NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9119 8.3549 109.7364 45.7943 0.0000 173.6813 3 K 4.1358 8.4864 120.8487 55.5168 32.3139 175.2912 4 A 4.1418 7.6228 123.1084 52.4711 19.7727 177.3188 5 V 4.3779 7.6534 118.5525 60.8675 33.7357 172.3720 6 I 4.5829 8.2120 120.6336 59.1319 40.9471 174.3707 7 A 4.8055 8.3366 127.4731 50.2892 22.0503 175.2792 8 I 4.7239 8.0363 112.8549 59.2945 40.9097 174.1807 9 H 4.9305 8.2290 115.2185 54.1608 31.3314 173.0460 10 G 3.5929 8.7399 108.2041 45.1725 0.0000 173.6829 11 G 3.9634 8.7301 105.6804 45.1764 0.0000 173.5501 12 A 4.6611 8.4028 123.8360 51.1240 21.4681 176.9075 13 G 3.9339 9.0599 108.6861 45.2841 0.0000 174.1841 14 A 4.5858 7.6911 120.5653 51.7253 19.1841 176.0241 15 I 4.3320 7.5728 119.2555 60.6607 39.2701 175.2749 16 S 4.4605 8.3211 118.9854 56.1656 64.6975 173.8814 17 R 3.8598 8.9158 128.8226 59.4879 29.9177 178.3861 18 A 4.0538 8.0259 118.8495 54.6558 18.4930 177.7917 19 Q 4.5490 7.9091 112.7900 55.8295 29.0125 175.1161 20 M 5.0521 7.7443 117.0535 53.2424 35.5016 175.5305 21 S 4.8423 8.2491 115.3100 56.4105 67.0035 175.2522 22 L 4.5920 8.1379 124.7058 58.0657 41.9217 178.9663 23 Q 4.1118 8.0848 117.5332 58.9726 28.6354 178.7394 24 Q 3.9576 8.0617 118.8716 59.0090 28.9390 178.5414 25 E 4.1622 8.3086 119.5118 59.6711 29.4606 179.5154 26 L 4.0830 8.5227 119.2121 57.8304 41.6271 179.8266 27 R 4.0289 7.9894 118.0604 59.4213 29.8759 178.7369 28 Y 4.1453 7.9351 116.4829 61.1268 37.8136 178.5072 29 I 3.7965 8.1985 120.9709 64.6113 37.2670 178.3690 30 E 3.9743 8.6258 119.3924 59.2289 29.1358 179.2853 31 A 4.0742 8.2337 120.8010 55.2550 18.4457 179.6921 32 L 3.9892 8.4040 117.7881 57.9555 41.6358 179.6765 33 S 4.0708 8.4492 113.0686 61.4147 62.4728 176.0465 34 A 4.0005 8.1247 123.3713 55.2260 18.0843 179.7855 35 I 3.7373 7.6638 118.4847 64.4731 37.2366 179.0402 36 V 3.6586 8.0685 120.3131 64.8740 31.0858 178.2658 37 E 4.1542 8.4846 119.4013 59.4356 29.2800 179.4201 38 T 3.9646 7.9223 115.5358 66.5416 68.4853 176.9434 39 G 3.6119 8.0947 107.6267 47.8417 0.0000 175.6989 40 Q 3.9903 8.4335 121.0600 58.5710 28.7632 178.8381 41 K 4.1670 8.1004 121.9234 59.2338 32.2316 178.6467 42 M 4.0514 8.0892 118.8164 58.4149 31.9084 178.7201 43 L 4.0025 8.0807 119.0965 57.9857 41.4407 179.5001 44 E 4.0110 8.6407 118.5793 59.0535 29.1718 178.4968 45 A 4.3984 7.7796 118.4843 52.4657 18.8372 178.1215 46 G 3.8804 7.8162 105.7333 45.1229 0.0000 173.9411 47 E 4.2194 7.8177 118.8041 55.5556 30.2171 177.5658 48 S 4.3820 8.3292 115.4898 57.9898 65.2902 175.0213 49 A 3.9455 8.5506 125.3383 55.3561 18.1205 179.9332 50 L 3.8770 7.8400 118.1484 58.5944 42.2053 178.9044 51 D 4.3841 8.2147 118.7660 57.0917 40.6048 179.0388 52 V 3.5531 8.0395 119.1016 66.2390 31.6553 178.6709 53 V 3.6238 8.1004 112.3901 64.4116 31.2004 178.8551 54 T 3.8611 7.8672 115.7604 66.5979 68.2444 176.3825 55 E 3.8942 8.4505 121.2026 59.0748 29.6789 178.5365 56 A 3.9537 8.1738 121.0433 55.3635 18.4236 179.8769 57 V 3.5199 7.8958 116.6751 65.8294 31.4666 178.1365 58 R 4.0687 8.2733 118.9060 59.5388 29.6877 178.5374 59 L 4.0194 8.0401 117.9155 57.8197 41.6741 179.2122 60 L 4.2307 7.8938 118.1086 57.5766 41.6433 179.1291 61 E 4.3504 8.5304 120.3938 58.4809 30.6076 177.6170 62 E 4.4593 7.9874 117.7362 56.2844 25.8855 175.3839 *64 P 4.7826 0.0000 0.0000 62.2033 33.9740 179.4056 65 L 3.9175 7.8035 117.0906 56.3921 41.6605 177.0064 66 F 5.1242 7.0165 114.3931 55.5572 41.1444 