NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 56 C 4.4986 8.2027 118.3632 59.5063 29.6373 173.5757 57 S 3.8227 8.8919 120.6924 59.1358 61.9683 173.9386 58 P 4.4293 0.0000 0.0000 64.5370 32.4581 176.2593 59 G 4.3752 8.3327 106.2273 46.8681 0.0000 172.4501 60 I 4.9798 7.3546 121.0348 59.4756 38.9947 175.0170 61 W 5.3721 9.2858 125.7952 54.9717 33.7789 174.1466 62 Q 5.1196 9.1330 120.3314 54.2267 31.5999 174.7021 63 L 5.3797 8.0439 122.6539 53.3418 45.1597 175.2576 64 D 4.5848 8.7185 118.6548 54.1190 45.3867 174.0388 65 C 5.2801 9.0084 120.2584 58.4081 30.6297 172.8107 66 T 4.7678 8.6177 116.1663 60.6282 71.1996 171.8353 67 H 5.7301 8.4566 119.0033 53.1303 32.8381 173.5132 68 L 4.5250 8.4390 119.9874 54.9198 45.6008 175.6481 69 E 3.8669 9.8525 121.6905 57.5622 27.0464 175.6764 70 G 3.9270 8.5347 103.5314 45.7328 0.0000 174.0667 71 K 4.6261 8.0462 119.0699 54.2748 35.0963 174.8796 72 V 4.5921 8.0526 120.4267 61.6285 33.6206 174.4385 73 I 4.8279 8.4304 128.5559 59.3954 39.9540 174.2714 74 L 4.4759 8.7368 130.7482 54.1069 43.4189 175.4947 75 V 4.9727 8.8552 125.8358 60.9916 34.8962 173.8686 76 A 5.4512 9.4107 128.9702 50.2405 22.4959 174.9987 77 V 4.7882 9.1396 121.0116 61.4139 35.2312 174.2272 78 H 3.6147 9.1693 128.6971 54.6132 29.3111 175.7224 79 V 3.3095 7.7526 124.8433 65.9705 31.3703 178.2108 80 A 4.0714 7.4238 120.0694 53.8813 18.2546 177.8068 81 S 4.3969 7.4723 107.4678 56.6399 64.5504 175.5324 82 G 3.8990 8.4041 108.9677 44.9746 0.0000 172.9597 83 Y 4.4335 7.5368 122.5467 57.6303 39.7575 174.7735 84 I 5.1300 7.8765 118.5824 59.2692 41.4414 174.4485 85 E 4.8407 9.0706 121.0917 54.9900 33.6646 174.5790 86 A 5.3792 8.5497 124.4440 50.8570 23.0180 174.6265 87 E 4.7363 8.7672 116.8413 55.1755 33.9127 174.9371 88 V 4.3388 8.6962 127.5260 62.8700 32.2007 174.9001 89 I 4.6514 8.2464 121.8840 58.2442 39.1804 174.0000 90 P 4.3296 0.0000 0.0000 65.7460 31.1596 176.3044 91 A 4.5855 7.3529 118.2071 50.5214 22.4486 175.9001 92 E 4.1974 8.5348 122.5323 55.5873 28.4899 176.0745 93 T 4.6792 7.1412 112.5376 59.7322 73.3809 175.4960 94 G 3.8298 8.3068 109.2369 46.9589 0.0000 175.7606 95 Q 3.9421 7.9613 121.3000 59.3000 29.2330 178.1477 96 E 4.0973 7.9839 119.1443 59.7119 29.4146 179.5667 97 T 3.9035 8.0953 115.6399 66.5691 68.5043 176.6594 98 A 4.0861 8.6959 123.1221 55.1679 18.4889 179.0745 99 Y 4.1849 8.1978 118.1558 60.8942 38.8440 178.0223 100 F 3.9669 8.4270 121.5612 61.2959 39.4360 177.0327 101 L 4.0223 8.3858 118.6901 57.7666 41.4083 179.5181 102 L 4.0033 8.0365 118.8691 57.6405 41.6186 179.6634 103 K 3.6926 7.5135 117.8363 59.2501 31.9865 178.9443 104 L 3.7239 7.6530 120.3886 58.2584 41.7256 179.0399 105 A 4.0896 8.0782 119.4622 54.6827 18.3690 179.1356 106 G 3.6886 7.8589 102.4346 46.0538 0.0000 175.1270 107 R 3.9750 7.0061 119.3504 56.5404 30.9670 175.7031 108 W 5.0342 7.1469 115.2376 54.1279 32.5992 174.8033 109 P 4.5331 0.0000 0.0000 61.9442 28.9685 174.1824 110 V 4.3102 7.8378 118.8954 62.2180 31.5938 175.1112 111 K 4.5068 9.2025 127.9451 57.8270 34.3057 177.2184 112 T 5.1643 7.8147 115.3253 61.8212 73.0827 173.4033 113 V 4.8530 8.7957 119.2580 59.8638 34.9075 174.2115 114 H 5.4790 9.1295 122.9560 54.3357 31.1865 173.8084 115 T 4.7756 8.4186 112.6988 60.1206 72.9656 172.7985 116 D 5.3221 8.0441 120.5745 52.3741 41.5927 175.4676 117 N 4.4449 8.8938 116.3727 55.1571 39.3909 176.3123 118 G 4.0505 8.5382 104.7090 45.8947 0.0000 174.0463 119 S 4.2574 9.2101 122.7725 60.9933 62.7927 176.8620 120 N 4.2420 7.9464 118.8383 56.1008 36.8071 177.0941 121 F 4.6319 7.8690 118.6339 59.5730 39.2704 176.7678 122 T 4.3866 8.0902 108.3424 61.1325 69.2799 