NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 33 T 4.2005 8.0333 117.3089 63.3474 70.5199 172.1311 34 I 4.4354 8.0353 127.1683 59.2651 39.2680 173.2693 35 Y 4.5131 9.4553 128.2189 57.1720 39.9378 174.7241 36 A 5.2456 8.7001 125.0243 48.9721 19.3320 173.8300 37 P 4.5598 0.0000 0.0000 62.9524 32.3377 176.6660 38 T 4.4082 10.0607 117.1671 62.0254 70.6147 174.0382 39 V 4.2329 8.4032 126.8524 60.9623 32.6665 175.0581 40 R 4.4890 8.4442 126.0061 54.3156 32.5077 175.0004 41 V 4.1127 8.3049 123.2965 61.5048 32.3850 175.4970 42 T 4.0812 8.3364 124.6399 62.5477 69.0001 172.8249 43 P 4.0622 0.0000 0.0000 62.2355 32.2466 175.4275 44 N 4.0158 5.7700 120.4421 51.8782 39.3550 173.6053 45 P 4.0857 0.0000 0.0000 65.7817 31.4430 177.6460 46 A 4.1486 8.1001 119.0330 53.9911 18.4560 177.9307 47 W 4.6210 7.7333 116.8808 55.6871 29.6083 174.4760 48 P 4.3811 0.0000 0.0000 62.4935 31.3627 175.8278 49 Q 4.0692 8.6919 123.7389 56.0596 29.3881 175.4045 50 V 4.4453 8.1749 118.5947 59.5316 34.7163 175.6521 51 S 4.4969 8.1257 114.5150 57.7254 64.4013 174.2119 52 W 4.6690 7.5718 118.0671 56.6985 28.9641 174.6316 53 Q 4.8782 9.6950 117.6992 54.0072 31.1692 174.6702 54 L 5.2602 8.5969 125.6771 53.2202 44.7640 174.6085 55 L 4.8059 8.9501 129.2934 54.1346 43.5746 175.2576 56 V 4.4769 8.7007 127.6611 61.3761 31.9319 175.5925 57 A 4.3113 8.4006 130.0018 51.4267 19.3749 177.1510 58 K 4.0406 8.4779 119.3823 55.7887 32.4124 175.8408 59 P 4.7732 0.0000 0.0000 62.5946 32.2333 175.9732 60 S 4.8751 8.6678 117.1906 56.7071 66.0849 172.7141 61 A 4.7070 8.1569 120.0400 51.2881 21.2565 176.3571 62 A 4.0701 8.2185 123.1497 52.3545 17.6859 179.1326 63 R 3.9763 8.7284 119.2798 59.2949 30.3530 179.1021 64 I 4.0610 7.6939 116.6514 63.3219 38.4295 176.7049 65 I 4.0373 7.7048 120.5455 63.6318 37.9408 176.4336 66 D 4.5903 7.1961 119.7598 52.5982 39.8469 174.7481 67 S 4.8216 7.1784 115.5018 56.3001 66.6817 173.1785 68 P 4.8494 0.0000 0.0000 63.9624 32.0724 176.2215 69 R 4.3506 8.3187 120.4122 56.4119 31.4322 176.3249 70 I 4.3492 8.0388 122.7087 59.6780 38.8802 174.7925 71 N 5.1304 8.9545 125.8642 53.1215 39.9586 174.7755 72 V 4.8114 8.9191 122.4308 60.0814 35.3147 174.7030 73 R 5.0366 9.5446 125.4117 53.4314 29.6273 174.6057 74 P 4.0918 0.0000 0.0000 64.5138 32.2542 177.2192 75 T 4.7278 7.3942 107.1110 58.3140 71.7565 172.5369 76 P 4.2287 0.0000 0.0000 65.6834 31.3207 177.7858 77 G 3.9087 7.9735 103.6965 45.7511 0.0000 173.0023 78 E 4.7811 8.0451 119.4529 54.2557 32.5603 174.5705 79 L 5.0769 8.3441 120.9280 53.3795 44.6960 175.6514 80 Q 4.7591 8.8649 120.9573 54.3630 33.4359 174.0653 81 V 4.8169 7.9995 111.2635 59.7761 35.2677 175.7435 82 Y 4.2059 8.0772 122.3433 58.8762 38.1299 176.3681 83 H 4.4584 9.1883 121.0864 56.1005 29.8875 174.7567 84 G 4.0375 8.7141 107.7712 45.8540 0.0000 173.2139 85 A 4.8020 7.7081 118.8078 50.8385 22.4312 176.3971 86 G 4.0623 8.1711 105.4990 45.0575 0.0000 173.0839 87 W 5.3973 8.7353 121.3830 56.0917 30.0053 177.6256 88 A 4.1378 8.9827 124.4192 54.9495 18.4651 178.1248 89 Q 4.4621 7.8089 113.9230 53.1480 32.7383 172.6648 90 P 4.7181 0.0000 0.0000 62.1048 33.2835 177.0916 91 A 3.1938 8.4139 122.8050 55.4347 18.0330 180.3739 92 T 3.6685 7.5310 107.5535 65.0139 68.7716 176.3914 93 D 4.2859 7.7626 121.2089 57.1421 40.9214 178.2497 94 M 3.9268 7.9648 119.3851 58.3147 32.0713 178.5794 95 L 3.8998 7.8601 120.3292 57.9702 42.2910 178.4551 96 E 3.9135 8.2105 119.2351 59.6029 29.6151 178.5935 97 D 4.3765 8.4348 119.1589 57.5369 40.8919 178.9719 98 S 4.1190 8.4654 116.0984 61.4632 62.7364 176.9515 99 V 3.3864 7.6697 120.5546 65.7646 31.4276 177.9230 100 V 3.8274 7.8601 117.9027 66.5788 31.2433 178.3341 101 R 4.1143 8.0533 117.1655 59.2189 29.6433 