NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 33 E 4.2563 8.4401 120.2337 56.2189 31.5230 176.3988 34 A 4.1995 7.8593 120.0574 52.9788 20.0842 176.3966 35 W 4.4684 8.9320 125.5697 59.4971 32.3221 175.5758 36 K 4.8158 7.9019 116.5269 56.6440 32.0828 177.6023 37 K 4.7230 7.6034 116.4738 55.0953 35.3786 178.6255 38 E 3.9471 7.8992 118.6748 58.7190 29.1921 178.3367 39 R 3.7336 7.1837 118.0042 58.8706 29.6787 178.3612 40 Q 3.9906 7.8300 117.6481 58.6498 28.7103 178.0323 41 E 4.0411 7.7018 119.5024 58.9701 29.2864 178.9199 42 K 4.0411 7.8116 119.3205 58.4909 32.1541 178.8951 43 K 3.9214 7.7133 119.8821 59.4988 31.7495 178.6423 44 A 3.9926 7.7440 120.6637 54.8761 18.3537 179.6251 45 L 3.9686 7.7804 117.5876 57.7476 41.5855 179.1949 46 E 4.1217 8.0055 119.1267 59.0208 29.1472 178.4035 47 A 4.0582 8.3417 120.3118 54.0726 18.5048 178.8530 48 Q 3.8816 7.6137 117.7434 58.4887 29.5093 177.6887 49 Q 4.0515 7.9433 118.6926 58.9119 28.6777 178.4269 50 D 4.4027 8.3720 120.2291 57.4632 40.6437 178.7873 51 S 4.1818 7.6950 113.3890 61.1809 62.4900 176.4016 52 V 3.6430 7.7585 120.6344 66.2399 31.2921 178.2777 53 S 4.3698 8.2708 114.8414 61.6590 62.5377 176.1309 54 Y 4.3524 8.0990 123.8626 60.1753 38.5594 178.2232 55 V 3.3392 7.6227 119.1132 65.9750 31.7570 178.0504 56 Q 3.9706 8.0174 117.2450 58.7234 28.4900 178.6692 57 A 3.9201 8.1523 121.9164 55.2713 18.4609 179.7688 58 I 3.4525 7.5439 118.3656 64.5339 37.0082 178.5287 59 N 4.3149 8.2143 117.1348 56.1028 38.2999 177.4093 60 A 4.0234 7.8823 121.9935 55.0712 18.3509 179.7484 61 L 3.3500 7.8456 117.5727 57.5433 41.3737 179.5931 62 K 4.0128 7.7056 118.4878 59.5825 32.2853 178.0983 63 N 4.6217 8.3940 114.5274 53.2570 38.4052 175.3026 64 G 3.9053 8.1667 108.9566 46.4611 0.0000 173.4955 65 S 4.6250 8.3294 115.4517 56.2983 63.9381 172.4360 66 F 5.4049 8.6782 121.3379 55.7636 41.9762 173.4179 67 V 5.1454 9.2781 118.5035 60.2311 35.1293 173.5694 68 L 5.2734 9.5501 127.0734 53.3459 44.1264 174.9024 69 E 4.7888 8.9276 125.8923 55.0167 30.5752 175.6586 70 A 4.3499 8.7593 128.0956 52.2750 19.1366 177.3456 71 D 4.6827 9.4901 124.0442 56.5071 42.6772 175.8169 72 N 5.5410 8.0717 113.5923 51.1743 41.4743 173.2971 73 V 4.6788 8.6345 119.6158 61.0052 34.8221 174.2168 74 V 4.5564 8.5967 127.4958 61.2115 34.1210 175.2118 75 F 4.8015 9.4463 129.5341 56.6038 41.0270 177.9700 76 R 3.9550 8.8896 118.1186 59.6440 29.1578 175.5166 77 N 4.7089 8.2035 113.4306 52.7938 37.1445 176.0801 78 G 3.9335 8.0902 106.7159 45.5983 0.0000 174.2599 79 I 3.9507 7.5056 121.6782 61.3165 37.9820 174.8944 80 M 5.1416 8.4848 124.1227 53.4036 33.8008 175.1007 81 R 4.5146 8.6123 121.1694 54.4529 33.6587 174.1248 82 F 4.9203 8.8331 125.2480 57.8016 39.7652 174.8808 83 V 4.7864 9.1211 115.9270 59.5637 36.0393 174.8658 84 S 4.5293 8.5976 115.9206 57.7340 62.9016 174.6959 85 S 4.6679 8.9974 120.5252 59.2223 63.1385 174.2920 86 N 4.6806 8.1302 117.8202 53.6268 37.9443 175.4950 87 T 4.5531 7.7039 107.1430 61.3702 69.9300 173.7472 88 N 5.2079 7.9925 120.0801 52.6056 42.4045 172.7074 89 Y 5.3627 8.5693 121.2518 56.3921 42.2664 173.6580 90 V 5.3200 8.9326 113.0815 59.6346 35.4846 174.8790 91 E 5.2096 9.4142 121.8813 54.6071 33.5059 174.5608 92 V 4.4918 7.7689 120.7262 61.0409 34.9084 174.0508 93 N 4.7417 8.8271 125.0692 52.9886 42.0737 173.5439 94 D 4.3803 9.4258 124.3870 55.4649 39.7030 174.1287 95 G 3.9128 8.1101 103.5429 45.5911 0.0000 172.9135 96 Q 5.0573 7.8743 118.1508 53.9237 32.9586 174.7621 97 G 4.5016 9.0364 107.6366 44.7492 0.0000 171.2543 98 I 5.2665 8.9513 120.8649 59.0518 42.0319 173.9637 99 I 4.9030 9.0339 129.7461 59.6863 39.4665 174.1921 100 Q 4.8427 8.4630 128.7174 54.3485 31.5744 174.1436 101 T 5.1796 