NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 25 G 3.8173 8.3393 109.7375 45.3802 0.0000 173.8655 26 S 4.2236 8.4914 122.4725 56.3252 62.4741 171.9898 27 G 4.3235 9.0514 114.7469 43.7392 0.0000 171.7680 28 K 4.5093 8.0970 117.0341 54.8034 36.0055 176.6269 29 V 4.0105 8.3375 122.5078 62.3157 31.2223 175.6150 30 V 4.3121 8.2677 127.3037 63.4022 32.8739 175.1679 31 K 5.2295 7.8903 117.8083 55.7918 36.1195 175.0847 32 F 4.9270 8.0323 116.4581 56.1194 41.6179 172.9161 33 S 4.8030 8.7677 115.9471 56.8703 65.7184 172.5863 34 Y 4.5410 8.8295 126.5308 55.9091 40.7305 173.6847 35 M 5.1706 8.1457 126.3016 53.6352 34.4879 174.5971 36 W 5.1798 9.6026 135.0000 56.0585 34.1871 173.5397 37 T 4.9131 8.9618 123.6323 61.8487 70.3757 173.7775 38 I 4.2481 8.5013 128.0315 59.5345 38.6040 175.2246 39 N 4.6695 8.8133 124.6194 52.8105 39.7620 174.6981 40 N 4.7324 8.5482 115.0809 52.6473 36.6388 176.0446 41 F 4.2171 8.3449 121.5316 61.6598 39.8441 177.1441 42 S 4.1562 8.1190 115.2545 60.8349 62.7046 175.3300 43 F 4.5193 8.3273 118.5792 59.5396 38.8843 176.2762 44 C 4.4328 7.5248 118.5409 59.7931 25.7883 172.9683 45 R 4.3291 8.0784 120.1925 55.5950 30.0745 176.7178 46 E 3.9747 8.2167 119.9330 57.8603 30.0174 177.6902 47 E 4.3640 9.0125 119.0091 54.3571 31.0493 173.3522 48 M 4.5417 7.8948 115.6948 58.2217 32.1122 176.6637 49 G 4.0029 9.7560 116.0022 44.4843 0.0000 172.8261 50 E 4.4453 8.2439 120.7266 55.1917 30.7034 175.2730 51 V 4.9267 8.0471 122.1244 60.0138 35.3027 174.5464 52 I 4.6925 9.1389 124.7120 60.3156 39.7579 175.6129 53 K 5.1559 8.9439 130.6478 53.8672 33.6908 172.7737 54 S 4.3167 8.0568 118.2907 56.3138 64.8281 173.8271 55 S 4.3666 8.2110 114.8106 58.2216 63.5562 173.5539 56 T 4.4569 8.1301 118.0110 63.0632 69.0815 174.4037 57 F 5.1760 8.8801 120.8139 54.9583 41.3555 174.0111 58 S 5.3937 8.7879 114.5807 56.6443 65.9734 173.1756 59 S 4.6051 9.0584 115.4890 56.6717 66.3203 173.6343 60 G 4.3373 8.7255 110.0195 44.4721 0.0000 173.0699 61 A 3.7935 8.4239 120.4292 52.3581 17.0233 179.2950 *64 K 4.3821 7.8855 113.3030 55.8793 33.9771 175.9831 65 L 4.6341 7.6406 119.1816 52.9219 44.0130 175.4408 66 K 4.7417 8.2248 122.1700 54.3817 35.4089 175.3110 67 W 5.4509 8.8911 123.3888 55.4366 34.1678 173.4310 68 C 4.7343 8.6156 114.3628 57.4675 32.8275 172.8825 69 L 5.3949 8.6791 119.7863 53.4429 44.7391 175.9713 70 R 5.4127 9.1972 119.7578 54.8016 34.4450 174.6456 71 V 5.0620 9.3285 123.2698 60.0950 35.1665 174.6450 72 N 5.2103 9.2940 121.5547 50.9910 39.0611 173.3192 73 P 4.4910 0.0000 0.0000 64.9376 31.7408 177.6369 74 K 4.5823 8.0594 117.1033 55.7954 33.1487 176.7052 75 G 4.2950 8.1317 103.2872 45.9755 0.0000 175.2180 76 L 3.9128 8.5160 121.9051 57.0823 42.7276 175.9236 77 D 4.6519 8.2990 118.6546 52.5976 42.7616 175.9873 78 E 3.9845 9.1099 114.2425 59.3287 29.4946 175.2535 79 E 4.0491 7.7609 119.0085 58.3885 29.7210 177.6253 80 S 4.9632 8.4904 112.9067 57.4646 63.4582 175.9400 81 K 3.8737 8.2622 123.3231 60.7979 32.1886 177.1062 82 D 4.7359 8.3012 116.6694 54.0837 41.1044 174.7492 83 Y 5.2266 8.2880 117.7800 56.0752 42.1286 174.0231 84 L 4.9515 8.8642 122.9832 53.9782 44.2808 175.1771 85 S 5.3131 8.9587 122.0545 56.8238 65.6277 172.8053 86 L 4.9299 8.5008 125.8207 53.3794 44.8744 174.7615 87 Y 5.2148 9.0954 123.0455 56.1326 42.8861 173.8483 88 L 4.7685 9.5078 124.7618 53.4884 44.3896 174.6402 89 L 5.2259 9.1521 129.1526 53.3185 44.8468 174.8867 90 L 3.8932 8.7385 128.7722 54.0179 42.2298 177.1015 91 V 3.6810 8.3455 128.6961 65.6671 