178.9665 102 A 3.8843 7.6274 119.3697 54.9493 18.7310 179.3579 103 F 4.3913 7.9112 116.3701 60.7664 38.7928 177.6408 104 E 4.0291 8.1298 116.7209 59.6922 29.5122 178.9898 105 D 4.5902 8.6938 116.7275 55.9655 40.8841 178.3676 106 S 4.4843 7.8614 115.2356 59.6022 63.3420 175.3784 107 G 3.9135 8.1451 107.8753 45.7762 0.0000 173.7220 108 K 4.4090 8.2823 118.0510 55.8476 33.3228 175.9923 109 I 4.3660 7.3591 118.8317 59.3085 39.9038 174.2988 110 A 3.9784 8.5943 131.3863 53.9917 18.8371 176.4659 111 A 4.6226 7.7166 116.9603 50.2121 21.7377 175.2714 112 V 4.9273 8.3795 120.7351 61.8168 34.6451 174.4728 113 A 4.7926 9.0339 127.7994 49.8190 23.2146 175.9543 114 R 4.5184 8.0829 116.1018 55.4110 30.5168 177.3141 *121 S 4.1700 7.8029 110.9210 58.5527 63.7026 171.9919 122 D 4.4784 9.2056 127.9655 56.1567 42.1534 176.1702 123 Y 5.1375 7.8844 114.7157 55.8713 41.9615 174.2928 124 K 4.9259 8.7680 123.3606 54.6879 35.0764 174.5732 125 L 5.1284 9.0659 130.5196 53.9659 43.4640 174.6810 126 A 5.1013 9.3698 129.6305 50.2060 21.5386 174.8794 127 I 4.9132 8.4059 123.2271 59.5545 40.3912 173.9178 128 D 5.1504 8.9507 127.2335 52.6486 43.1662 175.0358 129 V 4.3551 8.6269 127.0229 62.2749 31.7159 175.5276 130 R 4.5171 9.3229 128.3706 58.2314 31.1400 177.3052 131 R 4.7532 7.7851 113.2955 55.1204 33.0938 174.4514 132 F 5.0421 8.8122 123.2024 56.9211 40.1871 172.4701 133 E 5.2602 9.9345 121.5474 54.7297 34.2002 174.6058 134 S 4.7583 9.5193 116.4145 57.5465 63.6131 172.4714 135 D 5.0935 8.9430 129.4728 52.8950 41.9228 176.3142 136 Y 3.8226 8.8764 124.3638 59.8870 38.4039 178.0468 137 A 3.6873 9.3469 118.8497 53.1279 16.4441 177.2016 138 G 4.3501 8.8129 112.8378 47.0649 0.0000 174.6798 139 Q 4.0318 7.6639 117.3727 55.2594 29.4728 177.5135 140 S 4.6484 8.5187 112.3484 59.0161 63.9536 174.0038 141 L 4.8560 7.6362 121.1027 52.0848 44.1425 174.6934 142 P 4.3830 0.0000 0.0000 62.3862 33.2968 174.5782 143 A 4.9965 8.5593 122.9773 49.8253 21.6902 175.8974 144 A 3.7957 8.6777 125.2572 51.9576 19.5860 176.5285 145 T 4.8584 9.1722 120.5876 61.7535 72.0278 173.2203 146 I 4.9369 8.5009 126.9283 59.3509 40.7014 174.2271 147 E 5.2252 9.5490 127.8639 54.3652 32.8031 174.2778 148 L 5.2128 9.1543 125.9695 54.4399 45.0506 174.1712 149 N 5.4708 9.6241 118.0038 51.8066 42.0393 172.5619 150 A 5.2499 9.1603 128.4653 50.2618 21.7271 175.2590 151 K 5.1035 9.3033 122.4600 54.6200 35.2312 175.3398 152 L 5.1462 8.7638 126.2560 53.6374 43.7813 175.5702 153 L 4.9842 9.0583 127.3778 54.0344 44.5011 175.1255 154 H 5.0455 8.6006 120.7299 54.8226 30.9412 175.6612 155 S 4.0465 8.6406 123.4450 61.8000 63.0361 176.0847 156 S 4.2069 7.7911 112.8743 61.4965 62.7919 175.3642 157 D 4.3339 8.0135 119.6721 54.9038 41.1660 176.2685 158 Q 3.4452 7.6899 116.3126 57.2967 26.6988 173.8877 159 R 4.5459 7.4686 117.4976 54.2195 33.0067 175.3226 160 V 3.8387 8.4762 127.0273 63.2159 31.4169 175.7830 161 V 3.8072 8.7368 129.1359 65.4457 32.0510 175.4673 162 A 4.6144 7.6767 119.0822 51.8921 22.5250 174.7058 163 S 5.6227 8.7552 113.7578 57.3303 67.0994 174.1610 164 R 4.3883 8.1744 122.3381 55.1568 33.6168 173.2294 165 T 4.9347 8.0155 121.1603 62.0132 70.3131 173.8415 166 F 4.8087 9.0464 124.9122 55.9583 41.8424 174.8060 167 T 5.1088 8.4494 118.4884 61.8987 72.4104 173.5928 168 V 4.4934 8.8815 124.5343 61.3027 35.3214 173.4238 169 A 5.1031 8.6508 128.7200 50.1526 21.7310 175.0529 170 R 4.5542 8.6924 122.5059 53.2988 32.9242 173.7934 171 P 4.6074 0.0000 0.0000 62.8012 31.8266 176.3889 172 S 4.2728 8.9155 119.0357 58.0189 62.9439 173.9681 173 S 4.4575 8.3175 119.2411 58.5487 63.4608 173.0284 174 S 4.4401 7.4598 114.1875 58.2776 65.3250 174.0001 175 T 4.2555 8.2985 115.6611 62.7277 67.7328 174.4888 176 D 4.5357 