8.3126 119.0786 60.4912 71.2805 173.8276 102 A 4.0056 8.6088 128.6517 52.2412 18.4215 177.2495 103 F 4.7955 7.3576 116.4523 55.6114 41.1662 175.3434 104 T 3.9062 8.4311 122.8858 64.8588 68.8267 174.2065 105 N 4.4386 9.4826 120.8720 53.8949 36.2809 174.0975 106 F 3.9711 7.6314 112.7648 58.4832 37.1060 175.1441 107 V 4.5428 7.5064 118.4222 60.9032 33.9061 174.9404 108 Y 3.3403 7.6897 127.4237 60.2180 39.1847 176.8447 109 N 4.2899 7.6019 117.0749 51.7510 37.5517 175.6529 *117 G 3.5799 7.5846 103.6615 45.8678 0.0000 172.7768 118 V 3.9557 7.6878 126.2045 62.7622 33.0050 174.8683 119 T 4.9428 8.4165 123.1907 61.7367 71.2517 173.4680 120 V 4.4651 9.0643 127.5991 61.2016 33.6199 174.1059 121 Q 5.1093 8.9257 125.9453 54.0771 32.1646 175.7545 122 G 4.0193 7.7287 106.9548 46.1515 0.0000 170.9240 123 N 5.0448 8.1702 116.9776 52.5441 40.2571 174.9154 124 V 4.7662 8.4526 123.9031 61.9581 32.4326 174.7434 125 N 4.9678 8.7445 124.7161 50.6723 41.3257 173.8875 126 G 3.9497 8.3087 104.7551 46.7334 0.0000 173.7261 127 I 4.3041 7.5018 117.8338 60.9268 38.6841 177.4563 128 S 4.7191 9.1093 122.9841 56.7877 66.3283 172.7979 129 M 5.2763 8.6836 123.2750 54.0559 34.6450 174.3260 130 R 4.9224 9.4019 124.7281 54.4274 34.8721 174.1792 131 Q 5.2595 8.6628 121.4233 54.5645 32.3468 174.8774 132 D 4.8647 9.0246 125.7977 51.6901 41.4275 177.2277 133 K 4.1080 8.5111 117.3493 59.4558 32.6287 177.3853 134 D 4.5214 8.3340 117.3939 54.2117 41.2387 177.0299 135 G 4.0023 8.1929 107.6942 45.4195 0.0000 173.2999 136 N 4.7764 8.9243 118.0773 52.8415 40.0383 174.1831 137 V 4.7550 8.4878 122.9767 61.4363 34.1961 174.0037 138 Y 5.0406 9.4565 125.7800 56.6195 40.2654 174.1004 139 Y 5.0982 9.2199 127.3688 55.9280 40.7528 174.0524 140 N 5.6645 8.9383 124.7945 51.9133 42.4190 173.2780 141 Y 4.8943 7.6840 118.6151 57.2849 42.0757 173.2077 142 G 4.4762 9.2898 107.2056 44.4800 0.0000 172.3676 143 I 5.0819 9.1498 122.0777 59.4205 40.5719 174.3857 144 N 5.0478 9.3950 125.7810 51.8030 40.5388 173.9122 145 G 4.2544 8.6696 116.1394 43.0696 0.0000 171.7184 146 I 3.8289 8.3760 122.1398 61.4165 36.6376 175.3825 147 A 4.1254 8.7476 128.3407 52.1196 16.4488 176.6122 148 V 4.7293 7.2466 116.6313 62.1181 34.6944 173.2123 149 S 5.1829 9.2956 116.2195 57.3800 66.9356 172.5074 150 A 4.9355 8.8183 121.4924 50.9511 22.7929 175.3963 151 T 4.7315 8.3562 111.3882 60.0420 71.9393 173.7633 152 V 4.6486 8.3603 122.7094 61.2818 35.2809 174.0702 153 S 5.3224 9.0805 123.3741 55.8021 66.1052 172.8764 154 I 4.9186 8.9480 125.8311 59.4121 40.0532 174.6522 155 V 4.4520 8.8345 127.2468 60.9539 33.9130 173.7234 156 L 4.8716 8.7085 130.9009 53.6960 44.2674 175.3248 157 T 4.4409 9.0802 124.2685 62.6558 69.3741 174.7117 158 G 3.4661 8.8454 116.8290 47.1340 0.0000 173.5513 159 G 3.4952 6.6291 111.0182 45.2835 0.0000 172.3780 160 T 4.8803 7.4765 109.1090 60.3984 72.1342 173.5997 161 N 5.0910 8.6839 115.6398 52.9071 38.9370 173.7311 162 Q 4.5287 8.1990 119.4651 55.9578 30.1049 174.9700 163 A 5.0429 8.8091 124.5111 50.4363 23.5920 174.4950 164 S 5.0234 9.0843 114.3759 56.3842 65.6681 172.8988 165 V 4.8572 9.0157 127.3261 61.4444 34.0628 174.0259 166 T 5.0029 9.2203 125.0058 61.7986 71.3507 173.1569 167 I 4.6393 8.7409 127.4083 59.4207 40.2737 174.1222 168 N 4.7623 8.9115 126.9207 51.0762 40.6639 171.0379 169 P 4.6240 0.0000 0.0000 62.2225 33.1506 176.1476 170 N 4.2292 9.2950 122.4140 54.6449 36.6746 174.2676 171 F 3.8949 7.5286 110.3411 58.5590 36.8451 176.9528 172 S 4.3019 8.0742 116.5750 58.4737 63.4197 175.2899 173 G 3.8707 8.5628 107.9568 46.2613 0.0000 174.5874 174 N 4.7033 7.6290 118.0595 52.2681 36.9898 175.2408 175 T 4.5432 7.3373 115.5107 63.0799 70.2324 174.9934 176 L 4.7882 8.2095 