32.0731 176.3487 92 S 4.7083 7.2976 112.7031 57.5097 65.9453 173.3044 93 C 4.8086 8.1477 115.1832 56.0049 32.2881 172.3910 94 P 4.3308 0.0000 0.0000 65.0548 31.6304 176.3720 95 K 4.7099 7.4751 118.7937 55.1592 33.8538 175.8111 96 S 4.3053 8.6776 113.9499 61.7530 63.5199 173.0835 97 E 4.9136 7.6249 116.4430 55.5053 32.7782 174.4814 98 V 4.7545 9.0980 118.6404 61.5638 35.4858 173.5679 99 R 5.4931 8.9762 126.1073 54.6647 32.5907 174.9811 100 A 5.2011 9.3952 123.9269 50.9232 23.3751 175.0270 101 K 4.9440 8.9770 120.2330 54.9962 34.8102 175.7111 102 F 5.2402 8.2832 117.4960 55.4145 42.1078 173.1659 103 K 5.1086 8.7907 120.2227 55.0700 35.6459 174.7553 104 F 5.6612 9.5268 126.1266 56.1734 42.1029 174.6897 105 S 5.5588 9.2978 115.7709 57.9960 67.2395 172.5729 106 I 5.0486 8.9803 120.4828 59.5604 40.0926 174.9762 107 L 5.0163 8.4911 126.5973 53.5815 42.8645 176.9552 108 N 4.7276 8.9978 122.3467 51.5274 39.5871 175.2005 109 A 3.8906 8.3146 120.5258 55.7524 18.2600 179.0402 110 K 4.1188 8.1157 112.0290 56.7238 32.1187 178.1927 111 G 3.8532 8.2413 107.8184 45.3814 0.0000 173.8699 112 E 4.3080 7.7961 119.0413 55.3002 30.7286 175.3914 113 E 4.7295 8.3102 120.0934 56.3842 30.6777 176.0826 114 T 4.5489 8.7356 115.3906 61.6153 70.7394 172.8847 115 K 3.8364 8.5676 120.8219 57.2776 29.6283 175.6956 116 A 4.8183 7.9618 118.7171 52.3264 19.6702 178.0447 117 M 4.8726 9.4910 120.3639 53.5171 36.3166 174.2744 118 E 5.4107 8.7309 120.2232 54.1239 33.1873 175.6252 119 S 4.1469 8.6399 117.1365 58.2513 63.6141 174.4899 120 Q 4.0554 9.0260 124.4100 58.2475 28.6847 175.8832 121 R 4.5622 7.5717 111.1367 53.8026 32.2677 174.3314 122 A 4.6245 8.0506 118.7694 51.7590 19.9869 176.5334 123 Y 4.2269 9.0954 117.3788 55.8688 41.9357 175.4189 124 R 4.9224 8.4700 122.5580 55.8550 30.4810 175.4711 125 F 5.0555 9.9340 126.4730 56.5968 41.4509 175.6452 126 V 4.9148 8.1685 113.5228 59.1890 36.7343 174.7975 127 Q 4.1507 8.5861 120.8742 58.3918 28.4581 177.5025 128 G 3.8635 9.3710 112.6565 44.6647 0.0000 172.3723 129 K 4.5700 7.9273 121.5468 54.5285 34.5255 174.6354 130 D 5.6263 8.1269 124.2075 51.5732 42.9440 174.5051 131 W 5.2413 9.2337 117.4916 55.1294 33.8160 176.0152 132 G 3.5233 7.7744 107.2561 46.1876 0.0000 171.3410 133 F 4.8815 7.3486 120.2196 55.3423 40.7395 176.4433 134 K 4.0990 8.8671 127.1061 58.0644 32.6377 177.0323 135 K 4.5488 7.5544 116.6362 54.5298 31.9350 175.2481 136 F 4.4608 8.8806 123.6505 60.7931 40.3545 175.4524 137 I 4.2907 7.4238 117.2822 58.5502 40.7435 173.3005 138 R 4.0734 8.2405 126.2414 55.7805 31.5771 178.1370 139 R 4.0112 8.6435 123.3748 59.4989 30.1438 179.2504 140 D 4.3492 8.0157 118.3997 56.2849 39.3694 178.3259 141 F 4.1704 8.1019 121.7580 60.9562 39.2995 176.7087 142 L 3.7316 7.7185 118.9483 58.0927 42.1715 178.7147 143 L 4.1355 8.1281 119.0094 57.9178 41.3662 179.1491 144 D 4.3794 8.2285 118.1464 56.7515 40.9474 177.6801 145 E 4.3848 7.6180 117.4522 56.1087 30.0844 177.7717 146 A 3.9242 7.6144 124.6727 55.6724 18.0363 180.0964 147 N 4.2802 8.1307 113.2569 56.5232 38.9348 177.1810 148 G 3.7098 7.8716 105.9874 46.9900 0.0000 175.0777 149 L 4.3740 8.1848 118.8547 54.5485 43.3978 176.6466 150 L 5.1701 8.2436 118.7901 51.2671 42.6018 175.0385 151 P 4.3559 0.0000 0.0000 64.4133 31.9079 176.6832 152 D 4.1825 9.4080 120.6374 54.8767 38.5675 172.7777 153 D 4.4478 8.3421 116.4197 55.5390 40.0992 172.7418 154 K 4.9606 7.8915 116.3065 54.0715 35.3228 175.2238 155 L 4.4613 8.7236 127.6413 53.7815 43.9018 175.0300 156 T 4.9090 8.3174 123.5811 