7.8695 122.1511 54.6320 41.7071 177.3861 177 T 3.2393 8.4794 113.5452 64.7020 68.5994 176.2106 178 A 3.7229 8.0602 122.8783 55.1643 18.3451 179.3908 179 A 3.9234 7.7896 118.8887 54.9612 18.3901 180.1791 180 V 3.3984 7.4576 116.1916 66.0327 31.8163 177.8479 181 A 4.3191 8.0660 120.7450 55.2087 17.9767 179.0945 182 A 3.9594 8.0384 118.9986 55.7101 18.3237 179.8542 183 A 3.9068 7.7861 118.3847 55.1925 18.3149 179.8383 184 F 3.9135 8.7275 116.8965 60.4677 38.9103 177.5162 185 E 3.9515 8.3353 118.9155 59.3505 29.4231 178.7361 186 Q 3.9556 7.8363 117.8302 59.0456 28.7427 178.8276 187 A 3.9186 8.0842 121.6630 55.3161 18.5191 179.7205 188 L 3.9296 8.3086 117.7285 58.0108 41.5292 180.0274 189 T 3.8414 7.9957 115.9185 66.5869 68.4114 176.5096 190 Q 3.9691 8.3030 121.9295 59.2533 29.1597 178.6902 191 V 3.6559 8.0402 120.4617 65.0975 31.3472 178.5249 192 T 3.7578 7.8024 116.0915 66.4245 68.2737 176.8103 193 T 3.9907 8.2195 118.0615 66.9697 68.6953 176.4363 194 E 4.1609 8.5915 120.6672 59.5244 29.3884 179.5806 195 L 3.7027 7.7476 119.0378 57.3282 41.5165 179.6857 196 V 3.1991 7.7202 118.3216 65.7205 31.4380 178.0344 197 G 3.2984 7.1585 105.5375 47.6068 0.0000 175.3384 198 W 4.2251 8.1502 130.9305 60.1498 30.7138 178.1654 199 T 3.5571 8.3999 115.8997 66.5685 67.9578 176.4435 200 L 4.1501 8.0915 120.8610 57.9327 41.6789 179.5326 201 I 3.6752 7.5280 119.4200 64.7562 37.0318 178.5557 202 T 3.6021 7.8289 116.7512 66.5365 68.2019 176.8428 203 G 2.2049 7.5951 107.5855 47.1725 0.0000 175.2264 204 Q 4.1843 8.0845 121.8741 59.3999 28.9493 178.4459 205 Q 3.9626 7.8303 117.4030 59.0577 28.7285 178.3686 206 D 4.4276 7.3479 118.0355 56.8198 41.4539 178.2390 207 S 4.2856 7.8469 113.9758 60.9205 63.6728 175.4561 208 Q 4.4046 7.7322 123.1782 54.7989 27.5919 176.1682 209 T 4.0767 7.4770 112.5331 62.3836 68.1831 173.3256 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 T 8.03 4.20 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 0.70 0.00 0.00 34 I 8.04 4.44 1.79 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.18 0.94 0.00 0.00 35 Y 9.46 4.51 0.00 2.88 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 36 A 8.70 5.25 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 37 P 0.00 4.56 0.00 2.04 2.07 0.00 3.68 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.38 0.00 38 T 10.06 4.41 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 1.23 0.00 0.00 39 V 8.40 4.23 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 0.82 0.00 0.00 0.92 0.00 0.00 40 R 8.44 4.49 0.00 1.79 1.80 0.00 3.25 0.00 0.00 3.16 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 41 V 8.30 4.11 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 1.00 0.00 0.00 0.94 0.00 0.00 42 T 8.34 4.08 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 1.15 0.00 0.00 43 P 0.00 4.06 0.00 1.93 2.14 0.00 3.60 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.25 0.00 44 N 5.77 4.02 0.00 1.44 1.42 0.00 0.00 7.11 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 45 P 0.00 4.09 0.00 1.99 2.06 0.00 3.51 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.01 0.00 46 A 8.10 4.15 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 47 W 7.73 4.62 0.00 3.49 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 48 P 0.00 4.38 0.00 2.25 2.14 0.00 3.92 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 2.06 2.03 0.00 49 Q 8.69 4.07 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 50 V 8.17 4.45 1.14 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 0.77 0.00 0.00 -0.21 0.00 0.00 51 S 8.13 4.50 0.00 3.92 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 52 W 7.57 4.67 0.00 3.68 3.18 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 0.00 0.00 0.00 