125.0025 53.7778 46.0056 174.7830 177 T 5.0841 8.8206 122.6972 62.0069 71.6980 172.8654 178 M 5.0628 9.2342 125.5685 53.5989 34.9471 174.4498 179 N 5.2448 8.8472 121.4321 51.1384 41.4604 173.5287 180 G 4.4779 7.7556 112.3861 46.5386 0.0000 171.4517 181 Y 5.1156 8.1545 119.8730 56.0154 41.3674 174.4897 182 L 4.9810 8.8920 126.5101 53.7896 43.2701 175.8005 183 V 4.6790 8.8266 119.6309 58.4288 35.9585 173.6037 184 P 4.5743 0.0000 0.0000 63.1068 31.6704 177.0338 185 Y 4.1141 9.0263 123.9986 60.7379 38.8746 178.1550 186 N 4.1103 8.1208 115.5534 55.0121 37.9035 175.9402 187 E 4.1227 7.9427 118.0995 58.1337 29.9572 176.9412 188 G 3.6246 7.3932 111.9156 45.6433 0.0000 172.1633 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 33 E 8.44 4.26 0.00 2.00 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 2.22 2.34 0.00 34 A 7.86 4.20 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 35 W 8.93 4.47 0.00 3.39 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 36 K 7.90 4.82 0.00 1.85 1.84 0.00 1.84 0.00 0.00 1.78 0.00 0.00 3.13 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.54 1.74 7.81 37 K 7.60 4.72 0.00 1.72 1.72 0.00 2.12 0.00 0.00 1.69 0.00 0.00 2.82 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.39 1.35 7.81 38 E 7.90 3.95 0.00 1.87 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 2.22 2.25 0.00 39 R 7.18 3.73 0.00 1.69 1.71 0.00 3.27 0.00 0.00 3.08 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.55 0.00 40 Q 7.83 3.99 0.00 2.24 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.70 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 41 E 7.70 4.04 0.00 2.21 1.94 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 2.28 2.43 0.00 42 K 7.81 4.04 0.00 1.81 1.71 0.00 1.58 0.00 0.00 1.49 0.00 0.00 2.77 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.39 7.81 43 K 7.71 3.92 0.00 1.95 1.97 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.44 7.81 44 A 7.74 3.99 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 45 L 7.78 3.97 0.00 1.70 1.70 0.96 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.01 4.12 0.00 2.13 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 0.00 2.31 2.31 0.00 47 A 8.34 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 48 Q 7.61 3.88 0.00 2.31 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.75 0.00 0.00 0.00 0.00 0.00 2.31 2.39 0.00 49 Q 7.94 4.05 0.00 2.32 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 50 D 8.37 4.40 0.00 2.73 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 51 S 7.70 4.18 0.00 3.77 4.01 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 52 V 7.76 3.64 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 0.99 0.00 0.00 0.97 0.00 0.00 53 S 8.27 4.37 0.00 4.19 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 54 Y 8.10 4.35 0.00 3.21 3.20 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 55 V 7.62 3.34 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 0.94 0.00 0.00 1.02 0.00 0.00 56 Q 8.02 3.97 0.00 2.35 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 57 A 8.15 3.92 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 58 I 7.54 3.45 1.56 0.00 0.00 0.46 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 -0.12 0.75 0.00 0.00 59 N 8.21 4.31 0.00 2.70 2.84 0.00 0.00 6.91 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 60 A 7.88 4.02 1.52 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 61 L 7.85 3.35 0.00 1.53 1.05 0.60 -1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.71 4.01 0.00 1.83 2.02 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.12 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.55 7.81 63 N 8.39 4.62 0.00 2.79 2.86 0.00 0.00 7.06 