NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3654 8.3001 118.3262 55.4002 33.4141 176.3517 2 A 4.0588 7.8880 122.8904 50.7095 15.6082 174.7902 3 L 4.2274 8.7104 121.1039 55.1221 43.0673 174.7862 4 F 5.0989 9.8623 121.9155 55.7997 43.0896 174.3725 5 G 4.4989 9.2319 105.7800 45.2061 0.0000 171.4126 6 Y 5.5599 9.3050 124.4621 55.9784 42.4931 173.7554 7 A 4.3126 8.2637 126.7555 50.6924 23.5604 174.0700 8 R 4.8925 8.1545 117.8876 55.8469 33.9363 173.9751 9 V 4.7758 8.1516 120.5750 60.5317 34.8118 175.7052 10 S 4.5360 8.6142 111.6121 58.3066 65.6281 174.1357 11 T 4.4729 7.6207 117.3547 61.5814 70.0661 174.6525 12 S 4.1146 8.4441 116.3754 61.1893 62.9422 174.4300 13 Q 4.1701 7.7933 121.6004 55.3058 27.8170 175.7735 14 Q 4.4162 8.1384 128.1644 55.0894 27.3649 178.5117 15 S 4.4753 7.5758 112.9963 58.2609 63.9510 176.5960 16 L 4.0524 7.8820 126.0235 59.3057 42.1252 176.8162 17 D 4.3945 8.1825 118.4172 57.7134 40.2205 179.0563 18 I 3.6939 7.6565 119.4140 64.3628 36.9927 177.9139 19 Q 3.8712 7.2786 116.3189 59.2407 28.8287 179.2522 20 V 3.7152 7.7974 118.5636 66.2632 31.7657 178.0752 21 R 3.8418 7.7854 117.6417 59.4776 29.8956 178.3427 22 A 4.3283 7.6098 119.1048 54.0565 18.5487 179.3503 23 L 3.9263 8.0888 118.1094 57.8131 41.5613 179.8596 24 K 4.8691 7.8410 119.3686 59.1609 32.1262 178.8263 25 D 4.5011 7.5340 115.9653 56.3731 40.7711 178.6041 26 A 4.2578 8.1846 121.7838 53.2201 18.7819 179.3483 27 G 5.0305 7.0608 117.2744 46.6247 0.0000 172.6308 28 V 4.1199 6.8664 120.5433 61.4298 32.9308 175.1670 29 K 4.6872 8.2228 125.1382 54.5623 34.1285 177.1939 30 A 4.0286 8.7875 123.9311 55.7620 18.3159 179.8983 31 N 4.2849 7.9438 112.8170 55.8964 39.6432 174.4460 32 R 5.1291 8.6752 118.0321 56.0335 31.2059 175.1433 33 I 5.2852 8.5275 119.4902 59.7655 40.0125 176.2921 34 F 4.9214 9.8087 125.8225 56.4573 42.2049 175.1727 35 T 5.2349 8.3778 116.5201 63.1929 72.0757 172.6833 36 D 4.9131 8.9865 126.2299 52.7189 43.9003 175.8916 37 K 4.4908 8.5820 123.3072 54.0386 31.9805 172.0922 38 A 3.9833 8.4536 125.7800 52.3072 17.4498 177.0017 39 S 4.0698 8.6976 115.0258 61.0984 62.9502 175.3335 *44 D 4.5735 7.9053 116.8329 53.6231 42.6218 177.0444 45 R 4.4662 7.5570 118.4815 55.9576 25.7985 176.7413 46 K 4.1659 7.8471 124.6826 59.9537 32.7487 179.1569 47 G 4.1127 8.2044 105.4769 47.2100 0.0000 174.9634 48 L 3.8259 7.9484 122.1516 58.0988 42.2318 177.7746 49 D 4.3287 7.4355 117.1041 57.6833 41.1400 178.7507 50 L 4.0809 7.9622 120.4887 57.8332 42.0969 178.7189 51 L 2.8045 7.1864 118.9942 57.7905 41.6940 178.6604 52 R 3.8981 8.0413 117.6559 59.3458 29.9240 177.1918 53 M 4.3638 7.3268 114.9187 55.4114 33.0138 177.4510 54 K 4.0412 7.4428 119.5410 57.8082 32.7535 177.4921 55 V 4.0326 6.6332 111.1965 61.0763 31.9404 175.0981 56 K 4.6085 9.9232 121.8864 54.5437 36.1631 175.3759 57 E 4.3005 8.2863 117.6907 57.8586 29.5517 177.4518 58 G 3.9045 7.9511 109.1017 46.8171 0.0000 173.3290 59 D 4.8420 7.4247 117.5251 52.9376 43.5575 176.0980 60 V 4.5959 7.9473 118.1591 61.7958 35.1730 174.2598 61 I 5.3777 9.3467 128.7517 59.3642 40.8606 174.3101 62 L 4.4317 8.0892 121.1081 54.0323 46.0414 175.1114 63 V 4.5467 8.2794 123.5626 59.6820 34.3497 175.0889 64 K 3.8968 9.1642 128.8280 59.3433 32.3888 176.9215 65 K 5.2840 7.7457 115.6078 54.4072 36.1701 176.5062 66 L 3.3831 8.8145 120.5658 58.0131 41.1627 178.0278 67 D 4.5152 8.0853 117.6184 55.9495 39.7046 178.3544 68 R 4.1290 7.8338 117.8063 58.3819 29.8067 177.1647 69 L 4.4974 7.2617 117.4527 56.4225 42.6790 176.3737 70 G 4.2747 7.5300 108.0984 43.6486 0.0000 172.1975 71 R 3.9585 8.7111 121.6056 57.8581 30.8057 175.9145 72 D 4.8870 7.7819 118.5377 52.7751 41.5705 176.1624 73 T 3.8137 8.8953 124.4862 66.8880 68.1175 175.5604 74 A 4.0137 8.1257 122.6335 55.2602 18.3755 178.8865 75 D 4.4441 7.9484 115.3096 54.3564 39.6270 177.8792 76 M 3.8377 8.0985 120.0500 59.0809 31.8310 178.0764 77 I 3.6908 7.4643 119.0846 64.3210 37.4368 177.7117 78 Q 3.9372 7.2801 120.5619 59.6710 28.6435 178.5261 79 L 3.4969 7.8749 