NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.4193 8.3044 120.3355 55.2051 33.5560 173.9876 3 V 4.2035 8.0015 122.1245 59.9217 33.5762 172.9096 4 W 4.5865 9.1362 135.0000 57.4785 31.5960 174.8985 5 T 4.1627 8.1414 123.9682 61.5064 67.0312 172.5466 6 P 4.5496 0.0000 0.0000 63.1369 32.2614 175.5549 7 V 4.1157 7.3937 119.6418 62.4880 32.7058 175.1569 8 N 4.2859 8.6993 125.3604 54.9987 36.1129 173.4578 9 N 5.0366 7.7097 109.3726 52.9369 40.0098 174.1892 10 K 4.1161 8.3538 116.5230 56.5131 32.7935 176.9095 11 M 4.8809 8.3542 121.6141 54.0253 34.8213 175.3593 12 F 4.5905 8.3545 116.8131 57.2692 41.0851 176.5604 13 E 3.5237 8.4068 121.3212 56.9902 27.6751 175.0498 14 T 3.8335 8.3716 121.2976 66.6047 68.9198 174.2390 15 F 4.5377 9.0363 124.0111 57.6422 36.7543 176.4373 16 S 4.4814 8.2307 114.7554 60.3919 63.0594 174.5292 17 Y 4.3719 8.3029 117.2789 58.2948 38.1498 175.0494 18 L 4.6640 7.6174 120.3250 52.1795 43.6039 174.4593 19 P 4.4541 0.0000 0.0000 61.8656 31.7632 175.0758 20 P 4.3489 0.0000 0.0000 62.5655 31.8063 176.5536 21 L 3.9743 8.3287 122.7028 54.8517 42.1647 178.0118 22 T 4.2513 8.1972 114.0310 61.1527 71.1680 175.3322 23 D 4.3405 8.5390 120.9042 57.5415 40.7367 178.7633 24 E 3.9351 8.0800 119.4155 59.3056 29.8500 178.7390 25 Q 3.9521 7.9446 118.0295 58.6311 28.7118 178.6657 26 I 3.7234 8.0012 120.8695 64.4227 37.2590 178.1205 27 A 4.0377 8.2252 121.4601 55.3589 18.1339 179.5706 28 A 4.0084 8.0838 119.1352 55.4028 18.4182 179.9396 29 Q 4.1073 7.9993 116.3011 59.0757 28.8100 179.0485 30 V 3.7549 8.2096 119.4404 66.1338 31.5841 177.7605 31 D 4.4303 8.3530 118.7059 57.5167 40.5156 178.1504 32 Y 4.1716 8.0891 119.9521 60.7109 38.8151 178.1401 33 I 3.9389 7.9834 120.7072 64.6418 37.3895 178.6550 34 V 3.5407 7.9278 118.6845 65.9169 31.1500 177.8398 35 A 3.9207 8.2114 119.8830 54.5877 18.2555 178.3475 36 N 4.0979 7.1015 111.9770 52.1022 38.7240 175.7961 37 G 3.7517 7.2121 108.1470 45.9778 0.0000 174.0279 38 W 4.9644 7.5441 119.0716 56.0453 30.7529 176.1705 39 I 4.4285 9.0015 122.8685 59.3753 38.0290 174.0354 40 P 4.9091 0.0000 0.0000 62.8985 32.7432 175.2078 41 C 4.9968 8.8422 121.5025 58.3837 35.5841 172.4320 42 L 5.3379 8.7521 123.8676 53.2247 44.4487 175.1987 43 E 5.6197 9.1928 120.9921 54.9757 34.1826 174.5466 44 F 5.6177 9.1185 115.9547 56.0795 42.0605 172.9290 45 A 4.4790 8.3115 119.8563 50.3327 22.6131 176.2852 46 E 4.2699 8.6173 118.6350 55.7324 30.7259 177.6597 47 A 4.3064 8.8715 123.0488 55.9261 18.3756 179.6600 48 D 4.5765 8.1392 112.8845 56.1794 41.0651 177.0757 49 K 4.6175 8.0309 117.3725 56.0103 32.7736 176.7978 50 A 3.8540 7.6880 124.4034 53.8710 18.8069 178.1612 51 Y 4.6697 7.4591 111.3388 55.5200 40.3542 175.7683 52 V 3.8275 8.3984 122.4148 63.8523 31.9566 175.2693 53 S 4.7897 9.0085 119.8213 56.6354 66.3452 173.6570 54 N 5.1265 8.5605 114.4711 52.6565 39.2498 175.9983 55 E 3.9616 8.2823 120.7783 59.9290 29.3913 179.2230 56 S 4.0162 8.7446 115.2016 60.5460 62.8750 176.0750 57 A 2.5800 7.6165 123.3447 53.5733 17.7270 178.9845 58 I 3.5500 6.9480 116.9128 63.7807 37.9851 177.0807 59 R 4.2848 7.5115 116.3023 55.6655 30.5776 176.2650 60 F 5.0671 7.1473 118.0347 55.9822 41.2820 177.3815 61 G 4.0371 8.2477 117.3012 46.3434 0.0000 175.8062 62 S 4.6087 8.4419 114.4517 58.4308 62.0040 174.4489 63 V 4.4511 7.2653 107.3105 61.1372 33.2943 177.6653 64 S 4.5014 8.2026 115.2090 59.5974 63.5507 173.5408 65 C 4.0313 8.1160 119.0659 61.6523 27.9780 173.1181 66 L 3.5649 8.4439 122.9036 55.5518 39.0556 173.1315 67 Y 4.3597 7.6749 119.4404 56.0013 39.9552 174.5971 68 Y 4.9138 7.0958 123.1495 56.4471 42.3563 174.5957 69 D 4.5295 8.9861 123.4687 55.1774 41.8773 177.0788 70 N 4.7054 8.9160 116.8155 54.0869 35.9887 176.0070 71 R 3.9422 7.9534 118.6658 59.3284 30.3552 