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 64 G 8.17 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 65 S 8.33 4.63 0.00 3.76 3.74 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 66 F 8.68 5.40 0.00 3.19 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 67 V 9.28 5.15 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 0.91 0.00 0.00 1.00 0.00 0.00 68 L 9.55 5.27 0.00 1.80 1.73 0.98 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 69 E 8.93 4.79 0.00 2.23 2.16 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 2.49 2.42 0.00 70 A 8.76 4.35 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 71 D 9.49 4.68 0.00 2.96 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 72 N 8.07 5.54 0.00 2.48 2.71 0.00 0.00 5.63 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 73 V 8.63 4.68 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 0.19 0.00 0.00 1.00 0.00 0.00 74 V 8.60 4.56 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 0.94 0.00 0.00 0.80 0.00 0.00 75 F 9.45 4.80 0.00 2.99 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 76 R 8.89 3.96 0.00 1.83 1.85 0.00 3.26 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.19 0.00 77 N 8.20 4.71 0.00 2.83 2.95 0.00 0.00 6.13 7.00 0.00 0.00 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 G 8.09 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 79 I 7.51 3.95 1.88 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.68 0.37 0.00 0.00 80 M 8.48 5.14 0.00 1.81 1.85 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.29 0.00 81 R 8.61 4.51 0.00 1.80 1.91 0.00 3.56 0.00 0.00 3.32 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.93 0.00 82 F 8.83 4.92 0.00 3.07 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 83 V 9.12 4.79 2.27 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 1.07 0.00 0.00 1.13 0.00 0.00 84 S 8.60 4.53 0.00 3.91 3.83 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 85 S 9.00 4.67 0.00 4.11 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 86 N 8.13 4.68 0.00 2.85 2.96 0.00 0.00 5.93 7.71 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 87 T 7.70 4.55 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 1.24 0.00 0.00 88 N 7.99 5.21 0.00 2.86 2.84 0.00 0.00 6.65 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 89 Y 8.57 5.36 0.00 3.19 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 90 V 8.93 5.32 2.35 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 0.84 0.00 0.00 1.19 0.00 0.00 91 E 9.41 5.21 0.00 2.22 2.27 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 2.59 2.51 0.00 92 V 7.77 4.49 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 0.75 0.00 0.00 0.42 0.00 0.00 93 N 8.83 4.74 0.00 1.44 1.65 0.00 0.00 6.76 8.23 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 94 D 9.43 4.38 0.00 2.65 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 G 8.11 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 96 Q 7.87 5.06 0.00 2.02 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.65 0.00 0.00 0.00 0.00 0.00 2.38 2.23 0.00 97 G 9.04 4.50 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 0.00 98 I 8.95 5.27 1.95 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.62 1.12 0.00 0.00 99 I 9.03 4.90 1.99 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 1.20 0.74 1.10 0.00 0.00 100 Q 8.46 4.84 0.00 1.56 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.72 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 101 T 8.31 5.18 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 0.87 0.00 0.00 102 A 8.61 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 F 7.36 4.80 0.00 3.31 3.26 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 