NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 I 4.2260 8.0249 120.9915 60.9689 39.4055 174.4239 3 Y 4.6582 8.7053 126.3422 55.4404 41.0680 173.0533 4 Q 5.2028 8.4833 124.2204 54.9959 32.8186 172.9187 5 K 4.6919 8.9622 123.9059 56.2779 36.3562 173.9573 6 Q 5.1494 8.6291 118.0632 53.6502 31.7695 175.7627 7 R 4.4723 8.9007 119.9211 56.6552 30.3359 178.6416 *12 T 4.4493 8.4852 117.5281 62.5571 70.0937 171.8102 13 Q 4.5237 9.1286 119.6174 54.4744 31.8682 173.5812 14 L 5.1578 8.6251 125.3975 53.0175 45.5395 174.3252 15 N 5.3873 9.2718 124.1053 52.0672 42.0799 172.9203 16 I 5.3346 8.9732 127.0473 59.6035 41.6242 174.7453 17 S 5.2794 9.2917 120.2923 56.6690 66.7039 172.7119 18 I 5.3118 9.0077 121.2461 59.8309 41.9079 173.8754 19 S 4.9082 8.7950 120.8509 56.5917 66.1032 174.1592 20 D 4.7849 8.4780 128.5638 53.6505 40.5891 173.7289 21 D 4.7737 7.4005 116.3153 52.8444 42.1098 176.5285 22 Q 4.5758 8.6236 121.8932 56.0163 29.2714 175.7634 23 S 4.2946 8.7141 113.8550 57.8817 63.3215 172.3846 24 P 4.6061 0.0000 0.0000 63.0109 32.3232 175.3230 25 S 5.0989 8.4972 116.5171 56.3748 65.1450 173.0344 26 H 4.7983 9.6315 124.8969 54.5359 32.1246 172.4769 27 I 4.5948 8.2771 127.0946 59.7231 39.2572 175.3384 28 N 4.9021 9.2070 127.0879 51.9563 39.3857 174.3239 29 T 4.1278 9.3625 113.9960 61.1534 69.9158 177.0504 30 G 3.8525 8.3977 109.9434 45.3888 0.0000 173.6475 31 V 4.3793 8.0028 120.0825 60.5742 33.3791 175.7320 32 G 3.6679 8.6841 113.9445 48.0192 0.0000 174.0341 33 F 3.9173 8.0024 121.5240 60.7312 39.4864 176.4691 34 L 3.4812 7.4736 118.2729 57.6658 42.1916 177.8488 35 N 4.3248 8.3261 117.1171 56.7070 38.4885 177.4327 36 H 3.9303 7.4056 115.0071 57.0347 29.5969 176.5902 *38 L 4.3126 7.9119 121.1756 54.5904 43.9229 179.3837 39 T 3.9238 7.7792 115.5003 66.4939 68.1925 176.5862 40 L 4.1295 7.8160 120.9330 57.7742 41.5878 179.1101 41 F 4.8890 8.7170 121.6769 60.9964 39.2860 177.0608 42 T 4.2702 8.1649 110.4846 64.4463 68.3199 176.1556 43 F 4.1904 7.9689 122.3552 61.0644 39.2165 176.3373 44 H 4.2191 8.6015 115.7685 57.6650 28.5124 177.3817 45 S 4.3071 8.0056 115.3958 58.4349 63.2430 175.5371 46 G 3.7673 7.4460 108.9424 45.3013 0.0000 172.7231 47 L 4.7481 7.4132 120.7227 53.1118 43.7070 176.1495 48 S 4.6791 9.1376 121.2254 58.3995 63.7550 173.1573 49 L 5.3459 8.9296 124.3777 52.9834 44.8876 175.1257 50 N 5.6021 9.4038 121.0178 51.5724 41.7928 173.5623 51 I 5.0499 9.2199 124.4534 59.5533 41.4861 174.3177 52 E 5.0375 9.4600 125.7111 54.6173 32.8862 174.4378 53 A 5.2312 8.8283 126.7370 50.1742 21.6640 175.3002 54 Q 4.4762 9.0579 122.3727 54.0596 33.2107 172.7129 55 G 4.1401 8.6820 119.0698 46.6041 0.0000 173.8617 *60 D 4.6124 8.0774 125.1681 53.9601 43.3706 176.0504 61 D 4.4442 7.8494 118.1748 57.5020 41.0254 178.3949 62 H 3.9679 8.1372 118.2560 59.6191 29.8682 176.9176 63 H 4.2752 8.0010 117.3487 58.8126 28.6880 177.6703 64 V 3.6150 7.8949 119.9928 66.4585 31.3424 178.1980 65 T 3.9580 8.2576 115.6117 66.7397 68.2557 176.3795 66 E 3.9289 8.3227 121.2213 59.3572 29.6975 178.5715 67 D 4.3454 8.4512 119.2598 57.2757 40.7648 178.8499 68 I 3.8477 8.0344 120.5597 64.2955 37.0816 178.6538 69 G 3.1193 8.1498 106.5790 47.6572 0.0000 175.7057 70 I 3.5858 7.8927 122.5868 64.0202 37.1216 178.8047 71 V 3.5318 7.5661 118.4126 66.0428 31.3592 177.8581 72 I 3.7760 7.9311 119.9468 64.5069 36.9437 178.5156 73 G 3.5632 8.1082 106.3178 48.0100 0.0000 175.7592 74 Q 4.0053 8.3214 121.0294 58.6107 28.4797 178.9177 75 L 4.0330 8.2065 119.5680 57.5870 41.7128 