NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 G 4.0473 8.2133 108.0250 46.2446 0.0000 172.1323 11 Q 5.0460 8.5931 117.3175 53.7300 32.9814 173.2659 12 I 4.4735 9.0417 122.9259 59.5245 40.5264 174.1411 13 R 4.8764 8.4372 127.0417 54.4852 31.9203 175.2750 14 I 4.2147 8.4231 128.2134 61.2098 37.6798 176.7854 15 I 3.5827 9.1207 120.8906 61.1821 38.4115 175.1635 16 G 4.0146 7.8027 108.9322 44.6247 0.0000 173.0008 17 G 3.6287 8.3880 105.9875 44.9360 0.0000 174.3826 18 Q 3.8158 7.5771 116.9203 58.1352 28.8017 177.1353 19 W 4.8767 7.9583 118.5532 55.9250 29.5274 175.4467 20 R 4.0788 7.4800 118.8767 58.2332 29.5734 177.0165 21 G 3.9688 9.6203 114.3641 45.4105 0.0000 173.5858 22 R 4.1715 8.3679 120.6665 55.9908 31.2118 175.6029 23 K 5.0609 8.5734 122.8242 54.7479 34.3273 175.7171 24 L 4.9194 8.7310 123.9327 52.1662 45.8449 174.0780 25 P 4.9483 0.0000 0.0000 62.0791 32.4576 176.7754 26 V 4.5736 7.9073 114.4175 59.8020 31.2069 173.9823 27 P 4.3407 0.0000 0.0000 63.9664 32.3027 176.6663 28 D 4.4893 8.8224 119.2165 55.3025 38.0136 173.3396 29 S 4.8541 7.8123 114.6813 55.7512 66.3947 171.3518 30 P 4.5304 0.0000 0.0000 61.7022 32.0097 176.1599 31 G 3.8260 8.5430 110.0599 45.9501 0.0000 172.6029 *36 T 4.1224 8.0245 108.0116 61.2989 70.9384 174.5413 37 D 4.2822 8.3044 121.5631 57.7667 40.9659 179.3699 38 R 3.8885 7.8172 118.0605 58.9215 30.0013 179.2147 39 V 3.1445 7.3559 118.2398 65.9591 31.5770 178.3339 40 R 3.9028 7.6009 117.6393 59.0492 29.8014 178.5466 41 E 3.8454 8.4320 119.4859 59.6249 29.6511 178.9965 42 T 3.4106 7.5107 115.4206 66.4009 68.4803 176.3885 43 L 3.2217 7.3670 122.1225 57.9759 41.8371 178.9125 44 F 4.1757 8.3016 116.3117 59.6929 39.2875 177.4303 45 N 4.5289 8.2740 116.9200 56.1694 38.1498 177.1533 46 W 4.5054 7.7712 118.9163 59.7982 29.5212 177.8398 47 L 4.3653 8.1994 116.4233 55.0628 41.0080 178.5152 48 A 4.1000 7.8396 123.3731 54.8255 18.3525 177.8079 49 P 4.3693 0.0000 0.0000 64.3402 31.5851 176.9139 50 V 4.4232 7.7787 110.3204 60.8793 33.6728 176.5038 51 I 3.8849 7.5851 120.9324 63.5754 38.1104 176.3010 52 V 4.0468 7.7218 120.0762 64.1072 31.6224 175.1727 53 D 4.5433 9.2949 125.6819 54.6995 39.3136 173.8138 54 A 4.2715 7.8244 122.2273 52.0077 20.0360 177.1551 55 Q 4.8090 8.6863 120.4350 55.4265 30.3908 174.6557 56 C 5.4050 9.2732 122.0165 57.7947 31.9254 172.7619 57 L 5.0290 8.7992 124.0071 53.2829 44.7310 174.4094 58 D 5.3417 9.0600 126.6087 52.8934 42.3903 176.4018 59 C 3.8012 8.8677 125.1567 61.9968 28.7391 174.9723 60 F 4.8006 7.8152 115.4835 55.7751 40.0418 173.8154 61 A 4.5226 8.8471 127.9631 52.6297 20.1972 181.3218 62 G 4.0725 8.6113 103.2462 46.4891 0.0000 176.8508 63 S 4.0608 9.0337 119.8780 59.4301 63.0963 175.2766 64 G 3.8523 8.7490 109.3880 45.1251 0.0000 174.6260 65 A 3.9063 7.6607 122.1907 55.3732 18.2120 180.1140 66 L 3.9010 7.6850 116.5674 57.7200 41.8430 179.6672 67 G 3.6958 7.8962 105.1146 47.8519 0.0000 175.5873 68 L 4.0898 8.4740 121.8835 57.4077 41.7034 179.0840 69 E 3.6636 7.7921 119.0843 59.0200 29.4660 178.7881 70 A 4.1217 7.9583 120.6281 55.3345 18.5723 179.5644 71 L 3.9551 8.1666 117.5870 58.0348 41.6721 179.6987 72 S 2.9196 8.5060 113.4271 60.6586 61.9488 175.2529 73 R 4.2643 7.1444 118.5062 56.0628 30.5929 175.9263 74 Y 3.5083 7.1459 114.0842 58.5663 35.6255 169.0684 75 A 4.5490 7.7081 