NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 T 4.6218 8.0748 116.7684 63.1764 69.9181 173.6250 7 L 4.2203 8.2167 125.0728 52.9844 42.6153 176.0365 8 T 4.3409 9.7854 114.0459 60.5428 72.3590 173.8294 9 P 4.3208 0.0000 0.0000 66.6047 31.3450 179.7479 10 K 4.0669 8.0183 121.8500 59.8223 31.5913 181.1569 11 E 4.2022 8.0337 119.3633 59.1193 29.3507 179.2782 12 A 3.9824 8.1407 120.9846 55.1490 18.4171 179.9018 13 V 3.5818 7.7517 116.4678 66.1284 31.5331 178.4835 14 R 3.8999 8.0980 117.8847 59.0819 29.8601 178.6541 15 L 3.9004 8.2214 120.4877 58.2690 42.0465 178.5757 16 C 3.9271 8.1018 118.2374 62.3666 31.5300 175.3982 17 A 3.9126 8.0677 122.2553 55.3025 18.0544 179.6864 18 L 4.0476 8.3234 118.0740 57.8063 41.2029 180.0448 19 G 3.5413 8.2588 105.8830 47.9443 0.0000 176.0243 20 T 3.6847 7.8143 118.1387 66.4694 68.3008 176.7391 21 I 3.9453 7.7084 118.7692 63.5377 38.0357 177.3796 22 A 4.1010 7.7081 121.2659 54.9920 18.1601 178.7477 23 S 4.1183 7.5298 113.7727 61.2789 62.8072 174.6691 24 Q 4.5416 7.4040 116.1511 52.2171 31.7853 175.1568 25 P 4.6559 0.0000 0.0000 61.3322 32.2320 176.0878 *27 R 4.2728 8.1121 117.7433 56.0436 32.0515 174.9724 28 Y 4.0983 8.4166 126.2307 61.2566 38.7847 179.0512 29 S 4.0714 9.1482 115.0231 61.7713 62.8265 176.4482 30 E 3.9199 8.0047 121.4358 58.8757 29.3037 178.8754 31 L 3.8144 7.9378 120.1619 57.9631 42.1717 178.7407 32 A 3.8694 7.8359 121.1589 55.1622 18.2797 179.7777 33 G 3.5728 7.9661 104.1412 47.9229 0.0000 175.8941 34 S 4.1014 8.0488 115.4052 61.1362 62.4194 176.3468 35 V 3.6000 7.8614 121.0108 65.9864 31.2687 177.7791 36 R 3.8794 8.0864 118.4187 59.7670 29.9328 177.9364 37 H 4.0994 8.2847 117.8579 59.1552 29.7721 176.9772 38 F 3.9708 8.6208 122.9855 61.5052 39.0918 177.1428 39 T 3.9315 8.0877 108.4382 64.9883 68.6165 176.2587 40 S 4.8459 7.7824 117.3763 60.4454 63.1483 176.3504 41 R 3.9827 7.6900 121.2084 58.8060 29.8114 178.0389 42 I 3.9879 6.9636 116.8650 62.4835 37.7232 175.7197 *44 G 3.7858 7.8266 109.4284 44.5984 0.0000 171.3431 45 P 4.1241 0.0000 0.0000 64.3682 31.6694 176.8078 46 S 3.9548 8.0817 111.8645 57.9620 60.3873 174.0926 47 L 4.0579 8.0039 119.9504 57.5616 42.1698 179.1608 48 E 4.1034 8.1776 116.2816 58.6665 30.2081 176.5618 49 L 4.4452 7.9148 122.2031 53.2062 40.0413 177.0090 *51 G 3.9351 7.8902 109.4165 45.2882 0.0000 171.6806 52 I 4.0433 7.4518 121.1754 60.8735 34.9156 175.5171 53 S 4.7829 7.8488 118.7523 56.6853 64.7284 176.0723 54 I 4.0504 8.3874 123.4612 64.2101 36.3748 178.8762 55 E 4.0740 8.0077 119.7913 61.1204 29.4951 184.3653 56 L 4.2699 7.9729 120.2901 57.8959 42.3016 178.8116 57 L 4.0683 7.8455 120.8421 58.5812 41.4468 180.3814 58 R 4.4139 8.0681 123.7763 61.6445 29.1736 180.7146 *59 Y 4.2454 7.3106 119.1232 61.7644 36.9556 180.0230 60 E 4.6472 7.9932 117.2253 55.4627 29.7986 177.0157 61 G 3.9496 7.5943 106.9525 46.3591 0.0000 175.0627 62 L 4.3296 7.8469 122.1612 56.2790 42.7866 177.2095 63 V 4.8553 7.7859 117.2330 61.0086 35.0343 174.3715 64 E 4.7767 9.5478 124.7313 54.6820 33.8205 176.3302 65 A 4.2794 8.2578 124.1660 51.6115 21.0486 176.4993 66 V 4.1432 8.0335 110.3124 64.4041 34.9038 176.0196 *75 D 4.5271 7.8063 117.4937 54.2897 42.3100 175.3771 76 A 4.7277 7.2516 135.0000 51.1904 20.5883 179.0842 *78 L 4.6368 8.5843 118.3019 57.3289 43.5250 174.4861 79 A 4.5977 8.8070 120.6923 50.6051 