NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1424 8.1627 120.2934 54.9118 33.3150 173.9709 2 K 4.0076 8.3420 127.1250 55.5860 32.6112 175.1010 3 G 3.9569 8.5488 116.1206 44.8199 0.0000 171.4592 4 D 4.5562 8.4087 119.5542 53.7664 42.0945 176.4996 5 K 3.8225 9.1654 127.1313 60.1701 32.0419 178.8298 6 I 3.6540 7.8350 119.1901 64.0132 37.0425 178.2952 7 V 3.7615 8.0938 118.9164 66.3659 31.3575 178.0464 8 I 3.7773 7.8283 119.3344 64.5349 36.8865 178.2265 9 Q 3.9103 7.8699 119.8123 59.3177 28.8495 178.0065 10 H 4.0438 8.4184 117.5589 58.8461 28.7553 177.4356 11 L 4.0057 8.3605 121.1538 58.2791 41.4453 179.5109 12 N 4.3104 8.3312 116.0504 56.0620 38.3143 177.3813 13 K 3.8914 7.9554 120.9665 59.7150 32.3495 178.9292 14 I 3.7344 7.9073 120.0747 64.1978 36.9809 178.1464 15 L 4.0456 8.2565 121.5172 58.2152 41.4199 179.3616 16 G 3.6641 8.3907 105.7503 47.7872 0.0000 175.4463 17 N 4.4315 7.9249 118.6225 56.2239 38.4800 177.3834 18 E 4.0634 8.1883 120.0757 59.1513 29.3895 179.3164 19 L 3.9584 8.0145 119.2977 57.5069 41.5275 179.6279 20 I 3.5838 7.4283 118.7994 64.3493 37.0473 178.0962 21 A 3.2179 7.5803 121.0328 54.9718 18.0893 179.5863 22 I 3.6208 7.8105 118.2896 64.7252 37.2659 178.4554 23 N 4.3070 7.7898 116.8956 56.2397 38.3259 177.2114 24 Q 3.8486 8.1658 121.2423 59.6449 29.1383 178.1505 25 Y 4.6869 7.8641 119.3090 60.5175 37.8922 178.3162 26 F 3.9086 8.3499 121.7219 61.0292 39.4908 177.0417 27 L 3.9682 8.1842 119.9077 58.6980 42.0184 178.6202 28 H 4.0321 8.4116 116.0179 58.6508 28.5506 177.7113 29 A 4.1274 8.0937 122.7912 55.3239 18.2959 179.8002 30 R 3.9248 7.7751 115.7863 58.7260 30.1202 179.1836 31 M 3.4909 7.5473 119.2252 58.0712 31.8407 178.1868 32 Y 4.3742 7.5762 116.8175 61.2198 38.1819 178.2023 33 E 3.9571 8.1267 120.1282 59.4543 29.4840 178.3979 34 D 4.3748 7.9355 116.9317 56.4386 41.3217 177.2099 35 W 4.9406 7.6926 116.7544 56.4553 29.5174 177.1877 36 G 4.0387 8.1526 107.9410 45.7417 0.0000 175.4000 37 L 4.5134 7.8296 122.1003 53.0204 38.6524 176.6503 38 E 3.9281 8.0315 122.7521 59.3306 29.9591 178.2229 39 K 3.7841 7.9366 119.3806 59.7064 32.1780 178.2399 40 L 3.9779 7.4511 120.5863 58.0667 41.9082 179.1789 41 G 3.8046 8.2750 105.8183 47.9271 0.0000 175.3673 42 K 3.8195 8.2725 122.6665 59.3206 32.1253 178.3825 43 H 3.7708 7.9978 118.0071 59.0501 29.7590 176.9667 44 E 3.8516 8.2547 120.4023 59.6988 29.5108 178.4334 45 Y 4.1319 8.0890 119.4817 61.2854 38.6224 178.2873 46 H 4.0214 7.9083 116.1749 59.0093 28.9064 177.6512 47 E 3.7322 7.8717 120.2675 59.4240 29.1804 179.4984 48 S 4.3241 8.1285 113.2439 61.3366 62.4253 176.2450 49 I 3.7250 7.3358 122.2309 64.1153 36.7175 178.0990 50 D 4.2538 8.2124 120.1354 57.3088 40.6110 178.6283 51 E 3.9462 8.1213 119.0882 59.5666 29.5534 179.2433 52 M 4.0709 7.8889 118.7268 58.3490 31.9914 178.9910 53 K 4.0438 7.9743 118.7012 59.5234 32.2235 179.1073 54 H 4.2475 8.5207 116.8021 58.8593 28.6526 177.6407 55 A 3.9890 8.1591 122.4794 55.0766 18.2391 178.8706 56 D 4.2755 7.9430 116.2136 57.7565 41.2473 178.8946 57 K 4.0071 8.1035 118.6134 59.4626 32.0375 179.4048 58 L 4.0252 7.9490 119.2684 57.7907 41.5229 179.5331 59 I 3.7328 8.3744 120.0800 64.4201 37.0522 178.6738 60 K 4.0201 8.1804 119.2606 59.2811 31.8471 179.4091 61 R 3.9760 8.0342 119.0036 59.5275 29.9747 178.5009 62 I 3.7208 7.8715 119.5136 64.4329 37.1116 178.2360 63 L 3.9869 7.9016 119.6335 57.8773 41.2873 179.3527 64 F 4.3663 7.9742 118.9001 61.3969 39.6218 176.5842 65 L 4.1885 7.9332 116.7997 53.7469 40.9943 176.9913 66 E 3.9180 8.0313 117.4467 57.5321 27.3462 174.3733 67 G 4.0207 8.1295 107.7577 43.8430 0.0000 173.3418 68 L 4.5589 8.0390 118.8824 51.9129 42.5401 175.2005 69 P 4.2841 0.0000 0.0000 62.8825 31.6456 175.9289 70 N 4.6942 8.5425 122.0019 52.4473 38.2485 173.8027 71 L 4.6721 