119.4237 57.8038 41.4909 179.2675 80 I 3.7843 7.2853 118.1171 64.6772 37.2131 178.0576 81 K 4.1662 8.8205 120.7802 59.8881 31.7377 178.4455 82 E 4.0174 8.7600 118.9278 59.4987 29.3653 179.7660 83 F 4.4732 8.9233 118.5523 60.7719 39.1973 177.4072 84 D 4.3991 9.2504 118.5154 57.0097 40.7149 178.0112 85 A 4.1261 8.0129 121.0289 55.3011 18.5408 179.2654 86 Q 4.1735 7.8646 115.2346 57.2532 28.7847 177.7962 87 G 4.3075 7.7187 107.2331 45.2571 0.0000 172.5808 88 V 4.7584 7.5090 111.9688 58.4544 33.3970 175.3614 89 S 4.8382 8.5387 118.6558 56.5089 65.2494 172.3092 90 I 4.7629 8.5049 127.2915 59.5818 39.7515 174.6700 91 R 4.5505 8.0626 125.5484 54.9278 32.3310 175.0600 92 F 5.1154 8.1703 123.7082 54.9916 37.9272 175.8558 93 I 3.8399 8.2438 122.9671 64.5513 37.2652 176.8718 94 D 4.5177 8.5929 120.8280 56.7162 40.7512 177.9594 95 D 4.5057 8.3250 116.9598 54.1102 42.2053 176.1102 96 S 3.8370 9.3116 112.0692 59.5171 61.2034 170.7798 97 I 4.7309 7.4039 119.4832 60.4725 41.9672 175.8986 98 D 4.9821 8.6123 125.3288 53.1283 41.7852 177.2459 99 T 4.0541 8.3996 122.4020 66.7135 68.5511 175.9993 100 S 4.3181 8.2069 115.4433 60.8760 63.8625 175.4417 101 S 4.3273 7.7592 114.1329 57.7054 63.3855 172.1490 102 A 4.2849 8.0926 119.0271 53.6061 18.6621 180.1470 103 M 3.7757 7.4691 114.6029 58.0905 32.8154 178.4666 104 G 4.3052 8.6437 107.1725 46.9964 0.0000 175.4225 105 R 3.9564 8.0543 115.9762 59.2829 29.7885 178.2352 106 M 3.7650 8.0230 118.5967 58.8640 32.1248 178.0916 107 V 3.8321 8.6064 117.4250 64.8194 31.8231 177.9296 108 V 3.5561 8.1858 119.2962 66.3471 30.9393 177.5053 109 T 3.8482 8.4577 109.9194 65.2681 68.1600 175.7850 110 I 3.6728 8.1938 122.7443 64.5305 36.9365 178.1576 111 L 3.9551 7.6117 119.2442 57.8891 41.6820 179.8568 112 S 4.1513 8.0467 114.8354 61.6717 62.9289 176.6344 113 A 3.9651 7.6048 122.1503 54.9745 17.8542 179.4708 114 V 3.6899 7.4548 115.1857 64.8626 31.7411 177.1024 115 A 4.4059 8.0930 120.0957 53.7341 19.2789 178.8895 116 Q 3.8806 7.9432 117.8318 59.0441 29.2908 177.5550 117 A 3.4835 7.8623 121.2941 54.7642 18.1352 179.3002 118 E 3.9928 7.7517 118.0287 59.3510 29.7700 178.9540 119 R 3.8961 7.7556 117.5511 59.3985 30.3521 178.7885 120 Q 3.9750 9.0094 119.0136 58.9703 28.7062 179.1450 121 R 3.9624 7.6540 118.1397 59.3896 30.1806 178.2640 122 I 3.6931 7.8433 119.9238 64.8122 37.1058 178.3791 123 L 4.1146 8.2141 119.6086 57.7124 41.3484 179.4610 124 Q 3.9244 7.7407 118.4206 59.1413 29.0891 178.1855 125 R 4.0621 8.1598 119.7759 59.3295 29.6698 178.6435 126 T 3.8582 8.5090 116.1250 66.7565 68.4237 176.4273 127 N 4.3831 8.4321 118.5991 56.3253 38.3256 177.3235 128 E 4.0476 8.7556 120.6065 59.2807 29.3368 179.1622 129 G 3.7778 7.9138 103.4134 46.2589 0.0000 175.1858 130 R 4.3400 7.5324 119.5203 58.2255 30.6119 178.4649 131 Q 4.2040 8.4319 118.0756 57.6816 28.5424 177.0443 132 E 4.3720 7.6950 116.2389 56.4710 29.8354 176.6654 133 A 4.5561 7.4708 121.8384 54.2871 20.4167 178.7496 134 M 4.2860 8.3419 116.2521 58.7554 32.1705 178.6797 135 A 4.1945 7.4883 118.9183 54.7141 18.6050 179.2847 136 K 4.0794 7.8815 117.5506 58.9411 33.2949 176.4850 137 G 4.0937 7.1504 107.4649 46.4745 0.0000 173.7648 138 V 4.2993 7.3083 116.8687 60.3896 34.3016 175.3045 139 V 3.0076 7.9711 119.6712 61.1360 32.0107 175.6641 140 F 5.0233 7.4121 121.9488 56.2258 42.7141 179.1533 141 G 3.8379 8.3414 112.2497 47.0945 0.0000 176.4621 142 R 4.6293 8.6255 121.8672 53.7333 32.2895 174.5817 143 K 4.2995 8.2639 123.9876 54.9276 33.3232 176.4682 144 R 3.9438 8.4907 124.0374 57.0897 30.2995 176.1652 145 K 4.4177 8.7098 123.1346 56.4766 34.3629 176.2968 146 I 4.3094 7.4827 119.0484 58.8956 38.6656 174.2414 147 D 4.3654 8.7961 125.2639 55.0863 40.8183 177.7973 148 R 4.0516 8.5415 123.9636 58.5487 29.9961 178.5706 149 D 4.4116 8.0785 118.5784 57.0091 40.6421 178.1461 150 A 4.1548 7.4827 120.5069 54.5543 18.7987 179.4380 151 V 3.7790 7.5320 116.5540 65.8276 31.8583 177.8820 152 L 4.0960 7.9825 120.1271 58.1862 42.0335 178.6936 153 N 4.4847 8.0199 115.1875 