NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 G 3.8945 8.3549 109.7288 44.2878 0.0000 174.7836 4 P 3.9870 0.0000 0.0000 62.0495 32.6903 172.7950 5 E 3.9116 9.4454 125.7674 58.9103 31.1278 175.4278 6 Y 4.8521 7.6145 117.5362 57.2125 39.4293 174.4152 7 K 4.7235 9.9774 125.3909 55.5756 33.7048 176.0802 8 V 4.8660 8.9265 125.3344 61.0286 34.6127 174.1720 9 A 4.8596 8.7767 127.3682 50.1058 22.7981 174.8052 10 I 5.0336 8.2160 121.2687 59.3643 40.7520 174.2639 11 L 5.2525 8.9338 129.1369 53.7568 44.3362 174.9869 12 T 4.8383 9.1597 124.0328 62.3294 70.4931 173.9363 13 V 4.6753 8.2975 126.5003 61.2949 33.7840 174.7901 14 S 4.7920 9.0346 120.1565 57.0718 66.3051 176.8800 15 D 4.4057 9.4380 129.3747 58.0755 40.6664 179.2922 16 T 3.8893 7.8247 115.1803 66.7640 68.5563 176.7126 17 V 3.8607 8.0376 121.6447 65.6287 31.3920 178.0454 18 S 4.1015 8.2073 111.4910 60.5819 62.2771 174.9519 19 A 4.4608 7.6419 121.4256 51.4558 18.9714 177.8107 20 G 3.7982 7.9739 105.1596 45.7874 0.0000 174.7278 21 A 4.1365 7.8429 121.3199 52.9394 18.4650 177.8656 22 G 3.9277 7.3666 103.6420 44.5932 0.0000 170.9657 23 P 4.5962 0.0000 0.0000 61.2861 33.3402 174.1574 24 D 4.7751 8.4246 117.6722 53.0453 40.5929 175.7053 25 R 4.4214 8.4905 125.8484 56.6735 31.4588 178.3773 26 S 4.8139 8.1061 112.9163 59.9034 64.0126 175.8842 27 G 3.9436 10.0431 109.3276 47.8210 0.0000 173.7905 28 P 4.2689 0.0000 0.0000 65.0745 31.3327 178.6992 29 R 3.9087 7.5933 117.9226 59.0283 29.8866 178.7835 30 A 3.9840 8.0990 120.5906 55.1689 18.4023 179.6881 31 V 3.5246 8.1184 117.2815 66.1361 31.5108 178.2322 32 S 4.2711 7.8597 113.2082 60.8267 63.0375 176.5803 33 V 3.5973 7.9362 121.5652 65.7008 31.5326 177.8488 34 V 3.7374 8.0837 118.2260 66.0773 31.3180 177.5907 35 D 4.3492 8.1000 118.4616 57.5829 40.6055 178.7554 36 S 4.1892 8.3498 111.6040 60.3198 62.5594 175.0360 37 S 4.6607 7.9075 115.9942 58.3371 63.2536 175.4349 38 S 4.0922 8.0188 118.0648 62.2820 61.8552 175.0700 39 E 4.1078 8.4364 120.7780 59.5606 28.9597 178.4444 40 K 3.5164 7.9864 120.7510 59.2211 32.5653 177.7934 41 L 4.3227 8.1244 117.2325 54.5782 41.5948 177.2493 42 G 3.7606 9.2603 108.0692 45.5593 0.0000 170.3316 43 G 3.7114 10.2964 116.8705 44.9171 0.0000 173.2758 44 A 5.1388 8.5466 126.9591 50.7116 22.7203 174.9412 45 K 4.5880 8.7284 119.5181 55.2191 36.3432 174.9695 46 V 4.5178 7.7279 125.5092 62.3101 31.7308 175.9310 47 V 4.3758 8.2009 120.4034 60.9254 32.7400 175.4847 48 A 4.5744 7.3236 120.6397 51.5583 22.1298 175.4095 49 T 5.6962 8.6587 108.2133 60.5178 72.3976 172.2615 50 A 4.8281 8.6367 122.5251 51.1646 23.2385 174.9581 51 V 4.9212 8.2553 117.9880 61.4527 34.4446 174.9917 52 V 4.7075 8.7140 119.6880 58.7502 36.3894 173.3018 53 P 4.6541 0.0000 0.0000 62.3983 32.7336 177.0731 54 D 4.7736 9.2527 121.0189 53.1802 38.8904 175.2243 55 E 4.6344 7.8686 119.3727 53.5050 34.1362 176.7586 56 V 3.6253 8.7130 117.4295 64.7441 31.6181 178.4921 57 E 3.8413 8.1044 117.5847 59.4765 29.0912 179.5019 58 R 3.8815 7.8415 117.5723 59.2336 30.1987 179.1004 59 I 3.6462 7.5446 119.1987 64.0754 37.0569 178.2376 60 K 3.7971 8.7290 120.5870 59.8084 31.8707 178.5694 61 D 4.3305 