0.00 104 T 8.43 3.91 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 1.19 0.00 0.00 105 N 9.48 4.44 0.00 2.91 2.98 0.00 0.00 7.04 7.45 0.00 0.00 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 F 7.63 3.97 0.00 3.28 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 0.00 107 V 7.51 4.54 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 0.73 0.00 0.00 1.07 0.00 0.00 108 Y 7.69 3.34 0.00 1.43 2.34 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 0.00 109 N 7.60 4.29 0.00 2.70 2.71 0.00 0.00 6.81 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 *117 G 7.58 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 0.00 118 V 7.69 3.96 1.48 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 0.98 0.00 0.00 0.62 0.00 0.00 119 T 8.42 4.94 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 1.32 0.00 0.00 120 V 9.06 4.47 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 0.98 0.00 0.00 1.13 0.00 0.00 121 Q 8.93 5.11 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.65 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 122 G 7.73 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 0.00 0.00 0.00 123 N 8.17 5.04 0.00 2.65 2.74 0.00 0.00 7.04 7.23 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 0.00 124 V 8.45 4.77 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 0.68 0.00 0.00 0.87 0.00 0.00 125 N 8.74 4.97 0.00 2.79 2.88 0.00 0.00 6.41 7.06 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 0.00 126 G 8.31 3.95 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 0.00 0.00 0.00 127 I 7.50 4.30 1.84 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 1.31 0.59 0.67 0.00 0.00 128 S 9.11 4.72 0.00 3.62 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 0.00 129 M 8.68 5.28 0.00 2.07 2.11 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 2.76 2.66 0.00 130 R 9.40 4.92 0.00 1.84 1.81 0.00 3.10 0.00 0.00 3.07 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 131 Q 8.66 5.26 0.00 2.09 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.90 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 132 D 9.02 4.86 0.00 3.02 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 0.00 133 K 8.51 4.11 0.00 1.90 2.01 0.00 1.57 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.48 7.81 134 D 8.33 4.52 0.00 2.83 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 0.00 135 G 8.19 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 0.00 136 N 8.92 4.78 0.00 2.79 2.61 0.00 0.00 6.51 7.47 0.00 0.00 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 V 8.49 4.76 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 0.85 0.00 0.00 0.98 0.00 0.00 138 Y 9.46 5.04 0.00 2.88 2.90 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 0.00 139 Y 9.22 5.10 0.00 2.91 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 0.00 140 N 8.94 5.66 0.00 2.54 2.60 0.00 0.00 6.15 7.50 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 0.00 141 Y 7.68 4.89 0.00 2.98 2.87 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 0.00 142 G 9.29 4.48 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 I 9.15 5.08 1.90 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.96 0.96 0.00 0.00 144 N 9.39 5.05 0.00 2.63 2.75 0.00 0.00 6.21 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 0.00 145 G 8.67 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 0.00 0.00 0.00 0.00 146 I 8.38 3.83 1.89 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 1.36 0.84 0.93 0.00 0.00 147 A 8.75 4.13 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 0.00 148 V 7.25 4.73 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 0.92 0.00 0.00 0.97 0.00 0.00 149 S 9.30 5.18 0.00 3.81 