179.0794 76 L 4.0162 8.0083 118.6497 57.7210 41.8080 178.9847 77 L 4.0656 7.8718 120.2076 57.9569 41.8760 179.0667 78 E 4.0878 7.7024 114.2354 57.5368 29.3220 178.6418 *80 I 3.8102 7.6612 122.0827 61.2866 39.0522 178.2469 81 K 4.1421 7.9940 118.4802 59.3911 32.1160 178.2720 82 D 4.5524 7.8514 117.9884 56.8525 41.0267 177.5683 83 K 4.1428 7.4057 116.7005 56.5490 32.1617 175.5508 84 K 4.0906 8.1330 121.9993 57.1194 32.8741 175.9435 85 H 4.7672 7.9704 115.0288 55.0366 30.9909 174.5295 86 F 5.3522 7.6484 116.5190 55.3167 40.4510 174.4536 87 V 3.5960 8.6334 120.4015 64.7604 31.5329 176.4898 88 R 4.6057 9.2539 124.3527 56.1394 30.3001 174.8167 89 Y 5.1702 7.6107 113.0789 56.3610 39.8890 175.5891 90 G 4.3152 9.1623 110.0613 45.2688 0.0000 171.6668 91 T 5.4670 8.1059 118.4227 60.7107 73.3281 172.4875 *93 Y 4.5687 8.2594 118.6376 58.2705 39.2857 175.2228 94 I 4.6565 8.7113 124.2631 59.2437 40.6652 173.5864 95 P 5.7344 0.0000 0.0000 60.6278 34.3909 175.2078 *97 D 4.7526 8.6803 120.9794 54.3817 41.6282 178.3689 98 E 4.1196 9.3324 128.2876 59.9303 29.9085 177.1514 99 T 4.5991 7.7369 116.4236 62.8924 70.4213 173.6011 100 L 5.0224 8.9947 126.3933 53.3729 45.3996 174.9086 101 A 5.2343 9.0437 127.5940 50.0493 22.5056 174.6272 102 R 4.3377 8.8097 120.6939 54.2131 33.2159 174.5678 103 V 4.7426 8.0539 124.6451 61.0277 35.2649 173.8022 104 V 4.6487 8.8062 127.6547 61.0660 34.0642 174.1580 105 V 4.9256 9.2273 127.9161 61.0477 34.5567 173.4714 106 D 5.0534 9.3945 127.4098 52.5129 43.6691 175.3386 107 I 4.2105 8.4881 128.8037 60.9102 34.4677 175.5193 108 S 4.4432 8.5511 119.6387 57.3166 64.7644 176.5921 109 G 3.8470 8.2344 108.2290 45.1546 0.0000 173.2767 110 R 4.4990 7.6117 118.9396 53.7016 30.9658 174.3682 111 P 4.6404 0.0000 0.0000 62.8378 32.0681 175.9050 112 Y 4.4550 8.9652 125.1352 56.4649 42.8527 172.6800 113 L 5.1647 8.1058 128.6218 53.3058 44.7952 175.1287 114 S 4.6050 9.1885 122.0772 56.8503 63.9085 172.4950 115 F 4.7923 8.8142 130.6754 56.7477 40.7036 174.8941 116 N 4.9768 8.4983 124.7273 50.4006 39.2651 171.9242 117 A 4.4129 7.7395 120.7146 51.1079 21.8826 176.3922 118 S 4.5236 8.6453 119.9763 57.5119 62.7812 174.4715 119 L 4.5373 8.2431 125.6906 54.3782 42.2251 178.1234 120 S 4.3513 9.1780 118.7248 60.5986 63.1227 174.7683 121 K 4.7608 7.4927 117.2984 54.3224 35.8928 176.3568 122 E 4.1712 8.6458 119.9585 58.4679 29.8721 177.2646 123 K 4.9811 7.6758 115.9701 54.4377 36.1786 175.8732 124 V 4.2238 8.3515 115.6692 60.2179 33.9961 176.8357 125 G 3.7692 8.2333 116.1200 47.2236 0.0000 174.7988 126 T 4.2586 8.7046 114.6340 61.1976 69.5652 174.0331 127 F 4.3688 8.2086 126.8667 57.3475 39.9866 174.1046 128 D 4.7072 7.9921 128.4049 54.3134 41.0438 177.4749 129 T 3.9613 8.5761 122.6450 66.2313 68.3541 176.3148 130 E 4.1031 8.0227 118.7844 58.6435 29.5347 178.7991 131 L 3.8763 7.7327 120.4625 57.1566 41.4785 179.3064 132 V 3.8443 7.8206 118.7485 66.2190 31.5117 177.5463 133 E 2.9719 7.9709 118.3788 59.0410 29.3132 178.4692 134 E 3.8047 7.6123 118.0500 59.0884 29.4660 179.0717 135 F 3.9015 8.3384 120.8180 61.3904 39.4656 177.2808 136 F 3.6967 7.8598 117.3610 60.2329 38.5851 177.6818 137 R 3.7553 8.1259 118.3863 59.1690 29.7166 178.2948 138 A 3.8194 7.6039 120.4912 55.1174 18.2832 179.8131 139 V 3.3613 7.1053 116.4304 66.0535 31.6335 178.3872 140 V 3.6270 7.6748 117.9142 66.1927 31.1666 178.1008 141 I 3.7396 7.8420 119.5952 64.4159 36.7186 178.0799 142 N 4.3984 7.7929 115.8384 55.2713 38.5877 176.5362 143 A 4.3106 8.0679 120.2310 