55.7605 38.7876 175.9568 154 M 4.3614 7.8555 117.4756 55.5991 32.3813 176.6454 155 W 4.3151 7.7290 127.1570 59.4131 32.5002 177.1581 156 Q 3.9927 8.2303 116.9962 58.5914 28.1325 178.1345 157 Q 4.0610 7.3999 119.3315 57.0835 28.9466 177.0493 158 G 3.5165 7.7791 107.1956 45.5631 0.0000 173.1663 159 L 4.0885 6.9040 119.1239 53.6645 42.6671 177.0545 160 G 3.6984 8.5798 113.4282 45.6397 0.0000 174.3316 161 A 3.9431 8.8209 127.5458 55.2207 18.5960 179.5475 162 S 4.2530 8.1812 110.2278 61.5513 62.9372 175.5745 163 H 4.1661 8.1663 119.7128 59.3331 29.4200 177.3658 164 I 3.8498 7.5946 120.6066 64.0053 36.3998 177.8424 165 S 4.5034 7.8569 112.3735 59.7132 62.6525 175.2720 166 K 4.5821 7.6836 119.6823 56.5511 34.2472 177.8331 167 T 3.9161 8.2273 115.1189 66.3908 68.5228 174.5086 168 M 4.3990 7.8593 123.4727 53.5371 32.3906 176.9509 169 N 4.8360 8.5175 125.1681 53.1898 36.6130 172.7925 170 I 4.6617 7.6713 113.3421 58.0848 41.1112 175.7305 171 A 4.2382 8.2689 122.6179 52.0492 18.4106 178.9898 172 R 3.8450 8.6013 118.3273 59.0588 29.9139 179.0226 173 S 4.4375 8.2364 113.0022 61.3253 62.2941 176.0378 174 T 3.9052 7.9945 112.2076 64.5842 68.3353 176.1980 175 V 3.4879 7.0885 120.0728 66.4755 31.7389 177.2334 176 Y 3.9188 7.6464 116.4677 60.8776 37.6234 178.3326 177 K 3.8092 8.0720 119.5591 59.7426 31.7951 178.9837 178 V 3.5451 7.9889 118.5738 66.2040 31.2384 178.1850 179 I 3.5556 7.4676 117.7567 63.8742 36.8571 177.7549 180 N 4.4280 7.4853 116.4530 55.1723 38.3886 176.8586 181 E 4.2765 7.5237 120.4856 58.3713 30.3428 177.6676 182 S 4.3271 7.7022 117.4097 57.8598 62.0520 173.6321 183 N 4.5096 8.4252 123.3664 53.7482 38.4299 175.4913 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 1 M 8.30 4.37 0.00 1.99 2.22 0.00 0.00 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.59 0.00 2 A 7.89 4.06 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 3 L 8.71 4.23 0.00 1.42 1.56 0.94 0.85 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 4 F 9.86 5.10 0.00 2.88 2.92 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 5 G 9.23 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 Y 9.31 5.56 0.00 3.09 2.85 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 7 A 8.26 4.31 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 8 R 8.15 4.89 0.00 1.43 1.69 0.00 3.12 0.00 0.00 3.25 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 9 V 8.15 4.78 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 0.71 0.00 0.00 0.93 0.00 0.00 10 S 8.61 4.54 0.00 3.94 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 11 T 7.62 4.47 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 1.21 0.00 0.00 12 S 8.44 4.11 0.00 3.98 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 13 Q 7.79 4.17 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.65 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 14 Q 8.14 4.42 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.54 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 15 S 7.58 4.48 0.00 4.04 4.08 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 16 L 7.88 4.05 0.00 1.76 1.68 0.88 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 17 D 8.18 4.39 0.00 2.79 2.72 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 18 I 7.66 3.69 2.00 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 1.64 0.85 0.91 0.00 0.00 19 Q 7.28 3.87 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.94 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 20 V 7.80 3.72 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 1.12 0.00 0.00 0.92 0.00 0.00 21 R 7.79 3.84 0.00 2.17 2.00 0.00 3.28 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 22 A 7.61 4.33 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 23 L 8.09 3.93 0.00 1.85 1.77 0.97 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 24 K 7.84 4.87 0.00 1.94 1.84 0.00 1.96 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.39 7.81 25 D 7.53 4.50 0.00 2.82 2.74 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 26 A 