8.2652 125.1258 54.5407 42.4906 177.6242 72 Q 4.2186 8.7293 121.9909 57.9029 29.6624 175.9759 73 E 4.1732 8.1966 117.0569 55.5121 30.0110 175.5140 74 L 4.5591 8.3195 125.8802 52.7361 43.9597 176.5418 75 G 3.8158 8.3914 115.4853 44.7175 0.0000 171.7421 76 K 4.1273 8.3169 120.6852 55.7453 32.5531 176.6568 77 L 4.2726 8.3713 126.5443 54.4747 42.4138 177.2713 78 L 4.4985 8.1741 123.2103 53.1170 40.9401 173.9902 79 I 4.2739 7.8771 121.7844 59.5279 37.9187 176.5246 80 G 3.9947 8.7194 114.9554 45.1250 0.0000 172.2699 81 E 4.7678 8.9786 117.0544 56.4238 31.3959 176.4065 82 H 4.9459 7.7028 113.5506 53.1861 32.8754 173.7881 83 T 4.2353 8.7204 117.5140 67.3228 68.3820 176.1812 84 K 3.8537 8.2607 120.3829 59.7600 32.0694 178.2946 85 E 3.9009 7.8704 118.8028 59.5483 29.7378 178.3564 86 M 3.9560 8.2701 118.9632 58.4419 32.0156 178.8346 87 L 4.1304 8.1848 119.0601 57.9528 41.8959 179.4187 88 E 4.0982 8.1304 118.0312 59.2025 29.3234 179.1631 89 C 4.2702 8.3547 117.5258 62.7053 28.1686 175.7463 90 D 4.8090 8.2884 120.5722 57.3582 40.4166 178.5108 91 L 3.9665 7.9849 120.7995 58.0102 42.1816 178.8770 92 K 4.1884 8.0477 120.8949 58.7512 31.8625 178.5757 93 L 3.9662 7.7113 119.6596 58.1854 42.5437 178.3429 94 E 4.2209 8.4669 118.6196 59.7707 29.1008 179.2860 95 Q 4.0348 8.3160 117.6772 59.1988 28.5883 179.1081 96 A 4.2049 7.8830 120.3173 54.7832 18.6049 179.0965 97 G 3.8438 7.9300 101.8486 45.3963 0.0000 175.6838 98 L 3.9894 7.6288 122.9926 57.7546 42.1591 176.8913 99 P 4.2578 0.0000 0.0000 65.7343 31.3273 178.0667 100 D 4.4091 8.1769 117.0745 57.5467 40.7164 178.8785 101 L 4.0273 7.7297 119.2023 57.8588 41.6683 179.8022 102 K 3.9898 8.0900 118.0501 59.2386 31.9383 179.3757 103 A 3.9915 8.3009 121.0140 55.1423 18.3668 179.5415 104 A 3.6836 8.0943 119.3128 55.1919 18.4164 179.9559 105 I 3.6476 8.0220 118.1689 64.5218 37.2271 178.4539 106 A 4.0216 8.0972 121.5910 55.3497 18.1588 179.1247 107 Y 3.9760 8.0604 119.3098 60.4154 38.8625 177.6907 108 C 3.9442 8.2128 117.7299 62.7161 28.2012 175.7296 109 E 3.8833 8.1338 120.9985 59.3642 29.2613 179.1177 110 S 4.1509 7.9505 113.9616 60.4646 62.6284 175.7706 111 V 4.0752 6.6957 112.9340 60.3702 31.7527 175.7961 112 G 2.9775 7.4327 107.0380 46.8706 0.0000 175.5270 113 D 4.4932 7.2613 119.7123 52.6928 37.8860 175.6566 114 Y 4.2725 7.0880 121.1284 60.7668 38.6109 177.8964 115 A 4.0628 8.0813 121.3588 55.3813 18.6565 179.7527 116 S 4.1723 8.2964 113.2578 61.5754 62.8219 176.8872 117 R 3.9511 7.9316 121.4106 59.3349 29.8306 178.4202 118 E 4.1482 8.4774 118.6564 59.2363 29.3722 179.0211 119 L 3.9531 7.8274 119.8928 58.3309 42.1395 179.1534 120 L 4.0528 7.9168 118.7020 57.5665 41.4933 179.3132 121 E 3.9652 8.3937 118.7906 59.6808 29.4897 179.1711 122 D 4.3991 7.9559 118.3139 57.4267 40.8496 178.9899 123 I 3.6222 7.6290 120.1853 63.9720 37.0242 178.1953 124 L 3.9845 8.1612 121.5042 58.2670 41.4263 178.8841 125 E 4.0103 8.3248 118.5328 59.4926 29.3750 179.3606 126 S 4.1836 8.0104 112.7723 61.4106 62.4218 176.1044 127 E 4.1496 8.4354 121.4191 59.3922 29.2266 179.1111 128 E 4.0642 8.3640 118.5718 59.1379 29.5227 179.1498 129 D 4.4222 7.7944 118.6721 57.4824 40.9335 178.1429 130 H 4.3560 8.2085 118.3685 59.3747 29.8007 177.3268 131 I 3.7307 8.0835 121.7892 64.4335 36.8452 177.8866 132 D 4.3248 8.2237 118.8759 57.0206 41.0235 178.0758 133 W 4.0688 8.2525 128.6460 60.4418 30.8240 177.9597 134 L 3.7207 8.2601 118.8677 57.7491 41.2155 179.2656 135 E 3.8917 8.3727 118.7352 59.8210 29.4223 179.5476 136 T 3.7741 8.0646 115.9401 66.6744 68.4737 176.6357 137 Q 3.6371 7.6494 119.8633 58.8887 28.5355 178.9586 138 L 3.7858 7.4460 119.3171 57.6097 41.5531 179.4490 139 D 4.2546 7.6983 118.5716 57.2791 40.7103 178.6526 140 L 3.9544 7.8195 119.4840 57.8462 41.5667 179.6085 141 I 3.4558 