175.0705 123 S 4.2448 7.3091 117.3846 58.6482 63.6780 175.5948 124 T 3.9876 8.4421 112.4034 65.1354 68.5891 176.7516 125 T 3.8399 7.8560 115.6733 65.0223 67.3773 176.2285 126 V 3.7031 7.7920 119.8345 65.6343 31.5957 177.6786 127 K 3.9801 8.2829 119.3293 59.5980 31.9991 178.6318 128 A 4.0445 8.4529 121.0755 54.9612 18.2497 179.3535 129 A 4.0332 8.1605 119.2684 55.7707 18.5413 179.6537 130 C 4.1938 8.4994 115.4952 62.9725 28.1762 176.0864 131 E 3.9805 8.5620 121.0563 58.9537 29.0273 178.6470 132 W 4.1236 8.4439 127.8130 60.3397 30.9544 177.6568 133 G 3.8764 8.7904 103.3897 44.6136 0.0000 173.6152 134 G 3.8268 7.6365 108.2471 46.6916 0.0000 173.3531 135 I 4.5809 8.0859 120.2606 59.2101 38.9581 175.5741 136 K 4.4523 9.2179 128.5078 55.5413 33.6784 175.2894 137 Q 5.0152 8.5482 125.1527 54.4307 31.6130 174.8611 138 E 4.5237 8.3020 120.2765 54.8748 34.1429 174.1973 139 F 5.3130 8.3779 122.6813 56.4781 41.5978 172.0626 140 G 3.7316 9.1360 116.4509 47.3616 0.0000 174.1436 *148 Q 4.4381 9.2785 125.7941 55.9058 31.1537 176.0911 149 G 3.9150 8.0950 103.9044 48.1092 0.0000 174.8356 150 V 3.5440 7.4387 119.2715 66.3826 31.4773 177.7664 151 I 3.6784 7.7039 117.4318 64.1497 37.8495 177.7600 152 E 3.9679 8.0851 118.9206 59.4736 29.3726 179.2554 153 S 4.1152 8.1633 115.1225 61.8235 62.9099 176.6815 154 M 3.9980 8.0783 121.2266 58.5123 31.7459 178.4725 155 N 4.3000 8.1403 116.5307 56.1457 38.6951 177.3051 156 K 3.8982 7.9486 120.7553 59.7006 32.3093 178.5715 157 E 3.9780 8.6075 119.9640 58.8888 29.5184 178.4768 158 L 3.9249 8.5042 120.9124 58.1661 42.1300 179.0827 159 K 4.0409 8.1467 118.3990 59.2055 31.9284 179.1991 160 K 3.9129 7.9705 119.8403 59.7264 32.2373 178.9172 161 I 4.0059 7.9796 121.6517 63.8931 37.0243 178.4161 162 I 3.8326 8.4184 121.1574 64.4221 36.7131 178.6516 163 G 3.6563 8.0440 105.5664 48.0131 0.0000 175.4880 164 Q 4.1971 8.2493 120.4471 57.8626 28.6775 178.1218 165 V 4.3465 7.7135 110.9080 60.8997 32.3598 177.3113 166 R 3.8580 8.0376 120.7592 59.8368 29.5092 177.8881 167 D 4.4999 7.9846 116.7413 56.8474 41.1259 177.0727 168 Q 4.1879 8.1915 116.1885 56.6230 28.9829 175.7024 169 A 4.7966 7.2540 119.6738 49.8975 22.0220 176.1802 170 E 4.0361 8.9801 121.0573 58.9461 30.1413 177.6868 171 H 5.0562 7.6978 113.7098 52.9365 33.6371 174.3775 172 L 3.9872 8.4166 124.0321 58.3183 41.7107 179.1697 173 K 3.9360 8.2263 118.2697 60.5788 32.1021 179.0443 174 T 3.9141 7.8973 115.8701 66.3935 68.5637 176.3535 175 A 4.0009 7.8729 122.3034 55.2712 18.2833 179.7951 176 V 3.5814 8.2257 116.9951 66.4367 31.6122 178.3766 177 Q 4.1118 7.8563 117.3133 58.8672 28.4238 178.5822 178 M 4.0372 8.2201 119.9298 58.2162 31.9472 178.4237 179 A 4.0343 8.4534 121.3868 55.2430 18.4797 179.8004 180 V 3.5442 8.0472 116.7293 66.0481 31.6540 177.8503 181 F 4.0660 8.3137 120.3267 61.5005 39.2732 177.1066 182 I 3.8731 8.3423 119.5607 64.6693 36.7147 177.8891 183 H 4.0982 8.3655 118.0062 59.5626 30.0725 176.9440 184 N 4.4560 8.5766 118.2876 55.7051 38.0828 177.1363 185 K 4.0414 7.6551 118.6148 56.6593 32.6639 177.4046 186 K 3.9562 7.6447 120.9485 56.6650 32.8159 175.5091 187 R 4.7039 8.1880 123.4384 53.6977 32.5622 175.5180 188 K 4.0019 8.5745 120.9492 57.9332 32.3152 178.2353 189 G 3.8337 9.4262 111.1304 45.3316 0.0000 174.1424 190 G 3.9424 8.4416 107.0370 45.6628 0.0000 173.6945 191 I 4.4608 7.2391 118.5224 60.3461 40.9225 176.7872 192 G 3.5699 9.6872 113.8744 47.0081 0.0000 172.1999 193 G 3.8219 8.4391 107.3934 44.8956 0.0000 172.0817 194 Y 4.8626 8.3892 115.2513 56.1199 40.8204 176.0303 195 S 4.9288 8.7450 118.5972 56.0607 66.5198 175.3575 196 A 4.0679 8.4264 123.8468 55.3790 