120.4323 52.7672 18.3690 178.8924 76 A 4.1374 8.6780 123.3055 55.0858 19.1134 178.1306 77 G 4.7111 7.7664 98.5736 45.2615 0.0000 172.7102 78 A 5.3259 8.2453 122.1780 50.5101 22.9069 174.9483 79 T 4.9321 9.0478 119.5726 61.7461 71.2995 173.4607 80 L 4.9586 8.8793 126.9707 53.0209 44.5822 175.4306 81 I 4.4863 8.6949 125.9086 59.7712 39.2536 174.8184 82 E 4.3176 8.7086 127.8566 54.8381 33.9840 172.7182 *84 D 4.5473 8.5155 117.5630 54.0065 42.2558 176.3046 85 R 3.8375 8.7302 126.3417 59.4287 30.2488 177.9620 86 A 3.9759 8.0598 120.0726 55.3585 18.3936 179.6139 87 V 3.5108 8.2246 116.5603 66.1330 31.5987 178.1463 88 S 4.1028 8.5128 115.2646 61.9483 62.7308 176.7755 89 Q 3.9848 8.1272 120.3889 59.1088 28.4258 178.9035 90 Q 3.9230 8.0522 120.4530 58.8580 29.0650 177.8047 91 L 3.8863 7.9843 121.4400 58.2635 42.1042 179.0128 92 I 3.6667 7.7178 119.5793 64.4089 37.0682 178.5719 93 K 3.9404 7.9766 119.2140 59.5492 31.9362 179.2250 94 N 4.2596 8.2797 116.7964 56.1729 38.3400 177.4570 95 L 3.8100 8.0182 120.2503 57.5376 41.6676 179.4396 96 A 3.9043 7.9063 120.6593 55.4744 18.1353 179.4527 97 T 3.7428 7.4986 112.9048 66.9671 68.7053 175.9599 98 L 3.7298 7.2563 116.5255 53.8555 41.9581 176.8176 99 K 3.6887 7.6757 117.1924 57.3205 29.9794 176.3775 100 A 4.5878 8.0405 123.7070 50.9561 17.6562 178.2570 101 G 3.8054 8.4862 110.7234 48.1225 0.0000 171.4854 102 N 4.9944 7.9984 118.5267 52.1803 37.2847 174.3487 103 A 5.3000 7.7120 118.1137 52.2633 22.6928 176.7073 104 R 4.7334 8.8857 114.9765 54.6425 33.6486 174.0169 105 V 4.7275 8.3256 119.4331 61.1126 34.1600 174.5380 106 V 4.1635 8.7278 128.1546 61.1656 33.6439 174.2372 107 N 5.4223 8.7466 127.4067 52.3211 37.8227 173.4207 108 S 4.8067 7.8781 117.5364 56.2787 66.0140 173.1648 109 N 4.5598 8.7736 121.5925 52.5252 38.0282 176.2782 110 A 3.9068 8.1404 121.6031 52.5312 18.0424 180.1099 *112 S 4.4001 8.2475 117.6219 60.2160 65.0251 176.4838 113 F 4.1225 8.1779 121.0920 61.1785 39.1051 176.2157 114 L 3.7413 7.9830 118.3989 56.3588 42.2125 177.5141 115 A 4.6177 7.2264 123.7952 49.7460 16.9593 175.2417 116 Q 4.4676 7.2809 118.8934 53.9227 31.7197 174.6093 117 K 3.6990 8.5128 120.3456 56.8852 32.4750 176.6104 118 G 2.0000 8.0682 116.1292 44.3869 0.0000 171.9405 119 T 4.6964 6.8473 113.1847 59.0127 70.4438 171.5394 120 P 4.6134 0.0000 0.0000 63.2770 32.2165 175.1635 121 H 4.9966 9.0234 120.0536 54.1152 31.9359 174.7011 122 N 4.4575 8.8989 118.8636 55.7134 40.0216 175.2431 123 I 4.9094 7.9808 118.9364 59.3587 41.4363 174.9243 124 V 4.6458 8.6230 126.4039 61.0367 35.0184 173.8670 125 F 5.3738 9.1376 126.7542 56.2495 41.3021 175.0825 126 V 4.8504 9.6054 124.2963 60.7477 32.2789 172.3343 127 D 4.8893 8.5401 124.8827 50.7826 40.7444 172.6971 128 P 2.9700 0.0000 0.0000 60.5468 32.2781 175.9929 129 P 4.2939 0.0000 0.0000 65.2565 31.3713 176.1918 130 F 4.9358 6.5721 111.1905 55.3972 41.0750 174.2833 131 R 4.0955 8.7139 120.3261 58.4631 30.7342 177.2076 132 R 4.3006 7.9178 116.8350 57.4776 30.2569 176.5493 133 G 4.2367 9.2918 112.0129 45.2426 0.0000 174.0857 134 L 4.5731 7.8468 117.5015 55.9960 43.6961 178.1766 135 L 3.8914 8.1164 120.3630 58.3574 42.1415 178.8810 136 E 3.8903 8.0314 117.9362 59.3001 29.4626 179.0241 137 E 3.9729 8.1516 118.1849 59.7208 29.5078 179.4884 138 T 3.8891 8.1597 115.6566 66.7644 68.7342 