7.3980 119.6433 64.4865 36.7436 178.2140 142 D 4.3763 7.4534 118.7587 56.9158 40.7082 178.6245 143 K 4.1714 7.9160 118.8404 58.1717 32.2824 177.7737 144 I 4.2512 8.1599 109.7488 59.9177 39.2249 176.4356 145 G 4.0183 8.0022 108.1802 45.3951 0.0000 174.5860 146 L 3.9800 8.5204 121.2062 57.9311 42.3440 178.7777 147 E 3.9313 8.2758 118.2487 59.9317 29.5473 178.9818 148 N 4.4439 8.1297 115.6632 56.2946 38.9100 176.1230 149 Y 4.0970 7.6527 120.0640 60.2445 39.1368 177.1639 150 L 4.0361 8.0724 120.2029 57.2441 41.7283 178.8124 151 Q 3.9278 7.9036 119.8405 59.1683 29.0183 178.2381 152 S 4.2939 7.6476 109.1796 59.7913 63.4846 174.5178 153 Q 4.2235 7.7604 120.0960 56.3610 28.9975 177.5259 154 M 4.2589 7.7401 118.8764 57.5868 32.2546 176.1840 155 D 4.4982 7.8197 121.6762 54.3709 41.7571 175.4532 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 8.16 4.14 0.00 1.26 1.69 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.36 0.00 2 K 8.34 4.01 0.00 1.81 1.66 0.00 1.64 0.00 0.00 1.79 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.52 7.81 3 G 8.55 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 4 D 8.41 4.56 0.00 2.83 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.17 3.82 0.00 1.90 1.81 0.00 1.65 0.00 0.00 1.81 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.50 1.60 7.81 6 I 7.83 3.65 1.97 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 1.39 0.52 0.14 0.00 0.00 7 V 8.09 3.76 2.31 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 1.07 0.00 0.00 1.14 0.00 0.00 8 I 7.83 3.78 2.04 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 1.41 0.56 0.90 0.00 0.00 9 Q 7.87 3.91 0.00 2.08 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.20 2.31 0.00 10 H 8.42 4.04 0.00 3.40 3.33 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 11 L 8.36 4.01 0.00 1.97 1.76 0.96 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.33 4.31 0.00 2.87 2.85 0.00 0.00 6.72 7.70 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 13 K 7.96 3.89 0.00 1.91 1.95 0.00 1.60 0.00 0.00 1.64 0.00 0.00 3.26 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.47 7.81 14 I 7.91 3.73 2.00 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 1.43 0.29 0.93 0.00 0.00 15 L 8.26 4.05 0.00 1.84 1.89 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.39 3.66 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 0.00 0.00 0.00 17 N 7.92 4.43 0.00 2.96 2.89 0.00 0.00 6.92 8.91 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 18 E 8.19 4.06 0.00 2.14 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 2.58 2.53 0.00 19 L 8.01 3.96 0.00 1.82 1.68 0.90 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 20 I 7.43 3.58 1.93 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 1.47 0.86 0.88 0.00 0.00 21 A 7.58 3.22 1.08 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 0.00 0.00 22 I 7.81 3.62 1.99 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 1.51 1.06 0.88 0.00 0.00 23 N 7.79 4.31 0.00 2.82 2.82 0.00 0.00 6.74 8.61 0.00 0.00 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 8.17 3.85 0.00 1.99 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.52 2.28 0.00 25 Y 7.86 4.69 0.00 3.07 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 26 F 8.35 3.91 0.00 3.42 3.11 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 27 L 8.18 3.97 0.00 1.92 1.78 0.90 0.84 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 28 H 8.41 4.03 0.00 3.40 3.13 0.00 5.67 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.09 4.13 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.78 3.92 0.00 1.79 1.91 0.00 3.15 0.00 0.00 2.87 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.86 0.00 31 M 7.55 3.49 0.00 0.92 1.66 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.18 0.00 32 Y 7.58 