18.2559 180.0935 197 G 3.7598 8.3575 104.1998 48.1457 0.0000 175.7377 198 E 4.2364 8.0627 120.6253 58.9985 29.5224 179.5355 199 R 3.6915 8.2486 118.4527 59.0475 30.0350 178.8430 200 I 3.3263 7.6024 118.3143 64.2094 37.8233 178.4566 201 V 3.7010 7.2889 111.9021 64.1107 31.2309 178.2414 202 D 4.2446 8.0102 118.0059 57.3502 41.0036 178.1608 203 I 3.6149 7.9171 120.6852 64.6643 36.9145 178.5932 204 I 3.7571 7.7931 119.1251 64.0460 37.2100 178.1380 205 A 4.1619 8.3543 122.3072 55.4691 18.4251 179.8921 206 T 3.9058 8.3095 108.3575 64.4337 68.5509 175.5355 207 D 4.5055 7.5518 119.5392 55.9244 41.4725 177.4978 208 I 3.9893 7.5178 118.9092 63.1157 37.2656 175.7602 209 Q 4.2468 7.4711 122.6811 55.8834 29.0105 175.1896 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 56 C 8.20 4.50 0.00 3.01 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 57 S 8.89 3.82 0.00 3.88 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 58 P 0.00 4.43 0.00 2.23 2.14 0.00 3.65 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.10 0.00 59 G 8.33 4.38 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 0.00 60 I 7.35 4.98 1.73 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 1.18 1.08 0.76 0.00 0.00 61 W 9.29 5.37 0.00 3.19 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 62 Q 9.13 5.12 0.00 1.98 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.69 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 63 L 8.04 5.38 0.00 1.24 1.52 1.06 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 64 D 8.72 4.58 0.00 2.68 2.44 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 65 C 9.01 5.28 0.00 3.00 2.71 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 66 T 8.62 4.77 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 1.24 0.00 0.00 67 H 8.46 5.73 0.00 3.02 3.21 0.00 5.81 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.44 4.52 0.00 1.67 1.51 0.93 0.98 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 69 E 9.85 3.87 0.00 2.10 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 2.23 2.30 0.00 70 G 8.53 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 71 K 8.05 4.63 0.00 1.96 1.70 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.34 7.81 72 V 8.05 4.59 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 0.92 0.00 0.00 0.97 0.00 0.00 73 I 8.43 4.83 1.83 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.58 0.90 0.00 0.00 74 L 8.74 4.48 0.00 1.48 1.01 0.93 0.27 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 75 V 8.86 4.97 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 1.00 0.00 0.00 0.94 0.00 0.00 76 A 9.41 5.45 1.66 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 0.00 0.00 77 V 9.14 4.79 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 0.87 0.00 0.00 0.94 0.00 0.00 78 H 9.17 3.61 0.00 1.40 2.60 0.00 5.68 0.00 0.00 0.00 0.00 6.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 V 7.75 3.31 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 0.78 0.00 0.00 0.86 0.00 0.00 80 A 7.42 4.07 1.11 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 0.00 0.00 81 S 7.47 4.40 0.00 3.78 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 G 8.40 3.90 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 0.00 0.00 0.00 83 Y 7.54 4.43 0.00 2.99 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 84 I 7.88 5.13 1.89 0.00 0.00 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 1.20 0.70 0.83 0.00 0.00 85 E 9.07 4.84 0.00 2.14 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 2.49 0.00 86 A 8.55 5.38 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 87 E 8.77 4.74 0.00 2.27 