177.1421 72 Y 4.3870 7.7110 114.6687 57.8658 38.4230 175.0727 73 W 5.0966 8.6817 124.2631 55.4571 32.6379 174.5076 74 T 4.3538 8.0581 116.8362 62.5496 69.7141 174.4956 75 M 4.6301 8.4752 126.2958 55.2468 33.1553 175.2230 76 W 4.7943 9.4728 135.0000 56.3262 31.2662 176.8061 77 K 3.4063 8.5575 128.7816 57.6197 30.5999 177.8588 78 L 4.9223 8.2255 125.4483 52.6490 45.1005 174.0048 79 P 4.3462 0.0000 0.0000 63.3482 32.2471 177.6868 80 M 4.3160 8.6756 123.4455 53.8392 30.3803 175.5574 81 F 4.5209 7.4717 118.9383 58.6731 40.0327 176.3968 82 G 3.9573 9.1208 112.1508 45.7515 0.0000 173.0294 83 C 4.2873 7.9537 120.5877 59.5223 31.7015 173.2457 84 R 4.5214 8.6568 123.8314 55.5408 30.9747 174.4245 85 D 4.8526 7.8111 118.7303 51.6216 42.6217 174.6221 86 P 4.3230 0.0000 0.0000 65.9995 31.2410 178.4811 87 M 4.1035 8.1977 117.1433 58.3536 31.9284 178.4677 88 Q 3.9748 7.8613 119.3280 59.1554 29.2253 178.6740 89 V 3.6208 7.7489 118.6516 66.1167 31.8448 177.8275 90 L 4.0466 8.0282 118.6912 57.9486 41.4146 179.8063 91 R 4.0018 8.4216 118.3486 59.1924 29.9643 178.9745 92 E 4.1385 8.2654 118.3615 59.1992 29.4858 179.2137 93 I 3.5156 7.8150 119.9907 64.2676 37.1452 178.4646 94 V 3.4591 7.6046 118.2736 65.9726 31.4031 177.7157 95 A 3.9382 7.9767 120.3742 55.3080 18.2426 179.1135 96 C 2.0000 7.8026 117.3699 62.1042 31.0652 176.0025 97 T 3.7362 7.5044 111.1788 64.3578 67.9479 176.3495 98 K 3.8110 7.7622 121.7849 59.3670 32.3353 178.4523 99 A 3.9725 7.5282 119.7703 53.5525 19.9526 177.6514 100 F 4.7200 7.7208 115.4312 55.1090 39.0916 174.0585 101 P 4.4214 0.0000 0.0000 64.3040 31.8809 177.8797 102 D 4.6516 8.0685 116.6973 53.8898 41.1781 175.4660 103 A 4.8059 7.3750 120.7952 50.3682 21.3356 177.0546 104 Y 4.2069 8.5642 117.9402 57.8952 39.4395 175.2792 105 V 5.1902 9.0144 123.3203 61.1438 35.1908 174.2377 106 R 5.0107 9.5382 124.1844 54.2499 32.8348 173.9932 107 L 4.7893 8.0917 123.7893 54.0531 43.7597 175.7352 108 V 4.8635 8.6610 118.4278 59.5124 36.4209 174.1782 109 A 4.9554 8.0155 121.5185 50.5279 22.8670 175.2249 110 F 5.2303 9.0394 120.0054 55.7089 42.5478 174.0608 111 D 5.4432 8.8860 122.6101 52.7575 42.4701 176.5783 112 N 4.7526 9.1682 122.8189 54.0862 38.4495 176.3228 113 Q 4.2003 8.7772 118.8919 58.8813 29.0378 177.6068 114 K 4.0353 8.3405 114.7987 57.1036 32.8719 176.6341 115 Q 3.4249 8.0478 117.7633 55.8279 26.9156 172.4548 116 V 4.4704 7.8779 117.7593 60.1140 34.9520 173.8478 117 Q 4.3334 8.7023 123.1306 56.3383 29.3095 175.4147 118 I 4.1721 8.3069 125.3033 61.3768 39.7475 174.5495 119 M 4.7085 6.9091 117.6714 53.9216 34.7894 173.8490 120 G 4.8435 8.2452 106.6710 47.1160 0.0000 172.3347 121 F 5.0577 7.0796 116.7753 55.2531 41.2018 172.9014 122 L 4.5825 8.8035 122.7365 55.5658 42.0129 176.7708 123 V 4.5318 8.9470 118.1244 61.4896 34.2533 175.7532 124 Q 4.5993 7.8698 121.1873 54.3078 32.4477 173.4152 125 R 4.3567 8.1659 121.8259 52.8930 32.6285 173.6381 126 P 4.1448 0.0000 0.0000 62.8865 31.5962 177.5946 127 K 4.0831 8.4999 120.4590 59.0892 32.1181 177.8886 128 T 4.1888 7.7464 106.8549 61.8642 69.4050 174.7953 129 A 4.2765 7.8433 126.8792 52.9101 18.6982 177.4526 130 R 4.6695 8.8107 120.2343 55.8783 31.7694 175.3867 131 D 4.9937 8.5277 116.4139 52.7140 39.7416 175.3716 132 F 5.2673 7.8171 112.8968 55.5531 40.9402 173.7192 133 Q 4.3921 8.3698 120.9975 53.1186 30.8815 174.1128 134 P 4.4781 0.0000 0.0000 62.3110 32.5016 176.9247 135 A 4.0016 8.8233 122.9056 55.5669 18.2173 179.3586 136 N 4.6211 8.0691 110.4270 54.2780 37.8623 175.6832 137 K 4.4265 7.9167 117.7609 56.2250 32.8295 177.3587 138 R 3.5775 7.5310 119.9884 57.7774 30.1179 176.7262 139 S 5.0364 7.4585 110.2327 56.2822 65.9232 174.2460 140 V 3.9837 8.5554 114.7680 61.7382 32.1412 175.6118 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 