4.37 0.00 3.21 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 33 E 8.13 3.96 0.00 2.10 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 2.28 2.27 0.00 34 D 7.94 4.37 0.00 2.66 2.54 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 35 W 7.69 4.94 0.00 3.69 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 36 G 8.15 4.04 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 0.00 0.00 0.00 37 L 7.83 4.51 0.00 2.04 1.65 0.96 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.03 3.93 0.00 2.12 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 2.40 2.56 0.00 39 K 7.94 3.78 0.00 1.97 1.94 0.00 1.53 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.51 7.81 40 L 7.45 3.98 0.00 1.67 1.01 1.06 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.27 3.80 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 K 8.27 3.82 0.00 2.03 1.74 0.00 1.50 0.00 0.00 1.53 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.53 7.81 43 H 8.00 3.77 0.00 3.10 3.11 0.00 5.65 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 44 E 8.25 3.85 0.00 2.35 2.28 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 2.68 3.08 0.00 45 Y 8.09 4.13 0.00 2.95 3.11 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 46 H 7.91 4.02 0.00 3.14 3.12 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 47 E 7.87 3.73 0.00 1.79 1.55 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 2.03 1.92 0.00 48 S 8.13 4.32 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 49 I 7.34 3.72 1.79 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.10 0.80 0.00 0.00 50 D 8.21 4.25 0.00 2.71 2.52 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 51 E 8.12 3.95 0.00 2.19 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 2.73 2.76 0.00 52 M 7.89 4.07 0.00 2.06 2.25 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 2.90 2.56 0.00 53 K 7.97 4.04 0.00 1.97 1.85 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.63 7.81 54 H 8.52 4.25 0.00 3.34 3.40 0.00 5.64 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.16 3.99 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 56 D 7.94 4.28 0.00 2.97 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 57 K 8.10 4.01 0.00 2.04 1.86 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.66 7.81 58 L 7.95 4.03 0.00 1.89 1.73 0.94 0.88 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 59 I 8.37 3.73 2.05 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 1.53 0.76 0.92 0.00 0.00 60 K 8.18 4.02 0.00 1.97 1.86 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.47 1.64 7.81 61 R 8.03 3.98 0.00 2.10 2.13 0.00 3.35 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.80 0.00 62 I 7.87 3.72 2.04 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 1.54 0.74 0.97 0.00 0.00 63 L 7.90 3.99 0.00 1.99 1.79 0.94 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 64 F 7.97 4.37 0.00 2.95 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 65 L 7.93 4.19 0.00 2.00 1.60 0.82 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.03 3.92 0.00 2.03 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 2.20 2.29 0.00 67 G 8.13 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.04 4.56 0.00 1.61 1.61 0.91 0.99 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 69 P 0.00 4.28 0.00 2.04 2.01 0.00 3.72 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 70 N 8.54 4.69 0.00 2.63 2.74 0.00 0.00 7.10 9.10 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 71 L 8.27 4.67 0.00 1.64 1.61 0.91 0.93 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 72 Q 8.73 4.22 0.00 1.94 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.03 6.85 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 73 E 8.20 4.17 0.00 1.98 1.86 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 