51.4054 19.8181 176.8948 144 R 3.7867 7.5607 115.7928 57.1997 28.3174 175.6411 145 L 5.0401 7.8330 116.5335 53.7296 45.0060 176.9643 146 T 5.0937 8.8319 119.0967 62.5968 70.2189 173.8165 147 T 5.2526 9.3344 121.4492 60.6180 71.3859 171.9854 148 H 5.3256 9.2058 125.0719 54.1791 31.5331 172.9884 149 I 4.6873 8.7398 124.8466 59.5245 39.8145 174.5473 150 D 4.9186 8.7790 126.1233 52.4340 44.6419 174.8379 151 L 4.4721 8.4944 125.0322 54.2558 41.3025 177.1874 152 I 4.1161 8.8441 127.1668 63.9119 37.7241 176.9307 153 R 4.6700 7.8511 116.2116 55.1223 32.7870 174.6041 154 G 4.2717 8.8119 109.0104 46.2568 0.0000 173.0001 155 G 4.8862 8.0700 118.5032 46.1361 0.0000 172.3452 156 N 4.9003 7.7241 119.9600 51.4196 41.2033 175.6110 157 T 4.1612 8.4421 124.5823 66.9170 68.6453 176.2322 158 H 4.2286 8.3265 119.7714 59.6531 29.9767 176.8458 159 H 4.3680 8.4471 117.6093 58.9232 28.5401 177.4333 160 E 4.0324 8.4638 120.3777 59.7433 29.3069 179.7020 161 I 4.0084 7.9834 119.5569 64.3600 37.1893 178.0297 162 E 4.0062 8.6675 120.1296 59.4021 29.4200 178.6659 163 A 4.0569 8.5935 121.0793 55.2996 18.3471 179.6290 164 I 3.6007 7.9141 118.2105 64.6213 37.2077 178.7301 165 F 4.4189 8.8848 118.9340 60.5507 38.7901 177.9117 166 K 3.9869 8.6152 118.0919 59.3883 31.8249 179.2444 167 A 3.9897 8.3045 121.1619 55.1528 18.2860 179.3616 168 F 4.0412 8.5252 119.4356 61.6510 39.4550 177.5190 169 S 4.1538 8.4743 114.7442 61.5576 62.5643 176.7396 170 R 4.0260 8.4091 122.4721 58.8791 29.9016 178.3736 171 A 3.9051 8.0702 120.7380 54.9447 18.3292 179.3917 172 L 3.7425 7.9510 119.3534 58.0366 41.9092 179.2441 173 G 3.5947 7.7490 104.4990 47.9091 0.0000 175.1817 174 I 3.8256 7.9395 122.5032 64.1708 37.1881 178.4635 175 A 4.0480 7.9819 121.3062 54.9277 17.9682 179.0610 176 L 4.1384 7.7405 115.3764 55.2283 42.2452 177.4365 177 T 4.0057 7.3154 117.2818 63.5767 69.2836 173.7033 178 A 4.5865 8.7960 128.5796 52.6571 19.3604 177.2620 179 T 4.2372 8.3610 117.1597 63.6538 68.3790 174.8483 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 I 8.02 4.23 1.81 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.33 0.82 0.00 0.00 3 Y 8.71 4.66 0.00 3.01 2.82 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 4 Q 8.48 5.20 0.00 2.02 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.78 0.00 0.00 0.00 0.00 0.00 2.26 2.38 0.00 5 K 8.96 4.69 0.00 1.83 1.87 0.00 1.31 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.32 1.37 7.81 6 Q 8.63 5.15 0.00 2.24 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.83 0.00 0.00 0.00 0.00 0.00 2.21 2.36 0.00 7 R 8.90 4.47 0.00 1.75 1.03 0.00 3.19 0.00 0.00 3.28 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.52 0.00 *12 T 8.49 4.45 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 1.21 0.00 0.00 13 Q 9.13 4.52 0.00 2.05 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.79 0.00 0.00 0.00 0.00 0.00 2.43 2.29 0.00 14 L 8.63 5.16 0.00 1.76 1.52 0.94 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 15 N 9.27 5.39 0.00 2.84 2.63 0.00 0.00 6.62 7.46 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 16 I 8.97 5.33 1.90 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 1.31 0.58 0.95 0.00 0.00 17 S 9.29 5.28 0.00 3.87 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 18 I 9.01 5.31 1.99 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.80 1.05 0.00 0.00 19 S 8.79 4.91 0.00 3.97 3.68 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 0.00 0.00 0.00 20 D 8.48 4.78 0.00 2.70 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 