NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 I 4.1536 8.0093 121.4522 61.3045 37.3983 174.9973 8 T 3.9175 7.9661 114.6878 60.5543 69.1688 172.0482 9 H 4.1595 8.3460 122.0471 53.3739 31.0660 175.3690 10 Q 3.3664 8.0538 126.6536 56.8120 26.8931 173.0380 11 E 4.1345 8.3941 121.3408 57.2891 30.3028 177.1663 12 K 4.7093 7.7063 116.0422 54.1896 35.5191 175.2861 13 L 4.3878 8.1465 120.6508 53.8251 42.6132 177.8195 14 L 4.2964 8.2592 122.8660 54.3852 40.1833 175.8058 15 T 4.6462 8.0043 116.3378 59.7399 70.5225 173.2961 16 V 4.2492 8.2116 126.0281 61.0239 33.9315 174.2626 17 D 4.5716 8.5716 127.4539 52.9548 40.8796 176.6340 18 T 2.6632 8.1017 117.3473 62.8710 68.9620 175.1227 19 T 4.3206 8.5005 111.7938 62.2560 69.4891 175.3616 20 A 4.2909 7.8029 124.2247 53.6071 18.9454 176.8494 21 H 5.0314 7.8392 111.5310 53.2995 32.9250 171.6083 22 P 4.7467 0.0000 0.0000 62.4550 32.0550 176.2247 23 F 4.4094 8.8719 118.2210 57.4982 40.0435 175.0264 24 L 4.3604 8.9046 122.4525 54.8720 42.4620 176.4993 25 K 4.8850 9.3466 123.5825 55.6331 33.6614 176.6507 26 A 4.1828 8.5629 124.4274 51.2788 16.2745 176.9724 27 L 2.0000 7.9576 123.5777 55.5795 42.8223 177.2387 28 G 3.6731 6.4706 112.9885 46.2871 0.0000 173.6919 29 G 3.7465 7.9945 104.3282 45.9941 0.0000 174.4605 30 H 4.6842 7.7786 118.4606 53.3542 28.3143 174.1841 31 E 4.0815 8.5625 125.5268 57.9475 29.9856 177.2519 32 G 3.9600 9.2332 113.7852 45.0833 0.0000 172.3922 33 T 4.5813 7.6902 116.1725 62.0838 70.1556 172.4784 34 D 5.3973 8.5340 126.9788 52.5543 43.4030 175.9697 35 I 5.0703 8.8128 123.0326 59.4254 41.4113 174.5383 36 F 4.5780 8.6973 127.3464 55.3790 41.0006 173.0559 37 P 4.3726 0.0000 0.0000 62.7052 32.1096 174.7585 38 L 4.6534 8.3956 117.5651 55.8113 44.0415 176.4191 39 F 5.6514 7.9952 116.6705 55.3053 42.9983 174.3595 *41 D 4.2938 8.1686 120.3740 53.2661 40.5642 173.5639 42 P 4.1460 0.0000 0.0000 64.5936 31.8221 177.6766 43 Y 4.3019 7.4658 115.1768 60.3118 38.0760 175.9133 44 N 4.7031 9.0160 114.7058 52.1560 39.5083 175.1385 45 G 3.9015 7.8197 107.6659 45.8537 0.0000 171.5172 46 L 5.1767 8.1351 120.2922 53.6122 46.4866 174.6180 *48 V 4.2195 7.8685 118.8117 62.7529 33.0786 174.1553 *50 R 4.6678 8.3018 123.7601 56.1140 31.8077 174.2080 51 A 5.2133 9.0176 124.9446 50.0974 22.7904 175.1447 52 S 5.0124 8.9870 114.7182 55.5588 65.2335 172.5963 53 F 5.5295 9.4505 126.8826 55.8312 40.8931 175.9051 54 A 4.9761 8.6994 124.9984 50.3549 19.2448 175.6525 55 P 4.2534 0.0000 0.0000 63.2313 32.3464 176.7077 56 G 3.8898 8.2569 109.2183 46.3729 0.0000 173.4897 57 L 4.6129 8.3017 119.6088 53.6903 43.8492 176.4220 58 T 4.9023 8.2316 117.8630 61.8885 71.1274 173.7582 59 L 4.3656 8.6503 126.8628 53.2613 43.0548 175.0869 60 P 4.5470 0.0000 0.0000 61.8722 32.7441 176.4914 61 L 4.2137 8.3604 120.9874 55.4427 42.7235 176.2617 62 H 5.1555 8.8912 121.2652 54.0192 31.0087 173.2735 63 F 4.7580 9.4619 127.9622 57.7524 40.8126 173.9546 64 H 5.1523 8.2496 124.3865 54.9742 29.7564 176.0109 65 T 4.3706 8.6181 113.3916 62.6407 69.7282 174.1449 66 G 4.4472 7.8241 107.8706 43.9066 0.0000 172.1428 67 T 4.3046 8.4172 109.2953 61.5355 70.5640 173.6883 68 V 4.5780 8.2836 122.1973 61.6033 34.6159 174.2236 69 H 5.3150 8.8856 