NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4529 8.2893 120.3313 55.1917 32.3513 173.2957 2 K 4.4866 7.3900 119.3820 52.1848 34.4830 175.0579 3 T 4.2185 8.5691 113.3297 61.0076 70.5125 175.1013 4 F 4.1439 9.1010 125.8429 59.2507 39.7744 174.8309 5 T 3.8983 7.2023 121.0083 60.9605 71.1103 173.8566 6 A 3.7324 6.8749 129.8911 52.2512 19.0704 176.5052 7 K 4.5653 8.2600 121.3682 54.0102 34.9512 175.2728 8 P 4.1597 0.0000 0.0000 65.7957 31.3375 176.2680 9 E 4.5891 8.0288 116.5464 56.0963 29.5034 176.3676 10 T 4.6645 7.8896 105.8133 60.9780 72.3464 174.3435 11 V 3.5958 7.9057 120.9698 63.4998 31.9103 175.3980 12 K 4.2318 8.7740 126.9021 57.8750 34.1289 179.2220 13 R 4.2405 8.4313 115.5347 56.1051 28.0788 179.6667 14 D 4.9624 9.6286 124.1806 54.9449 40.3489 173.3571 15 W 5.2607 8.5466 121.4088 55.5459 31.6673 174.7311 16 Y 5.9756 9.3793 120.4671 55.4785 42.7977 174.1204 17 V 4.9983 8.5208 119.4318 61.2867 35.1495 174.2386 18 V 4.7289 9.3438 127.1435 61.1029 35.2420 173.6576 19 D 5.0402 8.5880 126.0164 52.3892 42.6169 175.9798 20 A 4.4604 9.3663 129.4651 52.8457 20.0371 178.5226 21 T 4.1745 8.3241 115.8519 66.1861 67.4777 176.3653 22 G 3.8788 9.2699 114.8456 47.0004 0.0000 173.4517 23 K 4.1856 8.4238 120.9768 56.0433 33.5986 176.6560 24 T 4.4915 8.6186 119.1374 61.2802 67.7774 172.2235 25 L 4.0158 8.5416 131.9017 58.4873 41.6403 176.1794 26 G 4.1202 9.2430 115.8198 46.1096 0.0000 174.9561 27 R 4.2751 8.5176 118.9272 57.6515 30.3909 178.5919 28 L 3.8369 7.8691 119.8568 57.7838 42.2087 178.2407 29 A 3.9823 8.1680 120.2699 55.6696 17.8351 179.1864 30 T 3.8285 7.4330 112.8467 67.3072 68.6791 176.3925 31 E 4.0334 7.6736 119.5546 58.9046 29.4710 178.8226 32 L 3.8247 8.1153 119.2785 58.2451 41.6188 179.5606 33 A 3.8383 8.2361 120.4597 55.1265 18.2460 179.7833 34 R 3.8970 7.5410 113.4349 59.1155 29.7364 179.4095 35 R 3.4441 7.8097 118.5428 59.0209 29.8385 178.7369 36 L 3.7585 8.2285 119.3273 57.4110 41.3914 178.7690 37 R 4.4539 7.5437 115.7194 55.5149 30.9907 176.9601 38 G 3.9679 7.9689 106.7851 45.8156 0.0000 174.9731 39 K 4.1127 7.9974 118.3825 57.7332 32.1427 176.2860 40 H 5.1232 8.3495 112.8287 54.3149 29.1665 173.2805 41 K 4.1584 7.7464 123.3728 57.7100 38.3584 174.8832 42 A 4.8121 8.6070 120.1335 50.6861 20.4682 178.1957 43 E 4.0554 9.1613 120.5954 61.2251 29.8550 179.1838 44 Y 3.8728 6.8658 117.5298 56.8381 36.2715 171.2005 45 T 3.1633 7.6991 118.1065 60.9174 66.6375 170.2311 46 P 4.6355 0.0000 0.0000 63.2429 32.1421 176.8517 47 H 4.6524 8.0214 113.1248 55.5509 29.3823 175.0323 48 V 4.1851 7.0837 120.0780 60.6679 33.6587 174.3934 49 D 4.4016 8.6379 126.5562 54.7441 40.5796 176.0080 50 T 4.4494 8.3389 116.5595 61.2582 69.9203 174.7670 51 G 3.8932 7.9549 110.4996 46.2208 0.0000 172.9571 52 D 4.9962 8.4111 120.3716 53.4604 43.1597 175.5000 53 Y 4.2174 8.9336 118.2252 56.5126 39.4775 175.0986 54 I 5.0648 7.9757 118.2795 58.9090 40.5591 174.4586 55 I 4.7315 9.1942 121.8842 59.9222 38.8634 175.5081 56 V 4.6055 8.5585 127.6035 62.0087 32.9987 174.7561 57 L 4.7366 8.2229 125.0602 53.8056 46.1798 175.4628 58 N 5.1624 9.6406 119.6714 53.3251 36.7383 176.3413 59 A 4.0201 7.9768 123.1470 55.4343 18.8255 180.0398 60 D 4.5082 8.1706 112.6440 55.3440 39.2630 176.7496 61 K 4.7270 7.7760 118.2874 55.9413 33.1566 176.8228 62 V 4.5151 8.6714 120.5774 61.7589 31.8498 175.5287 63 A 4.8936 9.1390 124.6011 50.7945 21.5173 177.0681 64 V 3.7094 8.5976 116.2630 63.5427 33.0281 177.1197 65 T 3.4498 7.5935 111.1482 61.5019 67.8050 171.7198 66 G 3.9452 8.0361 