22.9002 175.9462 80 I 4.2588 8.3900 120.2785 61.1068 39.2370 174.8425 81 S 4.8311 8.4857 120.7871 55.9312 66.1210 174.7666 82 A 3.9552 8.7376 120.7998 55.4390 18.0072 179.6517 83 A 4.0537 8.0380 118.7945 55.2244 18.4363 179.9598 84 G 3.5713 7.7584 103.4875 47.9921 0.0000 176.2419 85 R 3.9542 8.2230 120.4637 58.9191 29.9435 179.4464 86 R 3.9107 7.8011 118.0400 59.2078 30.0692 178.5631 87 E 3.8911 8.0388 118.8676 59.1160 29.5379 178.4000 88 L 3.8976 8.1763 120.6184 58.5816 42.0669 178.4951 89 H 4.0818 8.2628 117.8921 59.2336 29.5825 177.0157 90 S 4.0393 8.0706 113.8779 61.4886 62.3082 175.9009 91 L 4.1019 7.9977 120.6383 57.7577 41.4520 179.0103 92 L 4.0639 8.1932 119.9112 56.9253 43.3490 178.2603 93 T 4.3629 7.7230 110.6818 59.6534 66.0441 173.8957 94 A 4.6737 6.9709 125.8169 51.1910 22.8202 177.2577 95 R 4.1267 8.2634 119.0190 56.0989 30.3348 176.6963 96 L 4.6087 8.0805 121.3751 55.4673 43.9410 176.7489 97 R 4.6714 7.8293 115.0496 55.1749 32.7517 169.2012 98 P 4.5463 0.0000 0.0000 64.9592 31.8398 177.0352 99 G 3.7029 7.7828 108.8121 46.4963 0.0000 173.6525 100 S 4.3852 9.9878 118.3902 58.2579 61.0539 168.6384 101 D 4.6383 7.5070 109.6474 51.3393 40.2127 176.6402 102 L 4.0207 7.5181 122.2460 58.7349 42.4912 177.6230 103 S 4.1664 8.1832 114.8839 61.5396 62.6709 176.5587 104 K 3.9066 7.9622 120.9634 59.2687 31.7202 179.0973 105 L 3.9232 7.7925 120.0636 58.1400 42.1036 178.9741 106 V 3.5943 7.8223 118.2145 66.0293 31.2367 178.2062 107 V 3.5325 7.8781 116.9535 65.8321 31.4413 177.4520 108 A 4.0741 7.8085 119.5704 55.1920 18.4095 179.3288 109 L 3.9826 8.3082 117.8334 57.6447 41.7832 180.1264 110 K 4.2035 8.0070 114.5022 57.6020 31.5621 178.5241 *112 R 4.1177 7.8426 121.1260 55.8944 31.6213 176.2484 113 F 5.1601 7.8639 114.9266 57.1399 39.3005 177.4104 114 L 4.0649 7.6543 124.8345 58.2155 41.8862 178.8769 115 G 3.8012 8.0985 106.0739 48.0640 0.0000 173.7908 116 L 4.2522 7.5721 121.1475 54.7064 41.3836 177.2652 *118 E 4.1456 7.9252 116.7241 55.6695 32.3116 175.8403 119 A 4.0925 8.6633 125.9182 56.4150 18.3478 180.7775 120 E 3.9650 8.1599 115.8974 61.3489 29.8303 180.5938 121 E 4.2142 8.1666 120.0699 58.9305 29.7274 178.9113 122 R 3.9353 8.1924 117.9762 59.2558 30.1437 178.6404 123 A 4.0241 7.8263 119.9280 55.6460 18.3197 179.0815 124 H 4.0855 8.2752 116.5413 59.6213 29.9150 177.4761 125 Q 3.9382 8.3115 119.8312 59.0282 28.5187 178.8937 126 I 3.6795 7.8117 120.8925 64.2394 37.1270 178.0614 127 D 4.3653 8.3164 120.0168 57.5131 40.6866 178.9404 128 L 3.9656 7.9915 119.3599 57.7756 41.5969 179.6290 129 L 3.9944 7.8811 118.9080 57.6978 41.4392 179.6026 130 I 3.6898 7.7643 119.7918 64.3512 37.0928 177.9306 131 E 4.0056 8.3114 120.2362 59.3065 29.4113 179.1739 132 G 3.5646 8.0949 105.6233 47.7712 0.0000 175.8931 133 V 3.5776 7.8234 120.9385 65.6473 31.6135 177.6063 134 D 4.3482 8.3402 119.0327 57.6176 40.7557 178.9270 135 S 4.0533 8.1162 113.2991 61.3145 62.3977 175.7960 136 E 3.8684 8.2784 121.9612 59.2718 29.3685 178.5883 137 L 3.9298 8.1683 119.0655 57.9259 41.7030 179.5065 138 A 3.9799 7.9579 120.4241 55.0858 18.2834 179.9881 139 R 3.8392 7.9224 116.5470 59.4670 30.1065 179.3432 140 L 3.9401 8.0430 118.5582 57.5498 41.5622 179.4354 141 A 3.9622 8.1999 121.0178 54.9592 18.0693 179.0167 142 D 4.2675 7.8746 115.5745 57.6105 41.4111 178.0816 143 L 4.1255 7.7612 119.2458 