62.0676 70.5829 173.5572 157 L 5.2882 9.3203 127.8521 53.0147 44.8439 175.3636 158 F 5.5599 9.4039 124.4235 56.6626 42.6409 173.2890 159 C 4.9685 8.8812 125.9797 57.6976 34.5394 172.1338 160 E 4.5745 8.6860 126.9791 54.5082 31.4247 175.3450 161 V 4.4696 7.7874 124.8644 60.8948 34.6940 174.7250 162 S 4.5422 8.9477 122.6095 56.6784 65.6871 173.4601 163 V 4.4427 8.4790 126.5309 62.4583 31.2719 176.1076 164 V 4.3163 8.5774 121.3692 61.5847 32.8870 176.1609 165 Q 4.5291 7.8137 119.8880 55.3707 32.4986 173.6858 166 D 4.5922 8.8279 125.0957 54.5242 41.1978 176.2086 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 25 G 8.34 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 0.00 0.00 0.00 26 S 8.49 4.22 0.00 4.08 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 27 G 9.05 4.32 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 0.00 28 K 8.10 4.51 0.00 2.00 1.71 0.00 1.86 0.00 0.00 1.63 0.00 0.00 2.80 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.34 0.99 7.81 29 V 8.34 4.01 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 0.90 0.00 0.00 1.01 0.00 0.00 30 V 8.27 4.31 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 1.02 0.00 0.00 31 K 7.89 5.23 0.00 1.63 1.57 0.00 1.82 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.27 1.42 7.81 32 F 8.03 4.93 0.00 3.08 3.12 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 0.00 0.00 0.00 33 S 8.77 4.80 0.00 3.71 3.13 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 34 Y 8.83 4.54 0.00 2.46 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 35 M 8.15 5.17 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.53 0.00 36 W 9.60 5.18 0.00 3.32 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 37 T 8.96 4.91 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 1.16 0.00 0.00 38 I 8.50 4.25 1.67 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 -0.30 0.99 0.00 0.00 39 N 8.81 4.67 0.00 2.62 2.72 0.00 0.00 7.38 8.00 0.00 0.00 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 N 8.55 4.73 0.00 2.69 2.18 0.00 0.00 7.22 8.13 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 41 F 8.34 4.22 0.00 3.02 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 42 S 8.12 4.16 0.00 4.07 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 43 F 8.33 4.52 0.00 3.09 3.08 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 44 C 7.52 4.43 0.00 2.71 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 45 R 8.08 4.33 0.00 1.75 1.90 0.00 3.35 0.00 0.00 3.35 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.50 0.00 46 E 8.22 3.97 0.00 1.95 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 2.37 2.59 0.00 47 E 9.01 4.36 0.00 1.91 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.11 0.00 48 M 7.89 4.54 0.00 1.99 2.10 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 2.66 2.59 0.00 49 G 9.76 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 0.00 0.00 0.00 50 E 8.24 4.45 0.00 2.14 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 2.31 2.26 0.00 51 V 8.05 4.93 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 0.85 0.00 0.00 1.10 0.00 0.00 52 I 9.14 4.69 2.13 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.81 1.26 0.00 0.00 53 K 8.94 5.16 0.00 1.53 1.58 0.00 1.79 0.00 0.00 1.76 0.00 0.00 2.86 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.28 0.99 7.81 54 S 8.06 4.32 0.00 2.72 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.21 4.37 0.00 4.03 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 56 T 8.13 4.46 4.17 