111.8097 47.2727 0.0000 174.2615 67 N 4.7946 8.4191 120.4219 52.7181 39.2516 176.4008 68 K 3.7670 7.5658 120.4848 59.6091 32.5023 179.0103 69 R 3.4091 7.9302 118.6057 58.4704 30.0378 177.2899 70 T 4.6218 7.9301 104.4423 61.3792 69.6138 173.9337 71 D 4.8719 7.6543 120.4974 54.0252 41.8855 176.1899 72 K 4.2537 7.8310 118.9125 55.8782 32.4538 176.8636 73 V 3.4727 7.7424 113.3590 62.4409 32.3985 177.4799 74 Y 3.8408 6.5268 112.0914 59.3137 34.6831 170.4343 75 Y 5.1396 7.7844 121.1918 56.9559 40.0156 174.7968 76 H 5.0599 9.0350 116.9007 54.8321 32.4541 171.5036 77 H 5.3195 8.7257 118.9898 54.5767 32.0627 174.3939 78 T 3.7474 8.9382 116.6686 63.2717 69.0096 175.8141 79 G 3.9327 8.5437 110.1668 45.4194 0.0000 172.6366 80 H 4.6823 7.8064 116.5061 53.9729 32.3615 178.9521 81 I 2.9420 9.0207 119.9163 61.9482 39.2126 176.0575 82 G 4.2564 8.7025 104.4568 44.5118 0.0000 174.6987 83 G 3.7026 8.7604 113.0755 45.1826 0.0000 172.4757 84 I 4.2478 7.2675 121.5034 59.5202 37.3375 175.5133 85 K 4.3807 8.2664 125.7125 56.3124 33.5640 175.5845 86 Q 5.0552 8.3169 116.8042 55.7139 30.7031 173.0634 87 A 4.7836 8.8647 122.9818 51.0567 22.8760 175.9974 88 T 4.4676 9.0214 115.5022 60.9187 68.6569 175.3284 89 F 4.2243 8.6749 124.7892 60.9641 39.4659 176.2146 90 E 4.0740 9.2124 117.6116 60.0677 29.2612 179.3392 91 E 3.9594 8.0591 118.5586 59.3373 29.3894 179.0612 92 M 3.8625 7.7188 117.6696 58.5276 32.1210 178.4221 93 I 3.5960 7.2076 118.1715 64.3155 37.2118 178.1235 94 A 4.3131 7.5724 120.7232 53.6831 18.5511 178.1464 95 R 4.1665 7.4830 119.3032 55.1311 29.5247 174.2565 96 R 3.9455 8.2236 125.0357 55.5030 26.6852 175.3500 97 P 4.2068 0.0000 0.0000 65.1491 31.6393 177.4438 98 E 3.9319 8.2765 117.0406 59.2893 29.2017 179.4683 99 R 4.0555 7.4371 117.5583 59.2110 30.2699 178.2839 100 V 3.3895 7.6093 118.1310 66.1981 31.3492 178.0969 101 I 3.7474 7.6566 118.5366 64.6465 37.0195 177.5540 102 E 4.1453 7.9884 119.0573 60.0785 29.4156 179.6199 103 I 3.6882 8.6795 112.6753 64.1025 37.2124 178.0480 104 A 4.0178 7.6918 121.2520 55.3565 18.7194 179.9118 105 V 3.7972 8.2517 110.4581 63.5753 31.6243 178.8794 106 K 4.1419 8.5673 120.4660 59.5997 31.9028 178.9444 107 G 3.8242 7.8971 104.0808 47.3876 0.0000 174.2808 108 M 4.3944 7.8133 118.4079 54.5180 33.0267 175.7744 109 L 4.7360 7.1964 119.4563 51.7593 43.9880 174.7192 110 P 4.3421 0.0000 0.0000 63.8834 32.9083 179.2941 111 K 4.1645 7.5507 117.2169 57.4791 37.0853 176.6758 112 G 3.8385 8.4970 108.9871 44.6370 0.0000 172.5865 113 P 4.0547 0.0000 0.0000 66.2628 31.6020 176.3718 114 L 4.1440 7.9598 117.9696 58.1787 42.3754 179.2512 115 G 4.1851 7.9532 106.4378 47.8155 0.0000 175.4476 116 R 3.9776 8.3295 119.6071 58.6510 30.4049 178.7915 117 A 4.1683 8.3820 121.1020 55.4433 18.4281 179.6250 118 M 4.5415 7.8371 118.1047 58.0094 32.0107 178.5566 119 F 4.1133 8.4259 120.4438 60.8284 39.2686 177.0974 120 R 4.1452 7.7059 116.3849 58.2617 29.9677 177.1693 121 K 4.0568 7.5750 117.8909 55.8740 31.8693 175.6461 122 L 4.5583 7.1237 122.0816 53.2023 42.6472 176.0736 123 K 4.4060 8.4651 127.3185 54.9624 32.4524 177.4306 124 V 3.7412 7.8806 118.1130 61.7444 32.4220 172.0890 125 Y 3.5329 7.4894 124.9948 57.3513 37.6757 170.7150 126 A 4.2282 8.8419 127.8646 54.1471 19.7252 176.9941 127 G 4.3158 7.8703 107.1344 45.1781 0.0000 174.2118 128 N 4.9194 8.7502 122.5366 52.9986 39.7007 174.0802 129 E 4.6589 7.7168 113.3921 55.7531 32.6666 173.2108 130 H 4.3733 7.7134 113.2915 54.2145 31.1673 172.2390 131 N 4.8219 8.2924 115.5123 53.5187 37.7119 174.9768 132 