53 Q 9.70 4.88 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.80 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 54 L 8.60 5.26 0.00 1.96 1.33 1.06 -0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 55 L 8.95 4.81 0.00 1.81 1.68 0.99 0.71 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 56 V 8.70 4.48 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 0.88 0.00 0.00 1.09 0.00 0.00 57 A 8.40 4.31 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 58 K 8.48 4.04 0.00 1.77 1.78 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.69 1.47 7.81 59 P 0.00 4.77 0.00 1.92 2.04 0.00 3.63 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.09 0.00 60 S 8.67 4.88 0.00 3.87 3.98 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 0.00 0.00 0.00 61 A 8.16 4.71 1.20 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 62 A 8.22 4.07 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 63 R 8.73 3.98 0.00 1.89 2.03 0.00 3.13 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.65 0.00 64 I 7.69 4.06 1.89 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 1.45 0.77 0.95 0.00 0.00 65 I 7.70 4.04 2.01 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 1.30 0.74 0.87 0.00 0.00 66 D 7.20 4.59 0.00 2.65 2.59 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 67 S 7.18 4.82 0.00 4.04 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 68 P 0.00 4.85 0.00 2.20 2.33 0.00 3.77 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.02 0.00 69 R 8.32 4.35 0.00 1.73 1.89 0.00 3.27 0.00 0.00 3.21 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 70 I 8.04 4.35 1.89 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.14 0.65 0.90 0.00 0.00 71 N 8.95 5.13 0.00 2.99 2.84 0.00 0.00 6.56 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 72 V 8.92 4.81 1.43 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 0.20 0.00 0.00 1.04 0.00 0.00 73 R 9.54 5.04 0.00 1.91 2.05 0.00 3.37 0.00 0.00 3.51 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.63 0.00 74 P 0.00 4.09 0.00 2.06 1.96 0.00 3.61 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 1.92 1.99 0.00 75 T 7.39 4.73 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 1.16 0.00 0.00 76 P 0.00 4.23 0.00 2.07 2.19 0.00 3.67 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 77 G 7.97 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 78 E 8.05 4.78 0.00 2.03 1.80 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 2.20 2.22 0.00 79 L 8.34 5.08 0.00 1.50 1.55 0.96 0.89 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 80 Q 8.86 4.76 0.00 1.86 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.77 0.00 0.00 0.00 0.00 0.00 2.24 2.27 0.00 81 V 8.00 4.82 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 0.70 0.00 0.00 0.80 0.00 0.00 82 Y 8.08 4.21 0.00 2.90 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 83 H 9.19 4.46 0.00 3.16 3.28 0.00 6.05 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 84 G 8.71 4.04 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 0.00 0.00 0.00 85 A 7.71 4.80 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 86 G 8.17 4.06 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 0.00 0.00 0.00 87 W 8.74 5.40 0.00 3.27 3.09 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 0.00 0.00 0.00 0.00 88 A 8.98 4.14 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 89 Q 7.81 4.46 0.00 2.13 1.92 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 2.23 2.29 0.00 90 P 0.00 4.72 0.00 2.13 1.96 0.00 4.20 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 1.91 0.00 91 A 8.41 3.19 0.21 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 92 T 7.53 3.67 4.18 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 