2 M 8.30 4.42 0.00 2.08 2.15 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.57 0.00 3 V 8.00 4.20 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 1.07 0.00 0.00 0.96 0.00 0.00 4 W 9.14 4.59 0.00 3.48 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.14 4.16 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 1.02 0.00 0.00 6 P 0.00 4.55 0.00 2.23 2.19 0.00 3.78 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 7 V 7.39 4.12 2.03 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 0.78 0.00 0.00 0.91 0.00 0.00 8 N 8.70 4.29 0.00 2.92 2.88 0.00 0.00 6.83 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 N 7.71 5.04 0.00 2.66 2.70 0.00 0.00 7.29 6.68 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 10 K 8.35 4.12 0.00 1.98 1.59 0.00 1.30 0.00 0.00 0.61 0.00 0.00 2.50 0.00 0.00 2.48 0.00 0.00 0.00 0.00 1.24 1.26 7.81 11 M 8.35 4.88 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.64 0.00 12 F 8.35 4.59 0.00 3.11 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 13 E 8.41 3.52 0.00 2.14 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 2.19 2.13 0.00 14 T 8.37 3.83 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.17 0.00 0.00 15 F 9.04 4.54 0.00 3.29 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 16 S 8.23 4.48 0.00 4.15 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 0.00 17 Y 8.30 4.37 0.00 3.02 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 18 L 7.62 4.66 0.00 1.84 1.62 0.88 1.08 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 19 P 0.00 4.45 0.00 2.03 2.00 0.00 3.69 0.00 0.00 3.70 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 20 P 0.00 4.35 0.00 2.05 2.01 0.00 3.70 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.17 0.00 21 L 8.33 3.97 0.00 1.60 1.50 0.29 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.20 4.25 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 1.18 0.00 0.00 23 D 8.54 4.34 0.00 2.70 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 24 E 8.08 3.94 0.00 2.02 1.91 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 2.35 2.39 0.00 25 Q 7.94 3.95 0.00 2.30 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.59 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 26 I 8.00 3.72 2.06 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.79 1.07 0.00 0.00 27 A 8.23 4.04 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 28 A 8.08 4.01 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 29 Q 8.00 4.11 0.00 2.50 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.75 0.00 0.00 0.00 0.00 0.00 2.42 1.95 0.00 30 V 8.21 3.75 2.30 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 1.15 0.00 0.00 1.07 0.00 0.00 31 D 8.35 4.43 0.00 3.01 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 32 Y 8.09 4.17 0.00 3.25 3.36 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 33 I 7.98 3.94 2.16 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.94 1.10 0.00 0.00 34 V 7.93 3.54 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 1.03 0.00 0.00 0.96 0.00 0.00 35 A 8.21 3.92 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 36 N 7.10 4.10 0.00 1.44 1.42 0.00 0.00 7.05 8.80 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 37 G 7.21 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 W 7.54 4.96 0.00 3.38 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 39 I 9.00 4.43 2.12 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.00 0.77 0.00 0.00 40 P 0.00 4.91 0.00 2.10 1.99 0.00 3.80 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.14 0.00 41 C 8.84 5.00 0.00 3.12 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 42 L 8.75 5.34 0.00 1.86 1.64 0.90 0.81 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 