21 D 7.40 4.77 0.00 2.80 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 22 Q 8.62 4.58 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 7.01 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 23 S 8.71 4.29 0.00 3.94 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 24 P 0.00 4.61 0.00 2.12 2.11 0.00 3.75 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 2.00 2.01 0.00 25 S 8.50 5.10 0.00 3.80 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 26 H 9.63 4.80 0.00 3.22 3.32 0.00 5.72 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 I 8.28 4.59 1.81 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 1.24 0.79 0.88 0.00 0.00 28 N 9.21 4.90 0.00 2.68 2.75 0.00 0.00 6.49 7.78 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 29 T 9.36 4.13 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 30 G 8.40 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 31 V 8.00 4.38 2.12 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 1.28 0.00 0.00 1.07 0.00 0.00 32 G 8.68 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.00 3.92 0.00 2.79 2.41 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 34 L 7.47 3.48 0.00 1.49 1.68 0.37 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 35 N 8.33 4.32 0.00 2.86 2.77 0.00 0.00 6.62 8.09 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 36 H 7.41 3.93 0.00 3.02 2.94 0.00 5.81 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *38 L 7.91 4.31 0.00 1.69 1.71 0.79 0.51 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 39 T 7.78 3.92 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 1.20 0.00 0.00 40 L 7.82 4.13 0.00 1.68 1.85 0.78 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.72 4.89 0.00 3.48 3.41 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 42 T 8.16 4.27 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 1.48 0.00 0.00 43 F 7.97 4.19 0.00 2.99 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 0.00 44 H 8.60 4.22 0.00 3.35 3.30 0.00 5.66 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.01 4.31 0.00 3.59 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 46 G 7.45 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 0.00 0.00 0.00 47 L 7.41 4.75 0.00 1.65 1.66 0.99 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 48 S 9.14 4.68 0.00 3.82 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 8.93 5.35 0.00 1.74 1.64 1.03 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 50 N 9.40 5.60 0.00 2.62 2.74 0.00 0.00 6.43 6.77 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 51 I 9.22 5.05 1.87 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 1.26 0.88 0.92 0.00 0.00 52 E 9.46 5.04 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 2.30 2.42 0.00 53 A 8.83 5.23 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Q 9.06 4.48 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.61 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 55 G 8.68 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *60 D 8.08 4.61 0.00 2.80 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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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 0.00 139 V 7.11 3.36 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 1.01 0.00 0.00 -0.14 0.00 0.00 140 V 7.67 3.63 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 1.10 0.00 0.00 1.07 0.00 0.00 141 I 7.84 3.74 1.88 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 