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 1.05 0.00 0.00 57 F 8.88 5.18 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 58 S 8.79 5.39 0.00 3.86 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 59 S 9.06 4.61 0.00 3.71 3.02 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 0.00 0.00 0.00 60 G 8.73 4.34 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 0.00 0.00 0.00 61 A 8.42 3.79 1.44 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 *64 K 7.89 4.38 0.00 1.67 1.89 0.00 1.95 0.00 0.00 1.71 0.00 0.00 2.73 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.48 7.81 65 L 7.64 4.63 0.00 1.64 1.03 1.20 0.78 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 66 K 8.22 4.74 0.00 1.39 1.41 0.00 1.47 0.00 0.00 1.53 0.00 0.00 2.74 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.18 1.20 7.81 67 W 8.89 5.45 0.00 1.78 2.67 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 68 C 8.62 4.73 0.00 2.84 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 69 L 8.68 5.39 0.00 1.36 1.90 1.55 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 70 R 9.20 5.41 0.00 1.88 1.90 0.00 3.06 0.00 0.00 3.36 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 71 V 9.33 5.06 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 1.03 0.00 0.00 1.06 0.00 0.00 72 N 9.29 5.21 0.00 2.86 3.02 0.00 0.00 6.90 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 73 P 0.00 4.49 0.00 2.03 2.06 0.00 3.69 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.27 0.00 74 K 8.06 4.58 0.00 1.94 1.79 0.00 1.93 0.00 0.00 1.81 0.00 0.00 2.88 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.39 7.81 75 G 8.13 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 0.00 0.00 0.00 0.00 76 L 8.52 3.91 0.00 1.93 1.79 0.90 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 77 D 8.30 4.65 0.00 2.95 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 78 E 9.11 3.98 0.00 1.91 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 2.32 1.89 0.00 79 E 7.76 4.05 0.00 1.96 2.33 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 2.33 2.29 0.00 80 S 8.49 4.96 0.00 4.21 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 81 K 8.26 3.87 0.00 1.94 2.13 0.00 1.64 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.71 1.52 7.81 82 D 8.30 4.74 0.00 2.63 2.56 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 0.00 0.00 0.00 0.00 83 Y 8.29 5.23 0.00 3.03 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 84 L 8.86 4.95 0.00 1.93 1.88 1.04 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 85 S 8.96 5.31 0.00 4.21 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 86 L 8.50 4.93 0.00 1.26 0.73 0.73 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 87 Y 9.10 5.21 0.00 2.87 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 88 L 9.51 4.77 0.00 1.73 1.55 0.92 0.13 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 89 L 9.15 5.23 0.00 1.81 1.67 0.95 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 90 L 8.74 3.89 0.00 1.67 1.73 -0.42 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 91 V 8.35 3.68 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 0.68 0.00 0.00 0.73 0.00 0.00 92 S 7.30 4.71 0.00 3.75 3.75 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 93 C 8.15 4.81 0.00 2.92 2.64 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 0.00 0.00 0.00 0.00 94 P 0.00 4.33 0.00 2.17 2.19 0.00 3.67 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.96 0.00 95 K 7.48 4.71 0.00 1.75 1.78 0.00 