176.2050 67 N 4.8201 8.7684 123.6047 51.3968 36.8632 173.1880 68 A 4.3228 8.1895 120.5887 52.0577 23.3543 177.0626 69 G 3.8528 8.1482 110.5614 46.1287 0.0000 174.7870 70 I 4.0049 8.4186 125.5228 63.1356 37.1835 176.6369 71 G 4.0259 9.0056 113.6770 44.9499 0.0000 173.4157 72 A 4.2198 7.4053 122.1695 51.8104 18.8099 178.5299 73 V 3.9856 8.4270 114.6036 61.3785 32.3627 175.8172 74 F 4.8625 8.5536 119.9064 56.1487 40.6397 176.5186 75 T 4.3637 8.8126 115.2906 60.4705 70.0002 175.2878 76 R 3.8672 8.6193 120.9310 59.4687 29.8289 176.4422 77 D 4.7634 8.0111 115.1001 53.5976 40.7737 175.8998 78 E 3.9706 8.3671 117.4621 58.0817 27.4402 173.9036 79 T 4.7761 7.8630 106.9506 60.0712 72.0112 171.4910 80 H 5.1735 8.5604 117.6496 53.9563 31.3498 173.7071 81 E 4.6128 8.7960 121.6422 54.6591 32.2045 175.1014 82 L 4.7716 8.8067 125.0137 53.0480 44.7130 175.5418 83 D 5.3965 8.3429 119.9856 53.0780 45.1698 174.4340 84 A 4.6567 8.8739 121.4087 51.5107 23.1260 174.7942 85 C 5.3707 8.4191 118.5402 57.9912 35.1578 173.5605 86 V 4.6269 8.8816 122.9155 60.3574 34.7687 173.6889 87 M 5.0605 8.5060 121.8345 53.9964 35.6150 173.5104 88 D 4.7182 9.0668 126.3617 52.5987 42.0480 177.3562 89 G 3.6370 8.8476 115.9892 47.8820 0.0000 173.4519 90 N 4.4738 8.7062 118.9887 55.8450 39.0862 175.7233 91 T 4.2810 7.9240 105.1589 60.6688 70.0725 174.8713 92 L 3.7264 8.0992 120.5502 55.3913 39.9548 174.5750 93 K 4.4468 7.7657 118.3639 56.4808 33.1194 175.8889 94 A 5.0956 8.3611 122.5787 50.7367 23.1678 175.2148 95 G 4.3446 9.1493 105.5461 44.7817 0.0000 171.6653 96 A 5.2311 8.8452 123.4098 50.5585 23.2179 175.6332 97 V 5.6236 9.0453 112.9066 58.5027 35.9717 174.7516 98 A 4.8443 8.0546 124.0327 50.6446 22.6375 176.1130 99 G 3.9548 9.3350 107.7703 46.7961 0.0000 173.7892 100 V 4.3487 7.6302 112.3404 59.8187 32.8269 177.1599 101 S 4.6796 9.7578 117.0317 58.3297 64.9648 175.1052 102 H 5.2196 8.6078 116.7173 55.1525 29.5119 172.4060 103 L 5.1319 8.0351 119.3120 52.7314 43.9833 176.5670 104 R 4.2893 9.0834 124.2608 58.8845 30.4733 175.9425 105 N 5.3217 7.7600 115.3094 48.5519 39.5900 172.4075 106 P 4.2715 0.0000 0.0000 65.6797 31.5390 178.3236 107 V 3.6422 8.5428 117.9094 64.8119 31.2561 178.5406 108 L 4.0281 7.9377 118.9697 57.3741 41.5383 179.0307 109 A 4.0534 8.0893 120.5923 55.0474 18.3116 179.5251 110 A 3.9476 8.3922 119.6877 55.3831 18.4603 179.8641 111 R 3.8796 8.1611 117.2414 59.3732 30.0600 178.4802 112 L 4.0171 8.0270 120.3122 58.0828 41.9082 179.0959 113 V 3.5393 8.1305 118.2805 66.1480 31.2287 177.6454 114 M 3.9484 7.8728 116.6664 58.7505 32.2220 177.5381 115 E 4.3904 8.2584 116.7591 57.5486 29.9716 177.2244 116 Q 4.7453 8.4377 116.5603 55.1427 29.8061 174.7713 117 S 4.7351 7.6777 111.5548 56.4026 66.0972 171.6794 118 P 4.5743 0.0000 0.0000 62.9012 31.1885 174.9588 119 H 4.9976 7.8814 115.7316 54.5331 31.7835 173.7706 120 V 4.3523 8.1186 119.1392 63.4620 33.3805 175.2256 121 M 5.3078 7.8228 118.2869 53.9414 35.1548 174.5260 122 M 4.9789 8.9996 124.5492 53.4497 36.6027 174.3719 123 I 4.8738 7.9867 114.4657 59.2997 41.5148 176.1276 124 G 3.7819 9.0055 111.9426 45.9451 0.0000 175.8989 125 E 4.3330 8.2512 120.3872 58.5564 29.6282 179.1910 126 G 3.6097 8.0869 105.3642 47.6091 0.0000 175.3254 127 A 4.0290 7.9696 123.3200 54.8734 18.5145 179.5013 128 E 3.4137 8.0011 116.9806 59.5841 29.5599 179.4056 129 N 4.4197 8.3698 116.7334 56.1404 38.4230 177.2271 130 F 4.1301 8.3342 121.8002 61.2375 39.5176 177.0758 