H 4.8918 7.8759 114.1762 55.9386 29.9425 176.6864 133 A 3.8936 8.2295 124.1300 55.3411 18.4284 180.7195 134 A 3.9648 7.7707 116.9832 55.2149 18.5117 178.5147 135 Q 3.5481 7.3259 113.1378 56.3861 29.0850 175.8139 136 Q 3.4510 7.9108 116.9947 56.0620 26.4824 172.3418 137 P 4.6815 0.0000 0.0000 63.1738 32.4937 177.0894 138 Q 4.8341 8.5763 120.8248 54.4271 31.5109 174.8906 139 V 4.6596 8.3119 120.6554 61.4648 32.7946 174.8414 140 L 4.9477 8.8146 122.9102 54.0502 43.8470 176.3727 141 D 4.8909 8.4911 118.5284 52.2386 41.3904 176.6413 142 I 3.6015 8.5485 127.1652 62.9919 37.2797 173.3211 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 8.29 4.45 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.62 0.00 2 K 7.39 4.49 0.00 2.01 1.82 0.00 1.61 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.46 7.81 3 T 8.57 4.22 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 4 F 9.10 4.14 0.00 2.95 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 5 T 7.20 3.90 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 1.10 0.00 0.00 6 A 6.87 3.73 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 K 8.26 4.57 0.00 1.88 1.85 0.00 1.53 0.00 0.00 1.79 0.00 0.00 2.87 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.38 7.81 8 P 0.00 4.16 0.00 2.06 2.20 0.00 3.65 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 2.04 2.10 0.00 9 E 8.03 4.59 0.00 1.91 1.93 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 2.26 2.36 0.00 10 T 7.89 4.66 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 11 V 7.91 3.60 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 0.85 0.00 0.00 1.04 0.00 0.00 12 K 8.77 4.23 0.00 1.79 1.86 0.00 2.12 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.49 7.81 13 R 8.43 4.24 0.00 2.24 1.62 0.00 3.45 0.00 0.00 4.01 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.78 0.00 14 D 9.63 4.96 0.00 2.95 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 15 W 8.55 5.26 0.00 3.18 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 9.38 5.98 0.00 2.87 2.84 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 17 V 8.52 5.00 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 1.02 0.00 0.00 1.00 0.00 0.00 18 V 9.34 4.73 2.11 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 0.91 0.00 0.00 0.95 0.00 0.00 19 D 8.59 5.04 0.00 2.82 2.56 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 0.00 20 A 9.37 4.46 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 21 T 8.32 4.17 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 1.23 0.00 0.00 22 G 9.27 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 0.00 0.00 0.00 23 K 8.42 4.19 0.00 1.71 1.75 0.00 1.82 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.41 7.81 24 T 8.62 4.49 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 1.22 0.00 0.00 25 L 8.54 4.02 0.00 1.81 1.87 1.13 1.35 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 26 G 9.24 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 0.00 0.00 0.00 27 R 8.52 4.28 0.00 1.99 1.98 0.00 3.12 0.00 0.00 3.09 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 28 L 7.87 3.84 0.00 1.77 1.67 0.97 1.15 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 29 A 8.17 3.98 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 30 T 7.43 3.83 4.47 0.00 0.00 0.00 0.00 0.00 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 31 E 7.67 4.03 0.00 1.78 1.93 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 2.29 2.46 0.00 32 L 8.12 3.82 0.00 1.86 1.69 0.90 1.05 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 