123.8948 54.1702 32.7502 172.5400 *71 Y 5.0232 8.1147 120.0815 58.1475 40.4044 173.7025 72 T 4.8030 8.3965 124.0771 63.0721 69.0806 175.7322 73 I 4.0248 9.2898 129.1242 64.0146 38.3779 176.1325 74 S 4.3254 8.1171 114.1622 57.8880 65.9012 173.7514 75 G 4.1558 10.5217 105.1872 44.7229 0.0000 171.5430 76 C 5.1065 8.3845 120.8862 58.3403 35.0464 174.2889 77 W 5.2435 8.6109 121.4124 55.9686 31.5667 172.6382 78 Y 4.6744 8.2721 117.8797 56.0807 41.4499 172.9299 79 Y 5.2504 8.5635 118.0272 57.4133 39.2875 176.4905 80 T 4.0782 8.7807 121.5902 67.3145 68.2333 175.5402 81 E 3.9887 8.6316 119.9318 58.5436 30.6162 176.2695 82 Y 5.0176 8.2013 116.1568 56.0122 37.9993 174.9566 83 P 4.1385 0.0000 0.0000 65.2158 32.0214 178.1670 84 G 3.7944 7.9854 105.7822 46.1094 0.0000 173.4496 85 Q 4.6137 7.6866 117.8434 54.3820 28.9498 175.9301 86 K 4.0180 7.6047 116.7596 56.8616 33.7452 178.1767 87 Q 4.2909 8.5662 122.8781 54.5042 30.8499 175.0595 88 T 5.0451 8.0689 113.0064 58.2238 73.0396 172.3153 89 A 4.2914 8.0686 122.5526 53.7736 18.3019 178.1389 90 G 4.1804 8.4935 111.0395 45.3009 0.0000 172.9770 91 C 4.5352 7.6346 118.0569 58.9977 29.6193 172.1084 92 Y 5.2583 8.6495 123.2709 55.8453 41.3921 174.3737 93 L 4.4737 7.5699 125.4729 53.3412 45.3412 174.3931 94 Y 4.6553 8.4191 126.9402 55.7311 40.7620 173.9732 95 E 4.5120 8.3413 128.0180 53.5554 32.5773 173.7887 96 P 4.5439 0.0000 0.0000 61.4331 33.5869 175.8218 97 G 3.6177 8.3212 109.0364 46.7857 0.0000 174.2684 98 G 3.8059 8.7295 111.2267 44.5013 0.0000 173.8692 99 S 4.5262 7.0885 113.3575 57.5693 65.3141 173.3795 100 I 5.0015 7.5898 120.3264 59.1534 40.6121 173.5686 101 H 5.2295 8.3913 124.6526 53.4441 34.2503 171.7281 102 Q 4.8237 8.6936 119.8837 54.1912 31.5958 174.2570 103 F 4.7124 8.9578 129.6107 58.3906 40.9422 173.5895 104 N 5.3706 7.9699 122.2282 51.5369 43.1201 173.2126 105 T 4.7021 8.5316 113.4778 58.9995 71.3298 172.0751 106 P 4.5405 0.0000 0.0000 62.6491 32.0261 177.6200 107 R 4.0081 8.8404 122.9041 59.4113 30.1678 176.9678 108 D 4.6760 7.9832 114.9049 54.4579 41.1697 176.1414 109 N 4.4757 7.7721 117.8972 53.3152 38.9270 175.0985 110 E 4.2063 8.8382 123.3200 58.4729 30.7041 176.2826 111 G 4.0137 7.4508 105.6816 45.5251 0.0000 172.3005 112 Q 4.6676 8.8762 119.8988 56.2192 30.8012 175.3121 113 T 4.8302 9.1127 119.4204 62.1904 70.6706 173.2639 114 E 5.2769 9.1803 126.8719 54.8536 31.8646 175.7384 115 V 5.0477 9.0473 117.0126 59.5953 36.5120 174.2773 116 I 4.9558 9.0893 123.0255 59.3039 40.0379 174.5911 117 F 5.5375 7.8698 125.4509 54.7265 38.7338 173.4290 *119 L 4.2703 8.4102 120.5684 55.2569 42.4620 176.2896 120 S 4.8577 8.8396 122.4363 58.0224 65.1473 175.9113 121 G 4.2354 8.6981 111.6386 45.2411 0.0000 171.9998 122 C 4.9464 9.0987 120.1212 57.6776 35.5482 173.6696 123 N 5.4515 8.6344 118.8988 51.3939 41.0398 173.8818 124 V 4.5675 8.8638 123.9785 61.2357 34.0563 173.8467 125 N 5.3653 9.0475 125.9694 51.9614 40.5571 174.2698 126 F 5.4630 8.9644 121.2672 55.7848 44.0978 174.6633 127 T 4.6476 8.6299 110.9843 60.4664 69.9732 175.7570 128 Q 3.9365 8.5906 122.8319 59.0018 29.0298 176.4964 129 D 4.5744 8.0813 114.9305 53.2337 39.6152 176.9849 130 G 3.8485 8.2577 108.1242 45.7089 0.0000 173.8902 