176.6256 139 I 3.7324 7.6812 121.7324 64.8191 37.0733 178.2292 140 N 4.2870 8.1336 116.9292 56.1096 38.4133 177.5600 141 L 4.0833 8.0009 120.4724 57.6650 41.2955 179.3154 142 L 4.3092 8.2271 119.0798 58.1587 41.4726 179.3400 143 E 4.2016 8.0960 117.1227 59.5149 29.7398 178.1318 144 D 4.6549 8.3234 117.3330 55.7282 41.3129 176.9880 145 N 4.7440 8.3689 116.0020 52.8445 38.8938 175.6889 146 G 3.8510 8.3412 104.7871 46.0480 0.0000 174.9451 147 W 4.9863 7.8153 118.5727 56.8785 30.1000 175.8613 148 L 5.3559 7.8058 119.4785 52.5282 44.1209 176.4130 149 A 4.3027 8.7060 125.0453 51.2229 20.0621 176.6636 150 D 4.4454 8.5874 118.8362 56.2649 41.1339 176.8985 151 E 4.4821 9.2206 120.9117 56.7942 27.0833 174.3886 152 A 4.2666 7.5261 119.9597 52.4112 19.8420 177.2464 153 L 4.9990 8.7461 120.5520 53.0165 44.4475 175.6353 154 I 4.8270 8.5504 124.7653 59.6019 40.1898 173.9126 155 Y 5.1654 9.3519 129.6076 56.8210 40.3070 174.2169 156 V 4.8359 8.7655 126.4949 61.0062 34.8419 173.4496 157 E 4.8607 8.2075 128.2726 54.4920 31.7381 174.9082 158 S 4.5790 8.4665 119.2599 56.9979 66.7541 173.7373 159 E 4.3567 8.6896 125.8405 56.2029 30.1645 177.9453 160 V 3.5414 8.7413 123.6423 66.4822 31.2133 177.8368 161 E 3.8910 8.2555 117.1573 59.7066 29.3524 178.3171 162 N 4.4615 8.0775 115.2482 54.2645 38.8330 176.2830 163 G 3.9041 8.1296 109.3775 44.0742 0.0000 172.7610 164 L 4.1996 8.2422 118.8509 53.6906 42.0902 175.7817 165 P 4.4062 0.0000 0.0000 62.5110 32.0629 176.1675 166 T 3.9308 8.4231 117.2213 63.7068 68.7144 174.4934 167 V 3.8675 7.6954 118.8032 58.1732 35.2276 173.6316 168 P 4.2484 0.0000 0.0000 62.0104 31.8078 177.6880 169 A 4.0488 8.4393 122.8556 55.2151 18.5511 178.2764 170 N 4.8655 8.3089 111.7870 52.8729 37.6709 173.7609 171 W 5.4728 8.2154 119.2235 55.4086 31.1395 175.6389 172 S 4.9597 9.0612 118.5360 55.9512 65.8938 173.0566 173 L 3.5723 8.8680 124.9058 56.3232 41.6968 175.2306 174 H 4.6902 9.0262 126.5592 57.4705 31.2387 174.9883 175 R 4.2866 7.0991 114.9315 54.3187 34.5279 173.8311 176 E 5.1118 8.0288 121.2209 54.9220 32.9695 174.0746 177 K 4.8842 10.0399 127.8391 54.7006 36.0598 174.6339 178 V 5.0673 8.7093 126.0887 61.1356 33.7250 174.6799 179 A 4.6473 8.8329 130.2899 51.5731 22.6838 175.0392 180 G 4.0314 8.6605 112.3038 47.2251 0.0000 173.9634 181 Q 4.4695 8.6119 122.8128 55.6842 29.1538 174.7609 182 V 4.6748 7.5854 118.4977 61.3765 34.8296 173.9093 183 A 5.0356 8.9518 129.3744 50.5215 21.3456 175.0573 184 Y 4.9496 9.4042 121.1001 56.4105 40.3768 175.3052 185 R 5.1379 9.1965 123.1724 54.1613 35.0113 174.1216 186 L 5.2374 8.5887 123.8663 53.6346 44.8682 174.6794 187 Y 4.9964 9.1835 124.0939 56.3679 40.8547 174.2435 188 Q 4.8179 8.8833 124.3152 54.3553 31.5290 174.4073 189 R 4.6951 8.6436 127.0432 55.1751 32.3357 174.6161 190 E 4.8280 8.6688 123.6239 54.1655 32.1527 174.2575 191 A 3.8129 9.3503 128.0098 52.6472 18.6635 177.0518 192 Q 3.4860 8.3549 120.1478 57.1318 30.1511 174.4906 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 10 G 8.21 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 11 Q 8.59 5.05 0.00 1.95 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.63 0.00 0.00 0.00 0.00 0.00 2.22 2.43 0.00 12 I 9.04 4.47 1.82 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 1.08 0.97 0.86 0.00 0.00 13 R 8.44 4.88 0.00 1.77 