33 A 8.24 3.84 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 34 R 7.54 3.90 0.00 2.02 2.15 0.00 2.74 0.00 0.00 3.13 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.65 0.00 35 R 7.81 3.44 0.00 1.83 1.76 0.00 3.29 0.00 0.00 2.95 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.72 0.00 36 L 8.23 3.76 0.00 1.80 1.71 0.71 0.72 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 37 R 7.54 4.45 0.00 1.85 2.01 0.00 3.28 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 38 G 7.97 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 39 K 8.00 4.11 0.00 1.80 1.82 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.40 7.81 40 H 8.35 5.12 0.00 3.17 3.26 0.00 5.67 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 7.75 4.16 0.00 1.82 1.61 0.00 1.55 0.00 0.00 1.71 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.10 1.63 7.81 42 A 8.61 4.81 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 43 E 9.16 4.06 0.00 2.21 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 2.35 2.34 0.00 44 Y 6.87 3.87 0.00 3.10 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 45 T 7.70 3.16 4.22 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 1.29 0.00 0.00 46 P 0.00 4.64 0.00 2.12 2.10 0.00 3.81 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 47 H 8.02 4.65 0.00 3.23 3.39 0.00 5.66 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 48 V 7.08 4.19 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 0.74 0.00 0.00 0.69 0.00 0.00 49 D 8.64 4.40 0.00 2.72 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 50 T 8.34 4.45 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 51 G 7.95 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 52 D 8.41 5.00 0.00 2.62 3.22 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 53 Y 8.93 4.22 0.00 1.43 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 54 I 7.98 5.06 1.86 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 1.22 0.58 0.79 0.00 0.00 55 I 9.19 4.73 2.07 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 1.02 0.76 1.32 0.00 0.00 56 V 8.56 4.61 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.93 0.00 0.00 57 L 8.22 4.74 0.00 2.02 1.44 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 58 N 9.64 5.16 0.00 3.19 2.89 0.00 0.00 6.77 7.95 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 59 A 7.98 4.02 1.31 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 60 D 8.17 4.51 0.00 2.78 2.81 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 0.00 0.00 0.00 0.00 61 K 7.78 4.73 0.00 1.69 1.87 0.00 1.74 0.00 0.00 1.78 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.37 7.81 62 V 8.67 4.52 2.24 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 1.19 0.00 0.00 1.11 0.00 0.00 63 A 9.14 4.89 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 64 V 8.60 3.71 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 0.48 0.00 0.00 0.22 0.00 0.00 65 T 7.59 3.45 4.20 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 0.00 0.00 0.00 1.17 0.00 0.00 66 G 8.04 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 67 N 8.42 4.79 0.00 2.80 2.79 0.00 0.00 6.83 7.30 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 68 K 7.57 3.77 0.00 1.62 1.70 0.00 1.67 0.00 0.00 1.49 0.00 0.00 2.80 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.49 7.81 69 R 7.93 3.41 0.00 1.63 1.86 0.00 3.11 0.00 0.00 3.44 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.82 0.00 70 T 7.93 4.62 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 