131 T 4.2489 8.1510 118.0528 62.7501 68.6936 173.6185 132 Y 4.2126 8.9014 128.0245 57.8596 39.4738 175.6513 133 L 4.0443 8.2862 127.4026 54.6403 43.6087 176.7288 134 G 3.5938 5.6068 103.8996 45.9312 0.0000 171.1044 135 L 5.2583 8.2209 118.9154 53.2057 44.7818 177.6342 136 S 4.5867 9.4083 118.0005 56.9021 65.2960 173.2925 137 D 5.0885 8.2798 124.7280 51.4448 41.9684 177.2704 138 A 4.0652 8.7998 119.9453 55.4481 18.0504 179.9822 139 G 3.4516 7.8989 103.3764 47.8846 0.0000 175.8976 140 V 3.6156 8.2274 121.1988 65.7601 31.5264 178.1551 141 I 3.7487 7.8007 119.5138 64.2124 36.8781 178.2681 142 K 3.8506 8.3480 120.7871 59.5365 32.0124 178.4519 143 N 4.3057 8.2458 116.6713 56.1843 38.4538 177.1656 144 W 4.0084 8.1436 129.4081 60.2478 30.7204 177.9651 145 V 3.3319 8.3244 118.6210 66.3153 30.7448 177.8093 146 D 4.3422 8.3798 118.7962 57.2806 40.5813 178.8925 147 R 3.7320 7.8842 119.1154 59.1320 29.9708 178.4304 148 A 3.4705 7.6208 121.0221 54.7752 18.1170 179.6068 149 I 3.5319 7.8640 121.2184 65.2554 37.1660 179.3326 150 R 3.8685 7.5364 121.2716 61.3690 29.1077 180.2372 151 E 4.0682 8.2769 119.1649 59.2040 29.6264 178.5317 152 Q 4.2427 8.2000 114.6272 54.9484 29.1488 174.8204 153 D 4.2708 7.6038 116.6071 54.9959 40.1800 172.7357 154 N 4.7089 8.0751 115.6063 52.3953 39.9492 174.5211 155 G 4.0477 8.3946 114.2986 45.4444 0.0000 173.5552 156 L 3.9846 7.3026 120.6749 54.0642 42.8934 175.9785 157 R 4.7056 8.1851 120.2863 54.5835 33.7860 173.8921 158 Y 5.0554 7.6737 117.3870 55.7723 42.1153 173.8093 159 I 4.4382 9.2797 120.3198 60.0465 39.0734 175.2166 160 A 4.7186 8.1923 126.5306 50.0206 22.2422 174.9634 161 A 4.5210 8.2997 122.8575 50.6781 19.9957 177.4959 162 A 4.3056 8.5840 125.5039 51.1573 19.5115 177.5084 163 V 2.2110 7.6718 119.5197 60.1308 32.0406 174.8145 164 P 4.2794 0.0000 0.0000 62.9784 31.8422 175.7572 165 T 4.3959 7.6216 109.4350 60.4452 71.6495 172.7462 166 Y 4.1845 8.2772 118.1825 57.6929 38.4995 175.7805 167 A 4.0912 8.5321 126.2197 52.1167 19.2530 177.5267 168 A 4.1983 8.4871 123.0678 52.5051 18.5323 177.6117 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 7 I 8.01 4.15 1.88 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 1.48 1.07 0.92 0.00 0.00 8 T 7.97 3.92 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 1.22 0.00 0.00 9 H 8.35 4.16 0.00 3.09 3.20 0.00 6.08 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 Q 8.05 3.37 0.00 2.19 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.91 0.00 0.00 0.00 0.00 0.00 2.28 2.39 0.00 11 E 8.39 4.13 0.00 2.01 1.99 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 2.30 2.42 0.00 12 K 7.71 4.71 0.00 1.96 1.67 0.00 1.85 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.32 0.98 7.81 13 L 8.15 4.39 0.00 1.63 1.59 0.91 0.98 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 14 L 8.26 4.30 0.00 1.68 1.71 0.98 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 15 T 8.00 4.65 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 16 V 8.21 4.25 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 0.99 0.00 0.00 1.06 0.00 0.00 17 D 8.57 4.57 0.00 2.70 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.10 2.66 3.56 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 