0.00 0.00 1.14 0.00 0.00 93 D 7.76 4.29 0.00 2.79 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 94 M 7.96 3.93 0.00 1.81 1.82 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.38 0.00 95 L 7.86 3.90 0.00 1.85 1.77 0.93 0.80 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 96 E 8.21 3.91 0.00 2.21 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 2.37 0.00 97 D 8.43 4.38 0.00 2.83 2.69 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 98 S 8.47 4.12 0.00 3.85 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 99 V 7.67 3.39 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 1.08 0.00 0.00 0.89 0.00 0.00 100 V 7.86 3.83 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 1.07 0.00 0.00 1.04 0.00 0.00 101 R 8.05 4.11 0.00 2.11 1.97 0.00 3.38 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 102 A 7.63 3.88 1.23 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 0.00 0.00 0.00 103 F 7.91 4.39 0.00 3.33 2.99 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 0.00 104 E 8.13 4.03 0.00 2.24 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 2.38 2.42 0.00 105 D 8.69 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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 0.00 114 R 8.08 4.52 0.00 1.79 1.91 0.00 3.26 0.00 0.00 3.16 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 *121 S 7.80 4.17 0.00 3.85 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 0.00 122 D 9.21 4.48 0.00 2.71 2.32 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 0.00 123 Y 7.88 5.14 0.00 2.69 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 0.00 124 K 8.77 4.93 0.00 1.85 1.68 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.83 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.37 7.81 125 L 9.07 5.13 0.00 1.92 1.66 1.22 1.53 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 0.00 126 A 9.37 5.10 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 0.00 127 I 8.41 4.91 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 136 Y 8.88 3.82 0.00 3.08 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 0.00 137 A 9.35 3.69 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 0.00 138 G 8.81 4.35 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 0.00 139 Q 7.66 4.03 0.00 2.30 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.90 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 140 S 8.52 4.65 0.00 4.04 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 0.00 141 L 7.64 4.86 0.00 1.46 1.50 0.90 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 142 P 0.00 4.38 0.00 1.76 0.90 0.00 3.40 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.55 0.00 143 A 8.56 5.00 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 0.00 144 A 8.68 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0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.97 0.00 0.00 161 V 8.74 3.81 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 0.61 0.00 0.00 1.03 0.00 0.00 162 A 7.68 4.61 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 0.00 163 S 8.76 5.62 0.00 3.78 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 0.00 164 R 8.17 4.39 0.00 1.23 0.66 0.00 2.21 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.11 0.00 165 T 8.02 4.93 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 1.21 0.00 0.00 166 F 9.05 4.81 0.00 2.81 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 0.00 167 T 8.45 5.11 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 1.20 0.00 0.00 168 V 8.88 4.49 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 0.93 0.00 0.00 0.95 0.00 0.00 169 A 8.65 5.10 1.12 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 0.00 0.00 170 