1.77 0.00 3.21 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 14 I 8.42 4.21 2.08 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.75 0.95 0.00 0.00 15 I 9.12 3.58 1.81 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.48 0.86 0.00 0.00 16 G 7.80 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 0.00 0.00 0.00 17 G 8.39 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 Q 7.58 3.82 0.00 1.73 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 7.34 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 19 W 7.96 4.88 0.00 3.38 2.98 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 20 R 7.48 4.08 0.00 1.68 1.90 0.00 3.29 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 21 G 9.62 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 0.00 0.00 0.00 22 R 8.37 4.17 0.00 1.85 1.82 0.00 3.27 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.90 0.00 23 K 8.57 5.06 0.00 1.59 1.68 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.42 7.81 24 L 8.73 4.92 0.00 1.46 1.55 0.78 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.95 0.00 2.04 2.01 0.00 3.86 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.95 0.00 26 V 7.91 4.57 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 0.69 0.00 0.00 0.91 0.00 0.00 27 P 0.00 4.34 0.00 2.03 1.97 0.00 3.77 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 28 D 8.82 4.49 0.00 2.83 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 S 7.81 4.85 0.00 3.81 3.77 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 30 P 0.00 4.53 0.00 2.17 2.06 0.00 3.55 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 1.98 2.09 0.00 31 G 8.54 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 *36 T 8.02 4.12 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 1.22 0.00 0.00 37 D 8.30 4.28 0.00 2.66 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 38 R 7.82 3.89 0.00 1.78 1.87 0.00 3.09 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 39 V 7.36 3.14 1.92 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 0.93 0.00 0.00 0.38 0.00 0.00 40 R 7.60 3.90 0.00 1.81 1.98 0.00 3.07 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.60 0.00 41 E 8.43 3.85 0.00 2.12 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 2.24 2.31 0.00 42 T 7.51 3.41 3.77 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 0.33 0.00 0.00 43 L 7.37 3.22 0.00 1.14 1.26 0.87 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 44 F 8.30 4.18 0.00 3.11 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 45 N 8.27 4.53 0.00 2.81 2.88 0.00 0.00 6.82 7.52 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 46 W 7.77 4.51 0.00 3.49 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 47 L 8.20 4.37 0.00 1.70 1.74 0.57 0.53 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 48 A 7.84 4.10 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.37 0.00 2.22 2.21 0.00 3.82 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 2.03 2.03 0.00 50 V 7.78 4.42 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 0.71 0.00 0.00 0.98 0.00 0.00 51 I 7.59 3.88 2.16 0.00 0.00 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 1.42 1.37 1.12 0.00 0.00 52 V 7.72 4.05 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 0.85 0.00 0.00 1.06 0.00 0.00 53 D 9.29 4.54 0.00 2.87 2.81 