131 A 3.5917 7.9604 120.2642 55.1197 18.1982 179.5579 132 F 4.8512 8.3339 117.8451 60.3261 38.7460 177.8217 133 A 4.0916 7.9531 119.3337 54.5987 18.1854 178.8466 134 R 4.2351 7.1474 114.5069 56.0481 30.3601 177.4599 135 G 3.9442 7.9689 107.7412 45.1282 0.0000 173.8594 136 M 4.2146 7.9503 120.4846 54.8918 32.8964 175.1529 137 E 4.1448 8.5841 126.4143 55.9885 30.6053 175.7615 138 R 4.5960 8.0932 125.8129 55.9412 30.8701 175.6817 139 V 4.5565 8.4885 118.9783 59.0990 35.1591 175.4992 140 S 4.4071 8.4117 117.6184 57.6484 62.8861 173.4854 141 P 4.6707 0.0000 0.0000 64.8843 31.4117 176.9179 142 E 4.3011 7.9221 118.0219 57.1226 29.7423 178.2654 143 I 3.5492 7.2290 119.4663 63.5713 38.2185 176.7833 144 F 4.4525 7.3217 117.7235 58.8876 39.3033 175.6292 145 S 4.5914 7.6596 117.9597 58.4916 63.4333 174.2627 146 T 4.8440 8.4102 114.1286 59.1597 73.0045 175.2886 147 S 4.2830 8.7101 117.9705 61.4333 63.2143 176.2670 148 L 3.9763 8.0454 123.4961 58.4519 41.8569 179.2530 149 R 4.1666 7.9167 116.6045 59.2277 29.9752 178.4711 150 Y 3.7257 8.4349 119.6907 60.6122 38.6837 177.7949 151 E 3.8722 8.7356 119.9982 59.4018 29.4349 179.3294 152 Q 3.9699 7.9749 117.8390 58.6702 28.6897 178.5933 153 L 3.8776 7.8064 121.3727 58.1445 41.9327 178.9466 154 L 3.7372 7.3704 117.3621 57.6738 41.5586 179.1678 155 A 4.0634 7.9627 119.6434 55.1089 18.4253 179.1800 156 A 4.0610 8.0525 118.5192 55.2425 18.4976 178.3103 157 R 4.1444 7.9353 120.1262 56.6127 30.2799 176.5150 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 2 G 8.35 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 0.00 0.00 0.00 3 K 8.49 4.14 0.00 1.83 1.84 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.50 7.81 4 A 7.62 4.14 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 5 V 7.65 4.38 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 0.69 0.00 0.00 0.93 0.00 0.00 6 I 8.21 4.58 1.86 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 1.33 0.94 0.90 0.00 0.00 7 A 8.34 4.81 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 8 I 8.04 4.72 1.75 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.69 0.86 0.00 0.00 9 H 8.23 4.93 0.00 3.12 3.22 0.00 5.66 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 G 8.74 3.59 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 0.00 0.00 0.00 11 G 8.73 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 0.00 0.00 0.00 12 A 8.40 4.66 1.17 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 0.00 0.00 13 G 9.06 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 14 A 7.69 4.59 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 15 I 7.57 4.33 1.83 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.62 0.86 0.00 0.00 16 S 8.32 4.46 0.00 3.78 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 17 R 8.92 3.86 0.00 1.92 1.92 0.00 3.41 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 1.70 1.71 0.00 18 A 8.03 4.05 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 19 Q 7.91 4.55 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.63 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 20 M 7.74 5.05 0.00 2.02 1.95 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.49 0.00 21 S 8.25 4.84 0.00 4.01 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 22 L 8.14 4.59 0.00 1.79 1.71 1.01 0.99 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 23 Q 8.08 4.11 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.68 0.00 0.00 0.00 0.00 0.00 2.46 