1.86 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.36 1.39 7.81 96 S 8.68 4.31 0.00 3.98 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 97 E 7.62 4.91 0.00 2.16 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 2.22 2.37 0.00 98 V 9.10 4.75 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 1.04 0.00 0.00 0.85 0.00 0.00 99 R 8.98 5.49 0.00 1.90 1.90 0.00 3.23 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 100 A 9.40 5.20 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 0.00 101 K 8.98 4.94 0.00 1.67 1.62 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.48 1.35 7.81 102 F 8.28 5.24 0.00 2.58 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 0.00 103 K 8.79 5.11 0.00 1.78 1.56 0.00 1.60 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.55 7.81 104 F 9.53 5.66 0.00 3.06 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 0.00 0.00 0.00 0.00 105 S 9.30 5.56 0.00 4.19 4.17 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 0.00 106 I 8.98 5.05 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 1.39 1.30 0.90 0.00 0.00 107 L 8.49 5.02 0.00 1.47 1.50 0.64 0.61 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 0.00 108 N 9.00 4.73 0.00 2.98 2.96 0.00 0.00 6.44 6.90 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 0.00 109 A 8.31 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 0.00 110 K 8.12 4.12 0.00 2.09 1.83 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.35 7.81 111 G 8.24 3.85 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 0.00 0.00 0.00 112 E 7.80 4.31 0.00 2.02 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 2.34 2.44 0.00 113 E 8.31 4.73 0.00 1.97 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 2.19 0.00 114 T 8.74 4.55 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 1.30 0.00 0.00 115 K 8.57 3.84 0.00 1.89 1.55 0.00 1.60 0.00 0.00 1.61 0.00 0.00 2.67 0.00 0.00 2.49 0.00 0.00 0.00 0.00 1.41 1.40 7.81 116 A 7.96 4.82 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 0.00 117 M 9.49 4.87 0.00 0.51 1.55 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.19 0.00 118 E 8.73 5.41 0.00 1.89 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 2.28 0.00 119 S 8.64 4.15 0.00 3.58 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 Q 9.03 4.06 0.00 2.07 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.78 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 121 R 7.57 4.56 0.00 1.66 1.78 0.00 2.71 0.00 0.00 3.01 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.86 0.00 122 A 8.05 4.62 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 0.00 123 Y 9.10 4.23 0.00 2.56 1.61 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 0.00 124 R 8.47 4.92 0.00 1.89 2.00 0.00 3.28 0.00 0.00 3.31 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.78 0.00 125 F 9.93 5.06 0.00 3.23 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 0.00 126 V 8.17 4.91 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 1.00 0.00 0.00 0.93 0.00 0.00 127 Q 8.59 4.15 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.60 0.00 0.00 0.00 0.00 0.00 2.37 2.25 0.00 128 G 9.37 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 0.00 0.00 0.00 129 K 7.93 4.57 0.00 1.73 1.66 0.00 1.43 0.00 0.00 1.38 0.00 0.00 2.65 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.75 1.00 7.81 130 D 8.13 5.63 0.00 2.85 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 0.00 131 W 9.23 5.24 0.00 2.98 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 