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 54 A 7.82 4.27 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 55 Q 8.69 4.81 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.45 2.34 0.00 56 C 9.27 5.40 0.00 3.00 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 57 L 8.80 5.03 0.00 1.23 1.30 0.81 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 58 D 9.06 5.34 0.00 2.95 2.57 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 76 A 8.68 4.14 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 77 G 7.77 4.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 A 8.25 5.33 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 79 T 9.05 4.93 4.32 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 1.17 0.00 0.00 80 L 8.88 4.96 0.00 1.50 1.52 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 81 I 8.69 4.49 1.63 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.24 0.49 0.00 0.00 82 E 8.71 4.32 0.00 1.96 1.71 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 2.18 2.49 0.00 *84 D 8.52 4.55 0.00 2.77 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.03 3.89 0.00 2.05 1.91 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 2.30 2.46 0.00 137 E 8.15 3.97 0.00 2.24 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 2.43 2.48 0.00 138 T 8.16 3.89 4.52 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 1.31 0.00 0.00 139 I 7.68 3.73 1.80 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 1.50 1.23 -0.04 0.00 0.00 140 N 8.13 4.29 0.00 2.87 2.82 0.00 0.00 7.06 6.56 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 0.00 141 L 8.00 4.08 0.00 1.88 1.81 0.99 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 142 L 8.23 4.31 0.00 2.16 2.03 1.12 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 143 E 8.10 4.20 0.00 2.22 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 2.38 2.48 0.00 144 D 8.32 4.65 0.00 2.79 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 N 8.37 4.74 0.00 3.18 2.97 0.00 0.00 6.82 6.91 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 0.00 146 G 8.34 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 W 7.82 4.99 0.00 3.58 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 0.00 148 L 7.81 5.36 0.00 1.55 1.53 1.07 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 149 A 8.71 4.30 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 0.00 150 D 8.59 4.45 0.00 2.66 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 9.22 4.48 0.00 2.08 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 2.37 2.22 0.00 152 A 7.53 4.27 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 0.00 153 L 8.75 5.00 0.00 1.49 1.53 0.90 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 154 I 8.55 4.83 1.66 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.32 1.14 0.00 0.00 155 Y 9.35 5.17 0.00 3.18 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 0.00 156 V 8.77 4.84 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 1.02 0.00 0.00 1.17 0.00 0.00 157 E 8.21 4.86 0.00 1.85 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 0.00 2.08 1.95 0.00 158 S 8.47 4.58 0.00 3.85 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 0.00 159 E 8.69 4.36 0.00 2.08 1.83 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 2.38 2.32 0.00 160 V 8.74 3.54 