2.40 0.00 24 Q 8.06 3.96 0.00 2.40 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 25 E 8.31 4.16 0.00 2.25 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 2.57 0.00 26 L 8.52 4.08 0.00 1.80 1.74 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 27 R 7.99 4.03 0.00 1.76 1.78 0.00 3.24 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.71 0.00 28 Y 7.94 4.15 0.00 3.24 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 29 I 8.20 3.80 2.08 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.99 0.96 0.00 0.00 30 E 8.63 3.97 0.00 2.17 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 2.35 2.46 0.00 31 A 8.23 4.07 1.56 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 0.00 0.00 32 L 8.40 3.99 0.00 1.93 1.77 1.07 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 33 S 8.45 4.07 0.00 4.00 4.02 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 34 A 8.12 4.00 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 35 I 7.66 3.74 1.88 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.68 0.92 0.00 0.00 36 V 8.07 3.66 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 1.09 0.00 0.00 0.92 0.00 0.00 37 E 8.48 4.15 0.00 2.23 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 0.00 2.34 2.53 0.00 38 T 7.92 3.96 4.41 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 1.22 0.00 0.00 39 G 8.09 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 40 Q 8.43 3.99 0.00 2.26 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.52 0.00 41 K 8.10 4.17 0.00 2.02 1.91 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.44 1.35 7.81 42 M 8.09 4.05 0.00 2.12 2.24 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.59 0.00 43 L 8.08 4.00 0.00 1.86 1.71 0.94 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.64 4.01 0.00 2.14 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 2.33 2.43 0.00 45 A 7.78 4.40 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 46 G 7.82 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 47 E 7.82 4.22 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 2.44 2.39 0.00 48 S 8.33 4.38 0.00 4.05 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 49 A 8.55 3.95 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 50 L 7.84 3.88 0.00 1.77 1.67 0.92 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 51 D 8.21 4.38 0.00 2.87 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 52 V 8.04 3.55 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 1.10 0.00 0.00 0.94 0.00 0.00 53 V 8.10 3.62 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 0.87 0.00 0.00 1.00 0.00 0.00 54 T 7.87 3.86 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 1.22 0.00 0.00 55 E 8.45 3.89 0.00 2.07 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 2.31 2.37 0.00 56 A 8.17 3.95 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 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0.00 0.00 0.00 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 T 8.81 4.36 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 1.27 0.00 0.00 76 R 8.62 3.87 0.00 1.81 2.05 0.00 3.23 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 77 D 8.01 4.76 0.00 2.79 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 78 E 8.37 3.97 0.00 2.23 2.17 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 2.26 2.28 0.00 79 T 7.86 4.78 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 1.30 0.00 0.00 80 H 8.56 5.17 0.00 3.02 3.02 0.00 