1.29 0.00 0.00 71 D 7.65 4.87 0.00 2.70 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 72 K 7.83 4.25 0.00 2.00 1.71 0.00 1.73 0.00 0.00 1.85 0.00 0.00 2.26 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.36 1.54 7.81 73 V 7.74 3.47 2.32 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 0.79 0.00 0.00 0.78 0.00 0.00 74 Y 6.53 3.84 0.00 3.51 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 75 Y 7.78 5.14 0.00 2.85 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 76 H 9.04 5.06 0.00 3.30 3.42 0.00 5.40 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.73 5.32 0.00 3.28 3.15 0.00 5.86 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.94 3.75 4.30 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 1.22 0.00 0.00 79 G 8.54 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 0.00 0.00 0.00 80 H 7.81 4.68 0.00 3.27 3.26 0.00 5.91 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 9.02 2.94 1.90 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 1.36 0.68 0.95 0.00 0.00 82 G 8.70 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 0.00 0.00 0.00 0.00 83 G 8.76 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 84 I 7.27 4.25 1.89 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.92 0.93 0.00 0.00 85 K 8.27 4.38 0.00 1.53 1.68 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.85 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.37 1.43 7.81 86 Q 8.32 5.06 0.00 1.43 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.73 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 87 A 8.86 4.78 1.23 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 0.00 0.00 88 T 9.02 4.47 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 1.36 0.00 0.00 89 F 8.67 4.22 0.00 3.29 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 9.21 4.07 0.00 2.27 2.37 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 2.65 2.48 0.00 91 E 8.06 3.96 0.00 2.21 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 2.40 2.41 0.00 92 M 7.72 3.86 0.00 1.57 1.76 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.58 0.00 93 I 7.21 3.60 1.89 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 0.82 0.53 0.88 0.00 0.00 94 A 7.57 4.31 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 95 R 7.48 4.17 0.00 1.92 1.95 0.00 3.15 0.00 0.00 3.19 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.50 0.00 96 R 8.22 3.95 0.00 1.99 1.95 0.00 3.37 0.00 0.00 3.26 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 97 P 0.00 4.21 0.00 2.11 2.02 0.00 3.58 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.33 0.00 98 E 8.28 3.93 0.00 2.00 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 2.34 2.42 0.00 99 R 7.44 4.06 0.00 2.00 1.71 0.00 3.29 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.53 0.00 100 V 7.61 3.39 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 1.13 0.00 0.00 0.43 0.00 0.00 101 I 7.66 3.75 1.89 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 1.66 0.73 0.93 0.00 0.00 102 E 7.99 4.15 0.00 2.26 2.33 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 2.43 2.59 0.00 103 I 8.68 3.69 1.94 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.67 0.89 0.00 0.00 104 A 7.69 4.02 1.54 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 0.00 105 V 8.25 3.80 2.11 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 0.93 0.00 0.00 1.01 0.00 0.00 106 K 8.57 4.14 0.00 1.60 2.00 0.00 1.29 0.00 0.00 1.44 0.00 0.00 2.51 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.29 7.81 107 G 7.90 