8.0318 118.6134 57.7077 40.7437 179.2441 62 I 3.1905 7.1413 119.5440 64.3146 36.8773 178.5146 63 L 4.0141 7.8107 119.6032 57.7393 41.0779 179.7279 64 Q 3.9798 8.2626 118.4374 58.7763 28.6842 178.1658 65 K 4.1065 8.1376 120.7707 59.8047 31.7584 178.7139 66 W 4.6549 8.6021 118.8741 59.0873 28.7368 178.8176 67 S 4.3303 7.5445 116.0343 60.6742 62.8748 175.9278 68 D 4.5736 9.0893 120.4893 55.6658 40.7820 177.3816 69 V 4.1975 7.9440 117.6045 64.4279 32.8807 176.3882 70 D 4.5197 8.2318 116.1656 54.1324 41.3088 174.5455 71 E 3.6138 7.3505 120.4423 56.6940 29.6292 174.1866 *73 D 4.7832 8.3564 119.8148 53.8516 44.1191 175.3251 74 L 5.0481 7.9631 119.7394 53.4045 45.7946 175.1828 75 I 5.0950 8.9321 127.0776 59.5745 40.3225 174.4123 76 L 5.2755 8.8948 127.1568 53.1640 44.3941 175.6225 77 T 5.2266 8.6181 112.6403 59.9155 72.1819 172.9062 78 L 4.8714 8.9283 122.9335 54.3759 44.8577 177.4450 79 G 4.1124 9.0194 109.1292 46.5220 0.0000 172.6999 80 G 4.2530 8.9545 104.3025 46.6603 0.0000 174.9703 81 T 4.4498 7.9164 107.6280 60.9832 69.9038 174.5458 82 G 4.4875 7.6733 113.0992 45.4110 0.0000 173.5767 83 F 4.5072 8.8957 117.3277 57.9900 39.9686 176.4284 84 T 4.0387 7.8735 118.4589 63.2078 68.7006 173.4560 85 P 4.2931 0.0000 0.0000 65.2481 31.5736 177.9106 86 R 4.0363 7.8589 115.7193 57.8853 30.5982 176.1326 87 D 4.5231 8.1956 118.2856 54.7355 40.0405 176.4307 88 V 4.9689 7.9187 117.5152 59.9136 32.8776 178.7539 89 T 3.8760 8.5771 119.8832 66.4396 68.2358 174.9212 90 P 4.3411 0.0000 0.0000 65.5763 30.9431 178.5578 91 E 3.9559 8.1620 116.7948 59.0674 29.1416 179.0855 92 A 4.0115 7.6198 120.2631 55.2903 18.7095 179.3880 93 T 3.9615 8.3865 114.6817 66.8699 68.3184 177.0540 94 K 4.0166 8.0617 119.2216 59.1327 32.1319 179.1288 95 K 4.1890 7.6986 116.7715 58.0774 32.0351 177.8602 96 V 4.2963 7.8273 111.2645 61.0721 33.7761 176.1271 97 I 4.2009 7.5764 112.3452 60.4915 38.6339 174.8980 98 E 4.5988 9.1269 120.1139 56.9381 31.9078 177.1031 99 R 4.6347 7.6915 117.8041 54.3032 33.7369 175.1850 100 E 4.5964 8.9456 123.6116 55.6935 31.0838 176.9155 101 T 4.6513 7.7220 110.4435 58.9356 68.4472 173.1201 102 P 4.5721 0.0000 0.0000 65.9108 31.7201 178.8241 103 G 3.6180 8.0818 105.8900 47.9167 0.0000 175.3422 104 L 4.0626 7.5302 120.0225 57.6760 41.7290 179.4961 105 L 4.1824 7.7968 117.2669 57.4028 41.6805 178.8451 106 F 4.2231 8.2234 120.4184 60.4921 40.9790 177.2667 107 V 3.9870 8.1768 120.4987 62.9337 28.0177 175.4921 *110 Q 4.0747 7.9464 123.5686 55.5852 31.3216 176.9545 111 E 4.0156 8.0742 117.1339 59.5755 29.5085 179.6829 112 S 4.4389 7.9829 113.4090 60.9982 63.0913 175.8544 113 L 4.4801 7.3476 122.6347 56.0206 41.4072 178.4994 114 K 4.2024 8.2275 117.9926 57.8471 32.2498 178.3958 115 I 4.1179 7.4160 119.7732 62.6998 38.0264 175.6814 116 T 4.5913 6.7489 110.9403 60.3714 69.6906 172.2776 117 P 4.1796 0.0000 0.0000 65.2106 31.5301 178.6346 118 F 3.9818 8.1898 116.1222 59.2731 39.5750 176.0133 119 A 4.2217 7.4525 126.1601 52.0478 16.4950 178.5946 *121 L 4.1664 7.5657 119.7648 53.9935 44.1232 178.2539 122 S 4.3604 7.9740 114.2858 58.4987 62.6882 174.0604 123 R 4.7151 8.5334 126.8523 55.5191 30.6129 