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 0.00 150 A 8.82 4.94 1.08 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 0.00 151 T 8.36 4.73 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 1.07 0.00 0.00 152 V 8.36 4.65 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 0.80 0.00 0.00 0.65 0.00 0.00 153 S 9.08 5.32 0.00 3.72 3.74 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 0.00 154 I 8.95 4.92 2.11 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.08 0.85 0.00 0.00 155 V 8.83 4.45 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 0.61 0.00 0.00 0.97 0.00 0.00 156 L 8.71 4.87 0.00 1.65 1.43 0.98 0.65 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 0.00 157 T 9.08 4.44 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 1.15 0.00 0.00 158 G 8.85 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 6.63 3.50 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 0.00 160 T 7.48 4.88 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 1.18 0.00 0.00 161 N 8.68 5.09 0.00 3.06 3.17 0.00 0.00 5.96 7.83 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 0.00 162 Q 8.20 4.53 0.00 1.99 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.72 0.00 0.00 0.00 0.00 0.00 1.93 2.32 0.00 163 A 8.81 5.04 1.15 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 0.00 0.00 0.00 0.00 0.00 0.00 164 S 9.08 5.02 0.00 3.80 3.64 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 0.00 165 V 9.02 4.86 2.13 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 0.81 0.00 0.00 1.01 0.00 0.00 166 T 9.22 5.00 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 1.16 0.00 0.00 167 I 8.74 4.64 1.76 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 1.09 1.17 0.64 0.00 0.00 168 N 8.91 4.76 0.00 2.68 2.53 0.00 0.00 6.53 8.15 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 0.00 169 P 0.00 4.62 0.00 1.87 1.38 0.00 3.64 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.81 0.00 170 N 9.30 4.23 0.00 2.82 2.96 0.00 0.00 7.10 7.09 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 0.00 171 F 7.53 3.89 0.00 3.17 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 0.00 172 S 8.07 4.30 0.00 4.03 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 0.00 173 G 8.56 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 0.00 0.00 0.00 174 N 7.63 4.70 0.00 2.76 2.86 0.00 0.00 6.92 6.82 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 0.00 175 T 7.34 4.54 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 1.16 0.00 0.00 176 L 8.21 4.79 0.00 1.77 1.48 1.08 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 177 T 8.82 5.08 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 1.22 0.00 0.00 178 M 9.23 5.06 0.00 1.93 1.98 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.49 0.00 179 N 8.85 5.24 0.00 2.75 2.63 0.00 0.00 6.38 7.14 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 0.00 180 G 7.76 4.48 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 Y 8.15 5.12 0.00 2.93 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 0.00 182 L 8.89 4.98 0.00 1.61 1.57 0.89 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 183 V 8.83 4.68 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 0.76 0.00 0.00 1.01 0.00 0.00 184 P 0.00 4.57 0.00 2.09 2.02 0.00 3.63 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.12 0.00 185 Y 9.03 4.11 0.00 2.95 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 0.00 186 N 8.12 4.11 0.00 2.85 2.94 0.00 0.00 6.06 7.66 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 0.00 187 E 7.94 4.12 0.00 2.15 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 2.33 2.27 0.00 188 G 7.39 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.