58.0266 42.1289 178.5779 144 R 4.0332 8.2015 118.3441 58.4282 30.1324 177.1904 145 G 4.1230 7.9599 111.1538 46.0019 0.0000 174.0138 *148 G 3.5886 7.7055 107.3937 45.5470 0.0000 171.0914 149 E 3.6482 8.6695 121.7598 56.4756 27.4740 174.9291 150 G 3.9626 7.8243 117.0839 45.0716 0.0000 169.1724 151 G 4.2537 9.1172 108.4428 46.4216 0.0000 175.5809 152 S 4.3610 7.9649 114.0153 57.6035 65.1466 174.8931 153 A 4.0575 8.5478 125.1740 55.2833 18.1676 179.9728 154 L 4.0314 7.9692 118.0964 58.3434 42.2957 178.8423 155 A 4.0624 8.2674 120.5192 55.0946 18.3041 179.4321 156 A 3.9636 8.1429 119.2240 55.0872 18.5204 179.6513 157 W 4.1822 8.6497 127.2089 60.7382 30.6115 178.1588 158 L 3.9344 8.3463 118.0929 57.8676 41.1042 178.9557 159 D 4.4368 8.0463 118.0248 57.4417 41.0182 178.0544 160 H 4.2497 8.0871 118.7336 59.0727 29.8121 178.1119 161 D 3.6224 7.6487 117.8126 54.3525 40.9411 177.6235 *163 A 4.1935 7.9737 122.0579 51.6837 20.6709 179.9507 164 L 3.9318 7.6317 115.7346 57.8136 41.4559 179.7191 165 L 3.9325 7.9988 119.1018 57.8204 41.5407 179.4025 166 E 3.9543 8.0669 118.0203 59.5100 29.3893 179.4597 167 S 4.1659 7.9929 114.9560 61.4953 62.8068 176.6807 168 R 3.9037 8.1629 121.5368 59.2362 29.7876 178.2238 169 L 3.9451 8.2848 120.2405 58.2300 42.0911 178.8593 170 A 4.0081 8.1132 120.6316 54.8359 18.2274 179.3725 171 W 4.0249 8.5009 126.9609 60.7121 30.7661 178.2318 172 L 4.0070 8.5243 119.1349 57.8888 41.0669 179.4089 173 E 3.9784 8.4612 118.6995 59.1663 29.1241 178.8610 174 D 4.1796 7.9239 117.2862 57.2253 41.7668 177.5099 175 F 3.7350 7.8571 121.3554 61.4322 39.0374 177.0351 176 R 3.9908 8.4449 118.1850 59.5060 29.6464 178.2445 177 A 4.0206 7.9110 119.2069 54.5050 18.4392 179.1067 178 R 4.0386 7.4028 114.8719 57.6566 30.3916 176.5929 179 L 4.1144 7.3353 123.2502 54.8802 41.6977 176.5531 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 6 T 8.07 4.62 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 1.21 0.00 0.00 7 L 8.22 4.22 0.00 1.71 1.59 0.91 0.58 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 8 T 9.79 4.34 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 1.26 0.00 0.00 9 P 0.00 4.32 0.00 2.18 2.17 0.00 3.60 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 10 K 8.02 4.07 0.00 1.76 1.82 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.10 7.81 11 E 8.03 4.20 0.00 2.21 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 0.00 2.33 2.32 0.00 12 A 8.14 3.98 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 13 V 7.75 3.58 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 1.08 0.00 0.00 1.03 0.00 0.00 14 R 8.10 3.90 0.00 2.07 1.96 0.00 3.19 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.00 15 L 8.22 3.90 0.00 1.80 1.85 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 16 C 8.10 3.93 0.00 3.17 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 17 A 8.07 3.91 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.32 4.05 0.00 1.71 1.71 0.97 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 19 G 8.26 3.54 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 0.00 0.00 0.00 20 T 7.81 3.68 4.29 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 1.15 0.00 0.00 21 I 7.71 3.95 1.85 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 0.73 0.99 0.00 0.00 22 A 7.71 4.10 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 