5.64 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 E 8.80 4.61 0.00 1.79 1.82 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 2.20 2.31 0.00 82 L 8.81 4.77 0.00 1.45 1.35 -0.09 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.25 4.33 0.00 2.08 1.98 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 2.41 2.29 0.00 126 G 8.09 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 0.00 127 A 7.97 4.03 1.33 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 0.00 0.00 128 E 8.00 3.41 0.00 2.03 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 2.25 2.42 0.00 129 N 8.37 4.42 0.00 2.83 2.92 0.00 0.00 6.73 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 0.00 130 F 8.33 4.13 0.00 3.10 3.28 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 0.00 131 A 7.96 3.59 1.27 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 0.00 0.00 132 F 8.33 4.85 0.00 3.12 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 0.00 133 A 7.95 4.09 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 0.00 134 R 7.15 4.24 0.00 1.53 1.77 0.00 3.20 0.00 0.00 3.04 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.49 0.00 135 G 7.97 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 0.00 136 M 7.95 4.21 0.00 2.24 1.95 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 2.65 2.59 0.00 137 E 8.58 4.14 0.00 1.98 1.85 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 2.26 2.25 0.00 138 R 8.09 4.60 0.00 0.67 1.40 0.00 2.87 0.00 0.00 3.02 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 139 V 8.49 4.56 1.96 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 0.69 0.00 0.00 0.96 0.00 0.00 140 S 8.41 4.41 0.00 3.88 3.66 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 0.00 0.00 0.00 0.00 141 P 0.00 4.67 0.00 2.28 2.12 0.00 3.46 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.03 0.00 142 E 7.92 4.30 0.00 1.99 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 0.00 2.36 2.29 0.00 143 I 7.23 3.55 1.59 0.00 0.00 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 1.01 0.56 -0.10 0.00 0.00 144 F 7.32 4.45 0.00 2.69 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 0.00 145 S 7.66 4.59 0.00 4.10 4.14 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 0.00 0.00 0.00 146 T 8.41 4.84 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 1.25 0.00 0.00 147 S 8.71 4.28 0.00 4.14 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 0.00 148 L 8.05 3.98 0.00 1.81 1.78 0.95 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 149 R 7.92 4.17 0.00 2.23 2.26 0.00 3.50 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.15 0.00 150 Y 8.43 3.73 0.00 3.05 3.06 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 0.00 0.00 0.00 0.00 151 E 8.74 3.87 0.00 2.16 1.98 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 2.61 2.53 0.00 152 Q 7.97 3.97 0.00 2.40 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.52 0.00 153 L 7.81 3.88 0.00 1.72 1.42 0.97 0.36 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 0.00 154 L 7.37 3.74 0.00 1.60 1.55 0.81 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 155 A 7.96 4.06 1.33 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 0.00 0.00 156 A 8.05 4.06 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 0.00 157 R 7.94 4.14 0.00 1.91 1.81 0.00 3.06 0.00 0.00 3.19 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 * Residues marked with a * may have inaccurate shift predictions.