2.29 2.28 0.00 74 L 8.32 4.56 0.00 1.53 1.51 0.89 1.05 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 75 G 8.39 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 0.00 0.00 0.00 76 K 8.32 4.13 0.00 1.71 1.73 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.52 7.81 77 L 8.37 4.27 0.00 1.64 1.55 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.17 4.50 0.00 1.84 1.66 0.96 0.86 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 79 I 7.88 4.27 1.90 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 1.35 0.79 0.95 0.00 0.00 80 G 8.72 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 0.00 0.00 0.00 81 E 8.98 4.77 0.00 2.16 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 2.32 2.27 0.00 82 H 7.70 4.95 0.00 3.27 3.28 0.00 5.68 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 T 8.72 4.24 4.43 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 1.52 0.00 0.00 84 K 8.26 3.85 0.00 1.85 1.92 0.00 1.69 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.69 1.48 7.81 85 E 7.87 3.90 0.00 1.86 1.78 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 2.35 2.38 0.00 86 M 8.27 3.96 0.00 1.74 2.27 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.32 0.00 87 L 8.18 4.13 0.00 2.09 1.71 1.09 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 88 E 8.13 4.10 0.00 2.20 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 2.52 0.00 89 C 8.35 4.27 0.00 3.24 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 90 D 8.29 4.81 0.00 2.86 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 91 L 7.98 3.97 0.00 1.81 1.69 0.93 0.59 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 92 K 8.05 4.19 0.00 2.15 2.02 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.34 7.81 93 L 7.71 3.97 0.00 2.04 1.94 0.81 1.05 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 94 E 8.47 4.22 0.00 2.23 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 2.70 2.54 0.00 95 Q 8.32 4.03 0.00 2.27 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.59 0.00 96 A 7.88 4.20 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 G 7.93 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 98 L 7.63 3.99 0.00 1.93 1.70 0.96 1.17 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 99 P 0.00 4.26 0.00 2.21 2.10 0.00 3.82 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 100 D 8.18 4.41 0.00 2.91 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.73 4.03 0.00 1.85 1.74 0.95 1.13 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 0.00 102 K 8.09 3.99 0.00 1.98 1.88 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.74 7.81 103 A 8.30 3.99 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 A 8.09 3.68 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 0.00 105 I 8.02 3.65 2.03 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 1.47 0.87 0.94 0.00 0.00 106 A 8.10 4.02 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 0.00 107 Y 8.06 3.98 0.00 3.05 2.99 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 0.00 108 C 8.21 3.94 0.00 3.15 3.09 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 0.00 109 E 8.13 3.88 0.00 2.20 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 0.00 2.34 2.40 0.00 110 S 7.95 4.15 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 0.00 111 V 6.70 4.08 1.86 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 0.17 0.00 0.00 0.66 0.00 0.00 112 G 7.43 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 0.00 0.00 0.00 113 D 7.26 4.49 0.00 2.67 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.09 4.27 0.00 3.09 2.96 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 0.00 115 A 8.08 4.06 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 0.00 116 S 8.30 4.17 0.00 4.25 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 