1.64 0.77 0.88 0.00 0.00 142 N 7.79 4.40 0.00 2.72 2.82 0.00 0.00 7.01 7.84 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 0.00 143 A 8.07 4.31 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 0.00 144 R 7.56 3.79 0.00 2.04 2.06 0.00 3.11 0.00 0.00 3.17 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00 145 L 7.83 5.04 0.00 1.72 1.64 1.09 0.55 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 0.00 146 T 8.83 5.09 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 1.31 0.00 0.00 147 T 9.33 5.25 4.54 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 1.48 0.00 0.00 148 H 9.21 5.33 0.00 3.12 3.18 0.00 5.65 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 I 8.74 4.69 1.54 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.68 0.40 0.00 0.00 150 D 8.78 4.92 0.00 2.52 2.43 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 0.00 151 L 8.49 4.47 0.00 1.43 1.60 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 152 I 8.84 4.12 2.07 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.48 0.97 0.00 0.00 153 R 7.85 4.67 0.00 1.85 1.99 0.00 2.94 0.00 0.00 3.36 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.86 0.00 154 G 8.81 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 0.00 0.00 0.00 0.00 155 G 8.07 4.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 N 7.72 4.90 0.00 2.73 2.72 0.00 0.00 7.34 7.38 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 0.00 157 T 8.44 4.16 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 1.25 0.00 0.00 158 H 8.33 4.23 0.00 3.32 3.48 0.00 5.87 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 H 8.45 4.37 0.00 3.62 3.38 0.00 5.70 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 E 8.46 4.03 0.00 2.29 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 0.00 2.39 2.60 0.00 161 I 7.98 4.01 2.23 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.09 1.49 0.00 0.00 162 E 8.67 4.01 0.00 2.18 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 0.00 2.40 2.40 0.00 163 A 8.59 4.06 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 0.00 164 I 7.91 3.60 2.13 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 1.37 0.77 0.51 0.00 0.00 165 F 8.88 4.42 0.00 3.39 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 0.00 166 K 8.62 3.99 0.00 1.96 1.77 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.68 7.81 167 A 8.30 3.99 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 F 8.53 4.04 0.00 2.97 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 0.00 169 S 8.47 4.15 0.00 4.22 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 0.00 170 R 8.41 4.03 0.00 2.14 1.90 0.00 3.17 0.00 0.00 3.30 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 171 A 8.07 3.91 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 0.00 172 L 7.95 3.74 0.00 1.09 1.49 0.81 1.05 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 0.00 173 G 7.75 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 I 7.94 3.83 1.99 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 1.44 1.29 0.99 0.00 0.00 175 A 7.98 4.05 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 0.00 176 L 7.74 4.14 0.00 1.69 1.61 0.82 0.41 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 0.00 177 T 7.32 4.01 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 1.23 0.00 0.00 178 A 8.80 4.59 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 T 8.36 4.24 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 1.18 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.