0.00 0.00 0.00 0.47 0.00 0.00 19 T 8.50 4.32 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 20 A 7.80 4.29 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 21 H 7.84 5.03 0.00 3.38 3.37 0.00 5.71 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 P 0.00 4.75 0.00 2.27 2.14 0.00 3.87 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 23 F 8.87 4.41 0.00 2.83 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 24 L 8.90 4.36 0.00 1.85 1.66 0.74 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 25 K 9.35 4.89 0.00 1.73 1.80 0.00 1.90 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.62 1.45 7.81 26 A 8.56 4.18 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 27 L 7.96 2.00 0.00 1.09 1.12 -0.02 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 28 G 6.47 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 29 G 7.99 3.75 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 0.00 0.00 0.00 0.00 0.00 0.00 30 H 7.78 4.68 0.00 3.21 3.21 0.00 5.66 0.00 0.00 0.00 0.00 6.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 E 8.56 4.08 0.00 1.93 1.90 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 2.32 2.41 0.00 32 G 9.23 3.96 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 0.00 0.00 0.00 33 T 7.69 4.58 4.15 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 1.01 0.00 0.00 34 D 8.53 5.40 0.00 2.70 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 35 I 8.81 5.07 1.93 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.89 0.90 0.00 0.00 36 F 8.70 4.58 0.00 1.51 2.18 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 37 P 0.00 4.37 0.00 1.55 1.61 0.00 3.21 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.50 0.00 38 L 8.40 4.65 0.00 1.92 1.73 0.85 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 39 F 8.00 5.65 0.00 2.96 2.91 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 *41 D 8.17 4.29 0.00 2.79 2.75 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 0.00 0.00 0.00 42 P 0.00 4.15 0.00 0.98 1.82 0.00 3.31 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.87 0.00 43 Y 7.47 4.30 0.00 3.16 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 N 9.02 4.70 0.00 2.91 2.92 0.00 0.00 7.03 7.28 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 45 G 7.82 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 46 L 8.14 5.18 0.00 1.66 1.70 1.07 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 *48 V 7.87 4.22 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 1.24 0.00 0.00 0.95 0.00 0.00 *50 R 8.30 4.67 0.00 1.83 2.04 0.00 3.58 0.00 0.00 3.41 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.52 0.00 51 A 9.02 5.21 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.99 5.01 0.00 3.42 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 53 F 9.45 5.53 0.00 3.09 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 54 A 8.70 4.98 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 55 P 0.00 4.25 0.00 1.99 2.04 0.00 3.80 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.35 0.00 56 G 8.26 3.89 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 57 L 8.30 4.61 0.00 1.66 1.66 1.14 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 58 T 8.23 4.90 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 1.23 0.00 0.00 59 L 8.65 4.37 0.00 1.54 1.54 0.66 0.92 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 60 P 0.00 4.55 0.00 1.82 1.92 0.00 3.53 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.00 0.00 61 L 8.36 4.21 0.00 1.90 1.66 0.98 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 62 H 8.89 5.16 0.00 2.96 3.02 0.00 5.61 0.00 0.00 0.00 0.00 6.