8.18 4.26 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 27 G 7.06 5.03 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 28 V 6.87 4.12 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 1.10 0.00 0.00 0.97 0.00 0.00 29 K 8.22 4.69 0.00 1.85 1.69 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.41 7.81 30 A 8.79 4.03 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 31 N 7.94 4.28 0.00 2.68 2.89 0.00 0.00 6.72 7.65 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 32 R 8.68 5.13 0.00 1.86 2.40 0.00 3.03 0.00 0.00 3.02 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.66 0.00 33 I 8.53 5.29 1.90 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 1.35 0.88 0.96 0.00 0.00 34 F 9.81 4.92 0.00 3.18 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 35 T 8.38 5.23 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 36 D 8.99 4.91 0.00 2.70 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.58 4.49 0.00 1.71 1.75 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.85 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.43 7.81 38 A 8.45 3.98 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 39 S 8.70 4.07 0.00 3.89 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 *44 D 7.91 4.57 0.00 2.73 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 45 R 7.56 4.47 0.00 2.08 2.15 0.00 2.95 0.00 0.00 3.34 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 46 K 7.85 4.17 0.00 1.87 1.91 0.00 1.72 0.00 0.00 1.84 0.00 0.00 2.95 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.55 1.66 7.81 47 G 8.20 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 0.00 0.00 0.00 0.00 48 L 7.95 3.83 0.00 1.77 1.80 0.17 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 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1.19 0.00 0.00 74 A 8.13 4.01 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 75 D 7.95 4.44 0.00 2.93 2.88 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 76 M 8.10 3.84 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.58 0.00 77 I 7.46 3.69 1.84 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 1.62 0.99 0.89 0.00 0.00 78 Q 7.28 3.94 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 79 L 7.87 3.50 0.00 1.50 0.84 0.77 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 80 I 7.29 3.78 2.01 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 1.51 1.04 0.98 0.00 0.00 81 K 8.82 4.17 0.00 1.76 1.96 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.50 7.81 82 E 8.76 4.02 0.00 2.21 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 0.00 2.34 2.41 0.00 83 F 8.92 4.47 0.00 3.10 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 84 D 9.25 4.40 0.00 2.68 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 85 A 8.01 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.86 4.17 0.00 2.25 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.70 0.00 0.00 0.00 0.00 0.00 2.37 2.58 0.00 87 G 7.72 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 0.00 0.00 0.00 0.00 88 V 7.51 4.76 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 0.82 0.00 0.00 0.27 0.00 0.00 89 S 8.54 4.84 0.00 3.88 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 90 I 8.50 4.76 1.80 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.76 0.84 0.00 0.00 91 R 8.06 4.55 0.00 1.94 1.69 0.00 3.13 0.00 0.00 3.17 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 92 F 8.17 5.12 0.00 3.14 3.23 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 93 I 8.24 3.84 2.03 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.32 0.93 0.00 0.00 94 D 8.59 4.52 0.00 2.61 2.77 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 95 D 8.33 4.51 0.00 2.92 2.77 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 96 S 9.31 3.84 0.00 4.19 4.08 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 97 I 7.40 4.73 2.00 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 1.39 0.86 0.96 0.00 0.00 98 D 8.61 4.98 0.00 2.62 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 