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 0.00 2.28 2.30 0.00 88 V 8.70 4.34 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 0.93 0.00 0.00 0.95 0.00 0.00 89 I 8.25 4.65 1.88 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.85 0.93 0.00 0.00 90 P 0.00 4.33 0.00 2.19 2.24 0.00 3.90 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 1.99 1.98 0.00 91 A 7.35 4.59 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 92 E 8.53 4.20 0.00 1.92 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 2.17 2.18 0.00 93 T 7.14 4.68 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 1.18 0.00 0.00 94 G 8.31 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 0.00 0.00 0.00 95 Q 7.96 3.94 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 96 E 7.98 4.10 0.00 2.06 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 2.63 0.00 97 T 8.10 3.90 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 1.20 0.00 0.00 98 A 8.70 4.09 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 Y 8.20 4.18 0.00 3.15 3.22 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 0.00 100 F 8.43 3.97 0.00 3.14 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 0.00 101 L 8.39 4.02 0.00 2.13 1.77 1.04 0.50 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 0.00 102 L 8.04 4.00 0.00 1.77 1.64 0.80 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 103 K 7.51 3.69 0.00 1.57 1.54 0.00 0.61 0.00 0.00 0.97 0.00 0.00 2.60 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.13 0.98 7.81 104 L 7.65 3.72 0.00 1.30 1.54 0.60 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 105 A 8.08 4.09 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 0.00 106 G 7.86 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 0.00 0.00 0.00 107 R 7.01 3.98 0.00 1.79 1.83 0.00 2.98 0.00 0.00 2.98 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.76 0.00 108 W 7.15 5.03 0.00 3.34 3.31 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 0.00 109 P 0.00 4.53 0.00 2.33 2.09 0.00 3.95 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.18 0.00 110 V 7.84 4.31 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 0.67 0.00 0.00 0.46 0.00 0.00 111 K 9.20 4.51 0.00 1.92 1.85 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.47 7.81 112 T 7.81 5.16 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 1.21 0.00 0.00 113 V 8.80 4.85 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 0.93 0.00 0.00 0.91 0.00 0.00 114 H 9.13 5.48 0.00 3.01 3.09 0.00 5.58 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 T 8.42 4.78 3.15 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 0.73 0.00 0.00 116 D 8.04 5.32 0.00 2.85 2.78 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 0.00 117 N 8.89 4.44 0.00 2.74 2.92 0.00 0.00 6.71 7.94 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 0.00 118 G 8.54 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 0.00 119 S 9.21 4.26 0.00 3.84 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 0.00 120 N 7.95 4.24 0.00 2.68 3.05 0.00 0.00 5.19 7.30 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 0.00 121 F 7.87 4.63 0.00 3.38 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 0.00 122 T 8.09 4.39 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 0.81 0.00 0.00 123 S 7.31 4.24 0.00 4.04 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 0.00 124 T 8.44 3.99 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 0.00 125 T 7.86 3.84 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 1.26 0.00 0.00 126 V 7.79 3.70 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 1.33 0.00 0.00 1.14 0.00 0.00 127 K 8.28 3.98 0.00 2.10 