23 S 7.53 4.12 0.00 3.64 3.86 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 24 Q 7.40 4.54 0.00 2.09 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.62 0.00 0.00 0.00 0.00 0.00 2.20 2.19 0.00 25 P 0.00 4.66 0.00 2.03 2.16 0.00 3.72 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.05 0.00 *27 R 8.11 4.27 0.00 1.92 1.86 0.00 3.29 0.00 0.00 3.44 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.73 0.00 28 Y 8.42 4.10 0.00 3.17 3.19 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 0.00 29 S 9.15 4.07 0.00 4.06 4.36 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 30 E 8.00 3.92 0.00 2.16 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 2.39 2.36 0.00 31 L 7.94 3.81 0.00 1.68 1.63 0.90 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.84 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 7.97 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 0.00 0.00 0.00 34 S 8.05 4.10 0.00 3.91 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 35 V 7.86 3.60 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 1.03 0.00 0.00 0.93 0.00 0.00 36 R 8.09 3.88 0.00 2.00 2.14 0.00 3.17 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 37 H 8.28 4.10 0.00 3.43 3.50 0.00 5.84 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 F 8.62 3.97 0.00 3.28 3.06 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 39 T 8.09 3.93 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 1.34 0.00 0.00 40 S 7.78 4.85 0.00 4.12 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 41 R 7.69 3.98 0.00 1.67 1.84 0.00 3.41 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.62 0.00 42 I 6.96 3.99 1.74 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.38 0.89 0.00 0.00 *44 G 7.83 3.79 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 0.00 0.00 0.00 45 P 0.00 4.12 0.00 2.04 2.16 0.00 3.82 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 46 S 8.08 3.95 0.00 3.99 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 47 L 8.00 4.06 0.00 1.64 1.75 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.18 4.10 0.00 2.12 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 0.00 2.37 2.28 0.00 49 L 7.91 4.45 0.00 1.85 1.67 0.93 0.67 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 *51 G 7.89 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 0.00 0.00 0.00 52 I 7.45 4.04 1.98 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 0.93 0.00 0.00 53 S 7.85 4.78 0.00 4.13 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 54 I 8.39 4.05 1.72 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.87 0.98 0.00 0.00 55 E 8.01 4.07 0.00 1.85 1.97 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 2.25 2.20 0.00 56 L 7.97 4.27 0.00 1.73 1.72 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 57 L 7.85 4.07 0.00 1.92 1.73 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 58 R 8.07 4.41 0.00 1.81 1.94 0.00 3.33 0.00 0.00 3.34 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.12 0.00 *59 Y 7.31 4.25 0.00 2.45 2.25 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 60 E 7.99 4.65 0.00 1.97 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 2.31 2.46 0.00 61 G 7.59 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 0.00 0.00 0.00 62 L 7.85 4.33 0.00 1.76 1.72 0.92 0.57 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 