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 1.45 0.80 1.00 0.00 0.00 50 V 7.85 4.04 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 1.44 0.00 0.00 1.09 0.00 0.00 51 R 8.49 4.08 0.00 2.13 2.02 0.00 3.21 0.00 0.00 3.21 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.88 0.00 52 Q 7.80 4.21 0.00 2.10 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.98 0.00 0.00 0.00 0.00 0.00 2.57 2.57 0.00 53 S 8.07 4.36 0.00 4.21 3.87 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 54 L 6.76 4.81 0.00 1.79 1.49 1.06 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.57 4.11 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 56 A 8.73 4.08 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 57 N 7.73 5.37 0.00 2.69 2.87 0.00 0.00 6.03 7.68 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 58 V 7.59 3.86 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 0.62 0.00 0.00 0.75 0.00 0.00 59 Q 8.80 4.81 0.00 2.08 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.78 0.00 0.00 0.00 0.00 0.00 2.17 2.48 0.00 60 I 8.65 4.58 1.84 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.33 0.70 0.00 0.00 61 Y 9.01 5.20 0.00 2.76 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 E 9.48 4.96 0.00 2.41 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 0.00 2.30 2.44 0.00 63 G 9.93 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 0.00 0.00 0.00 0.00 64 G 8.49 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 65 K 8.00 4.65 0.00 1.75 1.67 0.00 1.62 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.45 7.81 66 V 8.10 5.05 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 0.75 0.00 0.00 1.11 0.00 0.00 67 E 8.98 4.91 0.00 2.16 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 2.35 0.00 68 R 8.82 4.88 0.00 1.76 1.90 0.00 3.22 0.00 0.00 3.30 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 69 S 7.50 4.68 0.00 4.14 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 70 L 8.56 4.03 0.00 1.98 1.75 1.07 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 71 T 7.95 3.86 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 1.24 0.00 0.00 72 E 7.88 3.91 0.00 2.10 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 0.00 2.42 2.38 0.00 73 Y 8.20 4.43 0.00 3.11 3.17 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 74 A 8.53 3.85 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 75 N 7.99 4.45 0.00 2.94 3.01 0.00 0.00 6.91 7.93 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 76 H 8.09 4.95 0.00 3.14 3.11 0.00 5.68 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.08 4.39 0.00 3.35 3.33 0.00 5.77 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *79 L 8.05 4.18 0.00 1.71 1.76 0.91 0.84 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 80 A 7.97 4.19 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 81 D 8.41 4.47 0.00 2.72 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.13 4.27 1.50 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 0.00 0.00 84 Y 8.32 3.74 0.00 2.63 2.93 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 85 L 8.16 3.61 0.00 1.68 1.61 0.76 0.54 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 86 K 7.65 3.84 0.00 1.74 1.94 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.38 7.81 87 G 7.67 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 88 L 7.46 4.93 0.00 1.32 1.37 0.05 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 89 T 8.66 4.41 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 90 I 8.34 4.41 1.81 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.19 0.84 0.00 0.00 91 T 8.71 4.50 4.30 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 1.25 0.00 0.00 92 P 0.00 4.65 0.00 2.17 2.23 0.00 3.75 0.00 0.00 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.03 0.00 93 K 9.15 4.67 0.00 1.73 1.86 0.00 1.77 0.00 0.00 1.82 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.59 1.53 7.81 94 E 7.69 3.79 0.00 1.82 1.75 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 2.17 2.18 0.00 95 H 8.46 5.13 0.00 3.17 3.23 0.00 5.54 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 96 Q 9.35 5.00 0.00 1.96 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.53 0.00 0.00 0.00 0.00 0.00 2.19 2.21 0.00 97 I 8.55 4.97 1.92 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.39 0.77 0.00 0.00 98 T 8.88 4.62 4.21 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 1.19 0.00 0.00 99 I 8.39 4.80 1.87 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.75 1.06 0.00 0.00 100 T 9.02 4.47 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 1.23 0.00 0.00 101 G 8.31 3.80 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 0.00 0.00 0.00 102 D 8.94 4.62 0.00 2.66 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 0.00 103 I 7.91 5.31 1.94 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.98 1.01 0.00 0.00 104 A 9.23 5.15 0.65 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 0.00 0.00 105 I 8.76 4.80 1.85 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 1.10 1.07 0.89 0.00 0.00 106 S 9.38 5.23 0.00 3.82 3.70 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 0.00 107 T 9.12 5.26 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 1.20 0.00 0.00 108 S 9.19 5.17 0.00 3.83 3.62 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 0.00 109 I 8.51 4.91 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.75 0.97 0.00 0.00 110 S 9.20 5.09 0.00 3.68 3.82 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 0.00 111 H 9.35 5.02 0.00 3.17 3.18 0.00 5.56 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 0.00 112 A 9.49 5.07 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 0.00 113 Q 9.54 4.79 0.00 1.71 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.81 0.00 0.00 0.00 0.00 0.00 2.18 2.16 0.00 114 G 7.89 4.39 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 0.00 115 E 7.90 4.94 0.00 2.17 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 0.00 2.20 2.23 0.00 116 Y 8.38 4.70 0.00 2.69 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 0.00 117 K 7.84 3.24 0.00 1.73 1.72 0.00 1.72 0.00 0.00 1.45 0.00 0.00 2.50 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.30 1.17 7.81 *120 S 7.78 4.29 0.00 3.90 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 0.00 121 I 8.47 4.43 1.82 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 0.67 0.94 0.00 0.00 122 D 8.66 5.05 0.00 2.62 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 S 9.36 4.40 0.00 3.87 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *125 T 8.37 4.12 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 *127 E 8.40 4.71 0.00 2.47 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 2.39 2.54 0.00 128 T 8.79 5.02 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 0.00 129 L 9.11 5.08 0.00 1.47 1.42 1.07 0.49 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 0.00 130 V 8.50 4.78 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 1.00 0.00 0.00 0.90 0.00 0.00 131 L 9.01 5.40 0.00 1.73 1.78 0.83 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 132 I 8.79 5.05 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.86 0.84 0.00 0.00 133 K 8.23 3.42 0.00 0.79 1.04 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.94 0.54 7.81 134 Q 8.77 4.18 0.00 2.22 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.54 0.00 0.00 0.00 0.00 0.00 2.45 2.39 0.00 135 A 8.39 3.87 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 0.00 136 D 7.95 4.49 0.00 2.74 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 0.00 137 G 8.08 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 0.00 138 R 7.90 4.26 0.00 1.88 1.87 0.00 3.14 0.00 0.00 3.18 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.60 0.00 139 W 8.78 4.88 0.00 3.16 3.16 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 0.00 140 K 8.78 4.84 0.00 1.66 1.69 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.37 7.81 141 I 8.77 4.31 1.50 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.54 0.63 0.00 0.00 142 T 9.13 4.32 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 1.23 0.00 0.00 143 H 7.73 5.06 0.00 3.05 2.98 0.00 5.80 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 0.00 144 V 8.33 4.29 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 -0.85 0.00 0.00 0.40 0.00 0.00 145 H 8.92 5.09 0.00 3.09 3.03 0.00 5.62 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 W 9.07 5.49 0.00 3.40 2.93 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 0.00 147 S 8.62 4.25 0.00 3.98 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 * Residues marked with a * may have inaccurate shift predictions.