43 E 9.19 5.62 0.00 2.06 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 2.36 2.32 0.00 44 F 9.12 5.62 0.00 3.05 3.02 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 45 A 8.31 4.48 -0.17 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 46 E 8.62 4.27 0.00 2.18 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 0.00 2.30 2.28 0.00 47 A 8.87 4.31 1.50 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 48 D 8.14 4.58 0.00 2.71 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 49 K 8.03 4.62 0.00 1.60 1.68 0.00 1.71 0.00 0.00 1.84 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.33 1.43 7.81 50 A 7.69 3.85 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.46 4.67 0.00 2.91 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 52 V 8.40 3.83 1.95 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 0.62 0.00 0.00 0.76 0.00 0.00 53 S 9.01 4.79 0.00 4.06 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 54 N 8.56 5.13 0.00 2.75 2.86 0.00 0.00 6.57 7.66 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 55 E 8.28 3.96 0.00 2.15 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 0.00 2.40 2.39 0.00 56 S 8.74 4.02 0.00 3.96 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 57 A 7.62 2.58 1.13 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 0.00 0.00 58 I 6.95 3.55 1.78 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 1.47 0.81 0.84 0.00 0.00 59 R 7.51 4.28 0.00 1.89 2.00 0.00 3.19 0.00 0.00 3.22 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 60 F 7.15 5.07 0.00 2.99 2.80 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 61 G 8.25 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 62 S 8.44 4.61 0.00 3.86 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 63 V 7.27 4.45 1.85 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 0.66 0.00 0.00 0.46 0.00 0.00 64 S 8.20 4.50 0.00 4.11 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 0.00 65 C 8.12 4.03 0.00 2.96 2.95 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 66 L 8.44 3.56 0.00 1.76 1.74 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 7.67 4.36 0.00 2.88 3.02 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 68 Y 7.10 4.91 0.00 2.82 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 69 D 8.99 4.53 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 70 N 8.92 4.71 0.00 3.07 3.26 0.00 0.00 6.99 7.66 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 71 R 7.95 3.94 0.00 1.52 1.68 0.00 3.07 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 72 Y 7.71 4.39 0.00 3.06 2.86 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 73 W 8.68 5.10 0.00 3.06 3.17 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 74 T 8.06 4.35 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 75 M 8.48 4.63 0.00 2.08 2.02 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.77 0.00 76 W 9.47 4.79 0.00 3.67 3.30 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 77 K 8.56 3.41 0.00 1.67 0.82 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.71 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.86 0.21 7.81 78 L 8.23 4.92 0.00 1.59 1.56 1.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.35 0.00 0.65 1.82 0.00 3.61 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.12 0.00 80 M 8.68 4.32 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.54 0.00 81 F 7.47 4.52 0.00 3.10 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 82 G 9.12 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 83 C 7.95 4.29 0.00 3.08 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 84 R 8.66 4.52 0.00 1.80 1.88 0.00 3.22 0.00 0.00 3.15 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.77 0.00 85 D 7.81 4.85 0.00 2.73 