2.08 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.57 7.81 128 A 8.45 4.04 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 0.00 129 A 8.16 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 130 C 8.50 4.19 0.00 3.19 3.30 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 0.00 131 E 8.56 3.98 0.00 2.10 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 0.00 2.34 2.35 0.00 132 W 8.44 4.12 0.00 3.42 3.44 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 0.00 133 G 8.79 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 0.00 134 G 7.64 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 0.00 0.00 0.00 135 I 8.09 4.58 1.91 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 1.36 0.71 0.93 0.00 0.00 136 K 9.22 4.45 0.00 1.79 1.75 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.42 7.81 137 Q 8.55 5.02 0.00 1.80 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.54 0.00 0.00 0.00 0.00 0.00 2.22 2.35 0.00 138 E 8.30 4.52 0.00 1.89 1.68 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 0.00 2.20 2.48 0.00 139 F 8.38 5.31 0.00 2.94 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 0.00 140 G 9.14 3.73 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 0.00 0.00 0.00 *148 Q 9.28 4.44 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.86 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 149 G 8.09 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 0.00 0.00 0.00 150 V 7.44 3.54 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 0.94 0.00 0.00 0.89 0.00 0.00 151 I 7.70 3.68 1.86 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 1.62 1.05 0.95 0.00 0.00 152 E 8.09 3.97 0.00 2.26 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 2.40 2.40 0.00 153 S 8.16 4.12 0.00 3.94 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 0.00 154 M 8.08 4.00 0.00 1.97 2.21 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.89 0.00 155 N 8.14 4.30 0.00 2.90 2.87 0.00 0.00 6.72 7.21 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 0.00 156 K 7.95 3.90 0.00 2.07 1.89 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.45 7.81 157 E 8.61 3.98 0.00 2.05 1.93 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 2.35 2.34 0.00 158 L 8.50 3.92 0.00 1.81 1.79 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.15 4.04 0.00 2.12 1.86 0.00 1.82 0.00 0.00 1.58 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.55 7.81 160 K 7.97 3.91 0.00 1.85 2.03 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.49 7.81 161 I 7.98 4.01 1.91 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 1.57 1.31 0.96 0.00 0.00 162 I 8.42 3.83 2.05 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 1.48 1.08 0.93 0.00 0.00 163 G 8.04 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 0.00 0.00 0.00 164 Q 8.25 4.20 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.67 0.00 0.00 0.00 0.00 0.00 2.39 2.62 0.00 165 V 7.71 4.35 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 0.79 0.00 0.00 1.03 0.00 0.00 166 R 8.04 3.86 0.00 2.13 1.96 0.00 3.15 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.75 0.00 167 D 7.98 4.50 0.00 2.71 2.71 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 0.00 168 Q 8.19 4.19 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.62 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 169 A 7.25 4.80 1.26 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 0.00 0.00 170 E 8.98 4.04 0.00 1.89 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 2.26 2.31 0.00 171 H 7.70 5.06 0.00 3.19 3.16 0.00 5.82 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 L 8.42 3.99 0.00 