99 T 8.40 4.05 4.37 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 1.33 0.00 0.00 100 S 8.21 4.32 0.00 3.99 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 0.00 101 S 7.76 4.33 0.00 4.02 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 0.00 102 A 8.09 4.28 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 0.00 103 M 7.47 3.78 0.00 2.06 2.11 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 2.70 2.62 0.00 104 G 8.64 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 0.00 0.00 0.00 0.00 105 R 8.05 3.96 0.00 2.08 2.27 0.00 3.03 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 106 M 8.02 3.77 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.74 0.00 107 V 8.61 3.83 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 0.94 0.00 0.00 0.98 0.00 0.00 108 V 8.19 3.56 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 0.75 0.00 0.00 1.08 0.00 0.00 109 T 8.46 3.85 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 1.21 0.00 0.00 110 I 8.19 3.67 1.92 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 1.51 0.87 0.89 0.00 0.00 111 L 7.61 3.96 0.00 1.59 1.68 0.93 1.33 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 0.00 112 S 8.05 4.15 0.00 3.81 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 0.00 113 A 7.60 3.97 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 0.00 114 V 7.45 3.69 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 0.83 0.00 0.00 1.00 0.00 0.00 115 A 8.09 4.41 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 0.00 116 Q 7.94 3.88 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 117 A 7.86 3.48 1.38 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 0.00 118 E 7.75 3.99 0.00 2.08 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 2.29 2.38 0.00 119 R 7.76 3.90 0.00 1.96 1.95 0.00 3.18 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.92 0.00 120 Q 9.01 3.98 0.00 2.08 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 121 R 7.65 3.96 0.00 1.89 2.14 0.00 3.28 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 122 I 7.84 3.69 2.09 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 1.52 0.59 0.91 0.00 0.00 123 L 8.21 4.11 0.00 1.71 1.71 0.94 1.21 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 0.00 124 Q 7.74 3.92 0.00 2.17 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 125 R 8.16 4.06 0.00 1.93 1.98 0.00 3.15 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 126 T 8.51 3.86 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 0.00 127 N 8.43 4.38 0.00 2.87 2.85 0.00 0.00 7.08 8.52 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 0.00 128 E 8.76 4.05 0.00 2.05 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 0.00 2.33 2.43 0.00 129 G 7.91 3.78 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 0.00 0.00 0.00 130 R 7.53 4.34 0.00 2.02 2.00 0.00 3.15 0.00 0.00 3.18 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.91 0.00 131 Q 8.43 4.20 0.00 2.06 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.59 2.50 0.00 132 E 7.70 4.37 0.00 2.11 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 2.40 2.32 0.00 133 A 7.47 4.56 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 0.00 134 M 8.34 4.29 0.00 1.98 2.32 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.47 0.00 135 A 7.49 4.19 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 0.00 136 K 7.88 4.08 0.00 2.01 1.99 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.43 1.51 7.81 137 G 7.15 4.09 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 0.00 0.00 0.00 138 V 7.31 4.30 2.19 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 0.83 0.00 0.00 0.93 0.00 0.00 139 V 7.97 3.01 1.88 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 0.56 0.00 0.00 0.82 0.00 0.00 140 F 7.41 5.02 0.00 2.96 2.94 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 0.00 141 G 8.34 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 142 R 8.63 4.63 0.00 1.76 1.80 0.00 3.24 0.00 0.00 3.16 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 