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 F 9.46 4.76 0.00 3.31 3.31 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 1.02 0.00 0.00 1.03 0.00 0.00 141 I 7.80 3.75 1.85 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.76 0.91 0.00 0.00 142 K 8.35 3.85 0.00 1.89 1.94 0.00 1.66 0.00 0.00 1.66 0.00 0.00 3.15 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.66 1.57 7.81 143 N 8.25 4.31 0.00 3.07 2.88 0.00 0.00 6.68 6.95 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 0.00 144 W 8.14 4.01 0.00 3.42 3.32 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 0.00 145 V 8.32 3.33 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 0.68 0.00 0.00 0.95 0.00 0.00 146 D 8.38 4.34 0.00 2.66 2.67 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 0.00 147 R 7.88 3.73 0.00 1.76 1.96 0.00 3.04 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.47 0.00 148 A 7.62 3.47 -0.06 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 0.00 149 I 7.86 3.53 1.90 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.88 0.87 0.00 0.00 150 R 7.54 3.87 0.00 1.80 1.91 0.00 3.29 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 151 E 8.28 4.07 0.00 2.11 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 2.35 2.18 0.00 152 Q 8.20 4.24 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.77 0.00 0.00 0.00 0.00 0.00 2.30 2.25 0.00 153 D 7.60 4.27 0.00 2.74 2.67 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 0.00 154 N 8.08 4.71 0.00 2.65 2.56 0.00 0.00 6.91 7.26 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 0.00 155 G 8.39 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 0.00 0.00 0.00 0.00 156 L 7.30 3.98 0.00 1.34 1.57 -0.14 0.97 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 0.00 157 R 8.19 4.71 0.00 1.80 1.70 0.00 3.17 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.56 0.00 158 Y 7.67 5.06 0.00 3.10 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 9.28 4.44 2.19 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.51 1.04 0.00 0.00 160 A 8.19 4.72 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 A 8.30 4.52 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 0.00 162 A 8.58 4.31 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 0.00 163 V 7.67 2.21 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 0.55 0.00 0.00 0.42 0.00 0.00 164 P 0.00 4.28 0.00 1.91 1.92 0.00 3.24 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.99 0.00 165 T 7.62 4.40 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 166 Y 8.28 4.18 0.00 3.01 2.89 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 0.00 167 A 8.53 4.09 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 0.00 168 A 8.49 4.20 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.