R 8.69 4.55 0.00 1.52 1.72 0.00 3.24 0.00 0.00 3.16 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.68 0.00 171 P 0.00 4.61 0.00 2.00 1.99 0.00 3.69 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 1.93 1.92 0.00 172 S 8.92 4.27 0.00 3.67 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 0.00 173 S 8.32 4.46 0.00 3.99 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 0.00 174 S 7.46 4.44 0.00 3.83 3.72 0.00 0.00 0.00 0.00 0.00 0.00 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 8.30 4.26 4.33 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 1.26 0.00 0.00 176 D 7.87 4.54 0.00 2.73 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 T 8.48 3.24 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 0.55 0.00 0.00 178 A 8.06 3.72 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 0.00 179 A 7.79 3.92 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 0.00 180 V 7.46 3.40 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 1.16 0.00 0.00 0.84 0.00 0.00 181 A 8.07 4.32 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 0.00 182 A 8.04 3.96 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 0.00 183 A 7.79 3.91 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 0.00 184 F 8.73 3.91 0.00 3.50 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 0.00 185 E 8.34 3.95 0.00 2.15 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 0.00 2.33 2.44 0.00 186 Q 7.84 3.96 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 187 A 8.08 3.92 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 0.00 188 L 8.31 3.93 0.00 1.97 1.73 0.93 0.67 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 0.00 189 T 8.00 3.84 4.40 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 1.22 0.00 0.00 190 Q 8.30 3.97 0.00 2.09 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.80 0.00 0.00 0.00 0.00 0.00 2.51 2.39 0.00 191 V 8.04 3.66 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 0.85 0.00 0.00 192 T 7.80 3.76 4.35 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 1.08 0.00 0.00 193 T 8.22 3.99 4.47 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 1.44 0.00 0.00 194 E 8.59 4.16 0.00 2.14 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 0.00 2.49 2.46 0.00 195 L 7.75 3.70 0.00 1.63 1.51 0.68 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 196 V 7.72 3.20 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 0.28 0.00 0.00 -0.17 0.00 0.00 197 G 7.16 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 0.00 0.00 0.00 198 W 8.15 4.23 0.00 3.66 3.43 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 0.00 199 T 8.40 3.56 4.78 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 1.32 0.00 0.00 200 L 8.09 4.15 0.00 1.56 1.68 0.66 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 201 I 7.53 3.68 1.83 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.80 0.91 0.00 0.00 202 T 7.83 3.60 3.25 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 0.64 0.00 0.00 203 G 7.60 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 Q 8.08 4.18 0.00 2.64 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.67 0.00 0.00 0.00 0.00 0.00 2.49 2.57 0.00 205 Q 7.83 3.96 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.73 0.00 0.00 0.00 0.00 0.00 2.38 2.53 0.00 206 D 7.35 4.43 0.00 2.44 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 S 7.85 4.29 0.00 4.15 3.98 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 0.00 0.00 0.00 208 Q 7.73 4.40 0.00 2.02 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.73 0.00 0.00 0.00 0.00 0.00 2.43 2.34 0.00 209 T 7.48 4.08 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 1.22 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.