176.3190 124 S 4.2733 8.0685 113.6408 59.5880 63.5325 174.1816 125 A 4.9004 8.4030 123.9514 50.6125 22.2554 174.5484 126 A 4.8518 7.3935 118.2377 50.7731 22.8620 176.0404 127 G 4.1452 8.0139 107.0801 47.4366 0.0000 171.0362 128 I 5.0571 8.2596 120.8106 59.6152 39.6892 175.4417 129 R 4.6245 8.9163 126.3570 55.5696 33.1562 175.7269 130 G 4.0103 9.4528 116.9889 46.8484 0.0000 174.3391 131 S 4.7106 9.1825 112.4088 57.9331 63.8099 173.4349 132 T 4.6506 8.3362 118.7439 62.7910 70.2047 173.7979 133 L 4.2931 8.7394 129.6099 54.7376 43.5436 175.3478 134 I 5.0502 8.9541 127.3066 59.5955 40.4628 174.5991 135 I 4.8414 8.4468 126.6378 59.6726 40.6255 175.4249 136 N 5.5817 8.7855 124.8891 51.2622 40.0536 172.7586 *138 P 4.2196 0.0000 0.0000 62.1236 32.4313 177.4414 139 G 3.8521 8.7799 109.6542 48.6058 0.0000 174.2215 140 N 4.4124 8.1272 117.0014 52.8102 39.0618 174.2675 141 P 4.3225 0.0000 0.0000 65.4731 31.8737 177.4878 142 N 4.5174 8.1117 114.4934 55.0172 39.3848 176.8898 143 A 3.9833 7.8198 120.6222 55.4732 18.1435 179.8654 144 V 3.5520 7.7864 114.2360 65.8222 31.6254 177.7402 145 A 4.1352 7.7023 120.0394 55.2285 18.5026 179.1967 146 E 4.1441 8.0806 116.6655 59.5434 29.3540 179.8824 147 C 4.4458 8.2532 114.6538 60.3396 27.8018 175.2125 *149 E 4.1868 8.1965 123.3021 56.1619 30.9476 176.7992 150 A 4.1858 7.7483 120.7062 54.4039 18.8352 178.2286 151 L 4.3581 7.6908 115.2997 56.3074 42.1710 178.4926 152 L 3.9445 8.1350 120.2710 57.8034 41.8761 177.1508 153 P 4.3653 0.0000 0.0000 64.6211 31.5042 176.4615 154 A 4.6831 8.4891 118.4936 50.4414 20.6631 177.4736 155 L 4.0456 7.5098 118.1728 57.4644 41.9112 178.9405 156 K 3.8550 7.9089 119.4905 59.8041 32.3424 177.9645 157 H 4.1852 8.2823 117.7702 59.1516 29.4982 176.6185 158 A 3.9118 8.0486 122.0447 55.4680 18.3938 179.4330 159 L 3.8952 7.9299 117.5044 57.4059 41.2927 179.6689 160 K 4.0841 7.9331 119.0542 59.7397 32.2933 178.6871 161 Q 4.0866 8.2049 117.3366 58.6286 28.6007 177.2348 162 I 4.0982 7.2991 124.8224 61.4738 37.4139 175.4989 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 3 G 8.35 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 0.00 0.00 0.00 4 P 0.00 3.99 0.00 2.10 2.00 0.00 3.64 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 5 E 9.45 3.91 0.00 1.69 1.62 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 1.55 2.05 0.00 6 Y 7.61 4.85 0.00 3.13 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 7 K 9.98 4.72 0.00 1.66 1.67 0.00 1.58 0.00 0.00 1.53 0.00 0.00 2.74 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.37 7.81 8 V 8.93 4.87 2.15 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 0.96 0.00 0.00 0.94 0.00 0.00 9 A 8.78 4.86 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 10 I 8.22 5.03 1.91 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 1.12 0.68 0.97 0.00 0.00 11 L 8.93 5.25 0.00 1.98 1.63 0.81 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 12 T 9.16 4.84 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 1.28 0.00 0.00 13 V 8.30 4.68 2.18 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 0.79 0.00 0.00 0.93 0.00 0.00 14 S 9.03 4.79 0.00 3.89 