143 K 8.26 4.30 0.00 1.74 1.67 0.00 1.83 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.38 1.40 7.81 144 R 8.49 3.94 0.00 1.81 1.84 0.00 3.24 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 145 K 8.71 4.42 0.00 1.75 1.81 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.36 7.81 146 I 7.48 4.31 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 1.42 0.58 0.91 0.00 0.00 147 D 8.80 4.37 0.00 2.78 2.66 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 0.00 148 R 8.54 4.05 0.00 1.84 1.96 0.00 3.11 0.00 0.00 3.32 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.71 0.00 149 D 8.08 4.41 0.00 2.69 2.72 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 0.00 150 A 7.48 4.15 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 0.00 151 V 7.53 3.78 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 1.00 0.00 0.00 1.00 0.00 0.00 152 L 7.98 4.10 0.00 2.01 1.69 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 153 N 8.02 4.48 0.00 2.94 2.87 0.00 0.00 6.54 7.54 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 0.00 154 M 7.86 4.36 0.00 2.16 2.25 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 155 W 7.73 4.32 0.00 3.34 3.14 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 0.00 156 Q 8.23 3.99 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.76 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 157 Q 7.40 4.06 0.00 2.31 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.22 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 158 G 7.78 3.52 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 0.00 0.00 0.00 159 L 6.90 4.09 0.00 1.65 1.69 0.88 0.96 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 0.00 160 G 8.58 3.70 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 0.00 0.00 0.00 161 A 8.82 3.94 1.05 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 0.00 162 S 8.18 4.25 0.00 3.96 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 0.00 163 H 8.17 4.17 0.00 3.31 3.36 0.00 5.84 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 0.00 164 I 7.59 3.85 1.88 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 1.61 0.66 0.93 0.00 0.00 165 S 7.86 4.50 0.00 4.26 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 0.00 166 K 7.68 4.58 0.00 1.64 1.82 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.35 1.36 7.81 167 T 8.23 3.92 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 0.00 168 M 7.86 4.40 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.46 0.00 169 N 8.52 4.84 0.00 2.67 2.76 0.00 0.00 7.00 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 0.00 170 I 7.67 4.66 1.88 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 1.47 0.86 0.92 0.00 0.00 171 A 8.27 4.24 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 R 8.60 3.85 0.00 2.13 2.26 0.00 3.01 0.00 0.00 3.30 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.00 173 S 8.24 4.44 0.00 3.93 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 T 7.99 3.91 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 1.22 0.00 0.00 175 V 7.09 3.49 2.22 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 0.66 0.00 0.00 0.96 0.00 0.00 176 Y 7.65 3.92 0.00 3.41 2.92 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 0.00 177 K 8.07 3.81 0.00 1.87 1.84 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.47 7.81 178 V 7.99 3.55 2.26 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 0.92 0.00 0.00 0.99 0.00 0.00 179 I 7.47 3.56 1.38 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.45 -0.30 0.00 0.00 180 N 7.49 4.43 0.00 2.74 2.84 0.00 0.00 6.94 7.81 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 0.00 181 E 7.52 4.28 0.00 1.95 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 0.00 2.31 2.30 0.00 182 S 7.70 4.33 0.00 4.01 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 0.00 183 N 8.43 4.51 0.00 2.71 2.76 0.00 0.00 7.02 7.56 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 * Residues marked with a * may have inaccurate shift predictions.