80 I 8.39 4.26 1.86 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 1.39 0.97 0.90 0.00 0.00 81 S 8.49 4.83 0.00 3.92 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 82 A 8.74 3.96 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 83 A 8.04 4.05 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 84 G 7.76 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 0.00 0.00 0.00 85 R 8.22 3.95 0.00 2.00 1.98 0.00 3.12 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.86 0.00 86 R 7.80 3.91 0.00 1.94 1.98 0.00 3.12 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.82 0.00 87 E 8.04 3.89 0.00 2.20 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 0.00 2.31 2.36 0.00 88 L 8.18 3.90 0.00 1.87 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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 0.00 151 G 9.12 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 0.00 0.00 0.00 0.00 152 S 7.96 4.36 0.00 4.09 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 0.00 153 A 8.55 4.06 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 0.00 154 L 7.97 4.03 0.00 1.86 1.77 1.19 1.40 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 0.00 155 A 8.27 4.06 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 0.00 156 A 8.14 3.96 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 W 8.65 4.18 0.00 3.52 3.37 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 0.00 158 L 8.35 3.93 0.00 1.79 1.71 0.98 1.10 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 0.00 159 D 8.05 4.44 0.00 2.78 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 0.00 160 H 8.09 4.25 0.00 3.15 3.27 0.00 5.79 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 D 7.65 3.62 0.00 1.92 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 0.00 0.00 0.00 0.00 *163 A 7.97 4.19 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 0.00 164 L 7.63 3.93 0.00 1.65 1.59 0.73 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 165 L 8.00 3.93 0.00 1.60 1.66 0.84 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 166 E 8.07 3.95 0.00 2.13 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 2.38 2.37 0.00 167 S 7.99 4.17 0.00 4.03 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 0.00 168 R 8.16 3.90 0.00 1.82 2.06 0.00 3.04 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 169 L 8.28 3.95 0.00 1.89 1.85 0.93 1.18 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 0.00 170 A 8.11 4.01 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 0.00 171 W 8.50 4.02 0.00 3.54 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 0.00 172 L 8.52 4.01 0.00 1.95 1.74 0.96 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 173 E 8.46 3.98 0.00 2.14 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 2.33 2.46 0.00 174 D 7.92 4.18 0.00 2.67 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 0.00 175 F 7.86 3.74 0.00 2.31 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 0.00 176 R 8.44 3.99 0.00 2.06 2.08 0.00 3.24 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 177 A 7.91 4.02 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 0.00 178 R 7.40 4.04 0.00 1.67 1.77 0.00 2.96 0.00 0.00 2.98 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.65 0.00 179 L 7.34 4.11 0.00 1.73 1.58 1.07 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.