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 15 D 9.44 4.41 0.00 2.68 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 16 T 7.82 3.89 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 17 V 8.04 3.86 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 1.14 0.00 0.00 0.94 0.00 0.00 18 S 8.21 4.10 0.00 3.89 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 19 A 7.64 4.46 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 20 G 7.97 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 21 A 7.84 4.14 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 22 G 7.37 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 23 P 0.00 4.60 0.00 2.19 2.10 0.00 3.72 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.94 0.00 24 D 8.42 4.78 0.00 2.64 2.62 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 25 R 8.49 4.42 0.00 1.91 1.94 0.00 3.16 0.00 0.00 3.39 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 26 S 8.11 4.81 0.00 4.02 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 0.00 27 G 10.04 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 28 P 0.00 4.27 0.00 2.28 2.33 0.00 3.64 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.06 0.00 29 R 7.59 3.91 0.00 2.01 2.03 0.00 3.30 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.92 0.00 30 A 8.10 3.98 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.12 3.52 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 1.04 0.00 0.00 0.93 0.00 0.00 32 S 7.86 4.27 0.00 4.10 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 0.00 33 V 7.94 3.60 2.23 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 0.82 0.00 0.00 0.94 0.00 0.00 34 V 8.08 3.74 2.23 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 0.98 0.00 0.00 1.01 0.00 0.00 35 D 8.10 4.35 0.00 2.90 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 36 S 8.35 4.19 0.00 3.82 4.11 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 37 S 7.91 4.66 0.00 4.08 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 38 S 8.02 4.09 0.00 4.00 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 39 E 8.44 4.11 0.00 2.08 1.86 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 2.39 2.43 0.00 40 K 7.99 3.52 0.00 1.80 1.90 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.49 7.81 41 L 8.12 4.32 0.00 1.89 1.76 0.93 1.02 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 42 G 9.26 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 0.00 0.00 0.00 43 G 10.30 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 44 A 8.55 5.14 1.34 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 45 K 8.73 4.59 0.00 1.80 1.58 0.00 1.61 0.00 0.00 1.55 0.00 0.00 2.77 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.37 7.81 46 V 7.73 4.52 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 0.80 0.00 0.00 0.91 0.00 0.00 47 V 8.20 4.38 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 0.71 0.00 0.00 0.78 0.00 0.00 48 A 7.32 4.