1.92 1.69 0.94 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 173 K 8.23 3.94 0.00 2.05 2.10 0.00 1.53 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.51 1.58 7.81 174 T 7.90 3.91 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 0.00 175 A 7.87 4.00 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 0.00 176 V 8.23 3.58 2.30 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 1.07 0.00 0.00 0.98 0.00 0.00 177 Q 7.86 4.11 0.00 2.26 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.66 0.00 0.00 0.00 0.00 0.00 2.70 2.60 0.00 178 M 8.22 4.04 0.00 2.05 2.27 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.48 0.00 179 A 8.45 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 0.00 180 V 8.05 3.54 2.29 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 1.12 0.00 0.00 1.06 0.00 0.00 181 F 8.31 4.07 0.00 3.30 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 0.00 182 I 8.34 3.87 2.12 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 1.57 1.07 0.98 0.00 0.00 183 H 8.37 4.10 0.00 3.14 3.48 0.00 5.76 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 N 8.58 4.46 0.00 2.78 2.92 0.00 0.00 6.84 7.59 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 0.00 185 K 7.66 4.04 0.00 1.76 1.78 0.00 1.37 0.00 0.00 1.17 0.00 0.00 2.13 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.89 1.27 7.81 186 K 7.64 3.96 0.00 2.02 1.64 0.00 1.59 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.43 7.81 187 R 8.19 4.70 0.00 1.86 1.92 0.00 3.17 0.00 0.00 3.47 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.73 0.00 188 K 8.57 4.00 0.00 1.82 1.76 0.00 1.80 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.46 7.81 189 G 9.43 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 0.00 0.00 0.00 190 G 8.44 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 0.00 191 I 7.24 4.46 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.89 0.90 0.00 0.00 192 G 9.69 3.57 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 0.00 0.00 0.00 193 G 8.44 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 0.00 194 Y 8.39 4.86 0.00 2.91 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 0.00 195 S 8.75 4.93 0.00 4.27 4.07 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 0.00 196 A 8.43 4.07 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 0.00 197 G 8.36 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 0.00 198 E 8.06 4.24 0.00 2.34 2.28 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 2.39 2.40 0.00 199 R 8.25 3.69 0.00 1.92 1.84 0.00 3.03 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.76 0.00 200 I 7.60 3.33 1.29 0.00 0.00 -1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.72 0.23 0.00 0.00 201 V 7.29 3.70 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 0.89 0.00 0.00 1.05 0.00 0.00 202 D 8.01 4.24 0.00 2.85 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 0.00 203 I 7.92 3.61 1.95 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 1.42 0.91 0.86 0.00 0.00 204 I 7.79 3.76 1.95 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.52 1.01 0.00 0.00 205 A 8.35 4.16 1.39 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 0.00 206 T 8.31 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 1.28 0.00 0.00 207 D 7.55 4.51 0.00 2.73 2.86 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 0.00 208 I 7.52 3.99 2.02 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 1.54 0.95 0.91 0.00 0.00 209 Q 7.47 4.25 0.00 2.13 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.55 0.00 0.00 0.00 0.00 0.00 2.28 2.25 0.00 * Residues marked with a * may have inaccurate shift predictions.