0.00 132 G 7.77 3.52 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 0.00 133 F 7.35 4.88 0.00 3.12 3.02 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 0.00 0.00 0.00 134 K 8.87 4.10 0.00 1.86 1.90 0.00 1.95 0.00 0.00 2.49 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.59 7.81 135 K 7.55 4.55 0.00 1.33 0.74 0.00 1.40 0.00 0.00 0.75 0.00 0.00 2.98 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.59 1.10 7.81 136 F 8.88 4.46 0.00 2.95 3.33 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 0.00 137 I 7.42 4.29 1.33 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.85 0.96 0.00 0.00 138 R 8.24 4.07 0.00 1.79 1.65 0.00 2.74 0.00 0.00 3.13 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 1.46 0.00 139 R 8.64 4.01 0.00 1.84 2.01 0.00 3.40 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.71 0.00 140 D 8.02 4.35 0.00 2.95 2.92 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 0.00 141 F 8.10 4.17 0.00 3.07 3.24 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 0.00 142 L 7.72 3.73 0.00 1.82 1.90 0.78 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 143 L 8.13 4.14 0.00 1.91 1.69 0.99 1.08 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 0.00 144 D 8.23 4.38 0.00 2.55 2.67 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 0.00 145 E 7.62 4.38 0.00 1.50 1.65 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 1.55 1.66 0.00 146 A 7.61 3.92 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 0.00 147 N 8.13 4.28 0.00 2.65 2.87 0.00 0.00 6.84 7.65 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 0.00 148 G 7.87 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 0.00 149 L 8.18 4.37 0.00 1.40 1.60 0.65 0.86 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 0.00 150 L 8.24 5.17 0.00 1.73 1.53 1.07 0.99 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 0.00 151 P 0.00 4.36 0.00 2.17 2.16 0.00 3.99 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.94 0.00 152 D 9.41 4.18 0.00 2.80 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 0.00 153 D 8.34 4.45 0.00 2.82 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 0.00 154 K 7.89 4.96 0.00 1.81 1.61 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.80 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.49 7.81 155 L 8.72 4.46 0.00 1.09 1.09 0.65 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 156 T 8.32 4.91 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 0.00 157 L 9.32 5.29 0.00 1.71 1.72 0.71 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 158 F 9.40 5.56 0.00 3.05 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 0.00 159 C 8.88 4.97 0.00 3.14 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 0.00 160 E 8.69 4.57 0.00 1.71 1.58 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 1.47 1.80 0.00 161 V 7.79 4.47 0.67 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 0.34 0.00 0.00 0.23 0.00 0.00 162 S 8.95 4.54 0.00 3.65 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 0.00 163 V 8.48 4.44 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 0.91 0.00 0.00 1.20 0.00 0.00 164 V 8.58 4.32 2.11 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 0.70 0.00 0.00 1.02 0.00 0.00 165 Q 7.81 4.53 0.00 2.13 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.87 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 166 D 8.83 4.59 0.00 2.73 2.56 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 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.