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 T 8.66 5.70 4.43 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 1.21 0.00 0.00 50 A 8.64 4.83 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 51 V 8.26 4.92 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 0.96 0.00 0.00 52 V 8.71 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 0.61 0.00 0.00 0.87 0.00 0.00 53 P 0.00 4.65 0.00 2.12 2.07 0.00 3.73 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 1.96 1.98 0.00 54 D 9.25 4.77 0.00 2.59 2.83 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 0.00 0.00 0.00 55 E 7.87 4.63 0.00 1.94 1.76 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 2.28 2.31 0.00 56 V 8.71 3.63 2.06 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 0.91 0.00 0.00 0.91 0.00 0.00 57 E 8.10 3.84 0.00 1.95 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 2.38 2.33 0.00 58 R 7.84 3.88 0.00 1.91 1.92 0.00 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0.00 *138 P 0.00 4.22 0.00 2.08 2.04 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 1.94 2.11 0.00 139 G 8.78 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 0.00 140 N 8.13 4.41 0.00 2.77 2.76 0.00 0.00 7.18 8.03 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 0.00 141 P 0.00 4.32 0.00 2.04 2.12 0.00 3.67 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 2.02 2.11 0.00 142 N 8.11 4.52 0.00 2.75 2.86 0.00 0.00 7.03 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 A 7.82 3.98 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 0.00 144 V 7.79 3.55 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 0.90 0.00 0.00 0.94 0.00 0.00 145 A 7.70 4.14 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 0.00 146 E 8.08 4.14 0.00 2.03 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 2.41 2.50 0.00 147 C 8.25 4.45 0.00 3.03 2.95 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 0.00 0.00 0.00 *149 E 8.20 4.19 0.00 2.06 2.18 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 2.20 2.33 0.00 150 A 7.75 4.19 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 0.00 151 L 7.69 4.36 0.00 1.71 1.72 0.93 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 152 L 8.14 3.94 0.00 1.72 1.71 0.93 1.03 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 0.00 153 P 0.00 4.37 0.00 2.09 2.11 0.00 3.83 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 154 A 8.49 4.68 1.25 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 0.00 0.00 0.00 155 L 7.51 4.05 0.00 2.11 1.66 0.89 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 156 K 7.91 3.86 0.00 2.03 1.80 0.00 1.99 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.57 1.59 7.81 157 H 8.28 4.19 0.00 3.27 3.30 0.00 5.94 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 0.00 158 A 8.05 3.91 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 0.00 159 L 7.93 3.90 0.00 0.87 0.82 0.46 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 160 K 7.93 4.08 0.00 1.87 2.01 0.00 1.90 0.00 0.00 1.81 0.00 0.00 3.07 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.59 7.81 161 Q 8.20 4.09 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.74 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 162 I 7.30 4.10 1.97 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 1.36 0.66 0.94 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.