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 0.00 108 M 7.81 4.39 0.00 2.02 2.14 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 2.82 2.58 0.00 109 L 7.20 4.74 0.00 1.68 1.60 1.08 0.90 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 0.00 110 P 0.00 4.34 0.00 2.21 2.18 0.00 3.75 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.96 0.00 111 K 7.55 4.16 0.00 1.94 1.32 0.00 1.42 0.00 0.00 1.71 0.00 0.00 3.25 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.35 1.49 7.81 112 G 8.50 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 0.00 113 P 0.00 4.05 0.00 2.03 2.11 0.00 3.69 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.18 0.00 114 L 7.96 4.14 0.00 1.71 1.66 0.94 0.94 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 0.00 115 G 7.95 4.19 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 0.00 0.00 0.00 116 R 8.33 3.98 0.00 1.98 2.02 0.00 3.13 0.00 0.00 3.27 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 117 A 8.38 4.17 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 0.00 118 M 7.84 4.54 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.43 0.00 119 F 8.43 4.11 0.00 3.07 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 0.00 120 R 7.71 4.15 0.00 2.10 2.03 0.00 3.26 0.00 0.00 3.28 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.97 0.00 121 K 7.57 4.06 0.00 1.49 0.94 0.00 0.79 0.00 0.00 0.94 0.00 0.00 2.79 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.30 0.90 7.81 122 L 7.12 4.56 0.00 1.14 1.06 0.82 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 123 K 8.47 4.41 0.00 2.16 2.14 0.00 1.60 0.00 0.00 1.67 0.00 0.00 3.23 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.69 1.59 7.81 124 V 7.88 3.74 2.08 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 0.67 0.00 0.00 0.89 0.00 0.00 125 Y 7.49 3.53 0.00 3.38 3.05 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 0.00 126 A 8.84 4.23 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 0.00 127 G 7.87 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 N 8.75 4.92 0.00 2.73 2.76 0.00 0.00 6.59 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 0.00 129 E 7.72 4.66 0.00 1.89 1.76 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 2.12 2.31 0.00 130 H 7.71 4.37 0.00 2.35 2.24 0.00 5.51 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 N 8.29 4.82 0.00 2.82 2.91 0.00 0.00 5.90 7.90 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 0.00 132 H 7.88 4.89 0.00 3.18 2.95 0.00 5.63 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 A 8.23 3.89 1.22 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 0.00 0.00 134 A 7.77 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 Q 7.33 3.55 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.70 0.00 0.00 0.00 0.00 0.00 1.79 1.16 0.00 136 Q 7.91 3.45 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.83 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 137 P 0.00 4.68 0.00 2.17 2.27 0.00 3.81 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.05 0.00 138 Q 8.58 4.83 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.00 0.00 0.00 0.00 0.00 0.00 1.90 2.33 0.00 139 V 8.31 4.66 2.14 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 0.79 0.00 0.00 0.98 0.00 0.00 140 L 8.81 4.95 0.00 1.62 1.78 0.90 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 141 D 8.49 4.89 0.00 2.66 2.34 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 0.00 142 I 8.55 3.60 1.85 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 1.27 0.35 0.90 0.00 0.00