0.00 117 R 7.93 3.95 0.00 1.95 2.19 0.00 3.35 0.00 0.00 3.31 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 118 E 8.48 4.15 0.00 2.28 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 2.56 2.50 0.00 119 L 7.83 3.95 0.00 1.92 1.83 0.95 0.44 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 0.00 120 L 7.92 4.05 0.00 1.91 1.71 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 121 E 8.39 3.97 0.00 2.20 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 2.35 2.63 0.00 122 D 7.96 4.40 0.00 2.82 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 0.00 123 I 7.63 3.62 1.93 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 1.06 0.95 0.83 0.00 0.00 124 L 8.16 3.98 0.00 1.84 1.95 0.95 1.09 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 0.00 125 E 8.32 4.01 0.00 2.22 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 2.35 2.55 0.00 126 S 8.01 4.18 0.00 3.97 4.12 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 0.00 127 E 8.44 4.15 0.00 2.10 2.21 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 2.65 2.55 0.00 128 E 8.36 4.06 0.00 2.07 2.04 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 2.36 2.51 0.00 129 D 7.79 4.42 0.00 2.96 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.21 4.36 0.00 3.23 3.50 0.00 5.61 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 0.00 131 I 8.08 3.73 2.07 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 1.44 0.77 0.94 0.00 0.00 132 D 8.22 4.32 0.00 2.96 2.90 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 0.00 133 W 8.25 4.07 0.00 3.53 3.46 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 0.00 134 L 8.26 3.72 0.00 1.89 1.68 0.78 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.37 3.89 0.00 2.11 1.96 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 2.31 2.51 0.00 136 T 8.06 3.77 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 1.11 0.00 0.00 137 Q 7.65 3.64 0.00 1.67 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 1.16 1.17 0.00 138 L 7.45 3.79 0.00 1.73 1.60 0.86 0.93 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 0.00 139 D 7.70 4.25 0.00 2.88 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 0.00 140 L 7.82 3.95 0.00 1.85 1.67 0.89 0.69 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 0.00 141 I 7.40 3.46 1.76 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 -0.25 0.77 0.00 0.00 142 D 7.45 4.38 0.00 2.67 2.68 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 0.00 143 K 7.92 4.17 0.00 1.83 1.84 0.00 1.63 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.61 7.81 144 I 8.16 4.25 1.89 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 1.57 0.72 0.92 0.00 0.00 145 G 8.00 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 146 L 8.52 3.98 0.00 1.76 1.67 0.98 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 147 E 8.28 3.93 0.00 2.09 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 2.40 2.45 0.00 148 N 8.13 4.44 0.00 2.95 2.84 0.00 0.00 6.76 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 0.00 149 Y 7.65 4.10 0.00 3.05 3.16 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 0.00 0.00 0.00 0.00 150 L 8.07 4.04 0.00 1.76 1.69 0.93 0.88 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 0.00 151 Q 7.90 3.93 0.00 2.10 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.02 6.87 0.00 0.00 0.00 0.00 0.00 2.33 2.29 0.00 152 S 7.65 4.29 0.00 3.96 3.91 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 0.00 153 Q 7.76 4.22 0.00 2.06 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.84 0.00 0.00 0.00 0.00 0.00 1.78 1.91 0.00 154 M 7.74 4.26 0.00 1.94 2.27 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.52 0.00 155 D 7.82 4.50 0.00 2.59 2.49 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