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 1.07 0.00 0.00 0.95 0.00 0.00 161 E 8.26 3.89 0.00 1.99 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 2.29 2.42 0.00 162 N 8.08 4.46 0.00 2.90 2.86 0.00 0.00 7.05 7.05 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 0.00 163 G 8.13 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 0.00 164 L 8.24 4.20 0.00 1.68 1.69 0.95 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 165 P 0.00 4.41 0.00 2.06 2.02 0.00 3.93 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 2.03 2.06 0.00 166 T 8.42 3.93 4.13 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 0.00 0.00 0.00 1.11 0.00 0.00 167 V 7.70 3.87 1.45 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 0.05 0.00 0.00 0.90 0.00 0.00 168 P 0.00 4.25 0.00 2.17 1.82 0.00 2.20 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.60 0.00 169 A 8.44 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 0.00 170 N 8.31 4.87 0.00 3.18 3.13 0.00 0.00 6.16 8.88 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 0.00 171 W 8.22 5.47 0.00 3.21 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 0.00 172 S 9.06 4.96 0.00 3.90 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 0.00 173 L 8.87 3.57 0.00 1.61 1.58 0.30 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 174 H 9.03 4.69 0.00 3.03 3.23 0.00 5.95 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 R 7.10 4.29 0.00 0.67 0.66 0.00 2.54 0.00 0.00 2.72 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.53 0.00 176 E 8.03 5.11 0.00 1.79 1.70 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 2.24 2.34 0.00 177 K 10.04 4.88 0.00 2.23 1.94 0.00 1.64 0.00 0.00 1.51 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.51 1.51 7.81 178 V 8.71 5.07 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 0.90 0.00 0.00 0.98 0.00 0.00 179 A 8.83 4.65 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 0.00 180 G 8.66 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 0.00 0.00 0.00 181 Q 8.61 4.47 0.00 2.23 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.72 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 182 V 7.59 4.67 1.77 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 0.31 0.00 0.00 0.90 0.00 0.00 183 A 8.95 5.04 1.18 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 0.00 0.00 184 Y 9.40 4.95 0.00 3.11 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 0.00 185 R 9.20 5.14 0.00 1.73 1.44 0.00 3.17 0.00 0.00 3.04 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.56 0.00 186 L 8.59 5.24 0.00 1.70 1.17 1.11 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 187 Y 9.18 5.00 0.00 2.80 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 0.00 188 Q 8.88 4.82 0.00 1.77 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.83 0.00 0.00 0.00 0.00 0.00 2.11 2.24 0.00 189 R 8.64 4.70 0.00 1.27 1.52 0.00 3.02 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.36 0.00 190 E 8.67 4.83 0.00 1.87 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 2.21 2.37 0.00 191 A 9.35 3.81 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 0.00 192 Q 8.35 3.49 0.00 2.13 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.60 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 * Residues marked with a * may have inaccurate shift predictions.