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 86 P 0.00 4.32 0.00 2.22 2.13 0.00 3.67 0.00 0.00 3.96 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 87 M 8.20 4.10 0.00 2.08 2.27 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.71 0.00 88 Q 7.86 3.97 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 89 V 7.75 3.62 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 1.05 0.00 0.00 0.98 0.00 0.00 90 L 8.03 4.05 0.00 1.92 1.72 0.95 0.77 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 91 R 8.42 4.00 0.00 2.03 2.01 0.00 3.15 0.00 0.00 3.19 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.88 0.00 92 E 8.27 4.14 0.00 2.26 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 0.00 2.61 2.65 0.00 93 I 7.81 3.52 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 1.35 1.07 0.85 0.00 0.00 94 V 7.60 3.46 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 0.97 0.00 0.00 0.99 0.00 0.00 95 A 7.98 3.94 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 96 C 7.80 2.00 0.00 1.23 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 0.00 0.00 0.00 0.00 97 T 7.50 3.74 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 1.11 0.00 0.00 98 K 7.76 3.81 0.00 1.82 1.93 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.37 1.39 7.81 99 A 7.53 3.97 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 0.00 100 F 7.72 4.72 0.00 2.81 2.80 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 0.00 101 P 0.00 4.42 0.00 2.12 2.11 0.00 3.24 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.87 0.00 102 D 8.07 4.65 0.00 2.68 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.38 4.81 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 0.00 104 Y 8.56 4.21 0.00 2.53 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 0.00 105 V 9.01 5.19 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 0.98 0.00 0.00 0.88 0.00 0.00 106 R 9.54 5.01 0.00 1.81 1.92 0.00 2.34 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.36 0.00 107 L 8.09 4.79 0.00 1.52 0.74 0.91 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.66 4.86 1.63 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 0.55 0.00 0.00 0.55 0.00 0.00 109 A 8.02 4.96 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 0.00 110 F 9.04 5.23 0.00 3.01 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 0.00 111 D 8.89 5.44 0.00 2.40 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 N 9.17 4.75 0.00 2.93 3.05 0.00 0.00 6.31 7.39 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 0.00 113 Q 8.78 4.20 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.05 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 114 K 8.34 4.04 0.00 1.76 1.87 0.00 2.07 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.47 7.81 115 Q 8.05 3.42 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.71 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 116 V 7.88 4.47 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 0.47 0.00 0.00 0.92 0.00 0.00 117 Q 8.70 4.33 0.00 2.13 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.91 0.00 0.00 0.00 0.00 0.00 2.16 1.91 0.00 118 I 8.31 4.17 1.18 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.23 -0.53 0.00 0.00 119 M 6.91 4.71 0.00 2.07 2.23 0.00 0.00 0.00 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.59 0.00 120 G 8.25 4.84 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 0.00 121 F 7.08 5.06 0.00 3.21 3.26 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 0.00 122 L 8.80 4.58 0.00 1.62 1.62 0.75 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 123 V 8.95 4.53 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 0.73 0.00 0.00 0.94 0.00 0.00 124 Q 7.87 4.60 0.00 1.99 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.82 0.00 0.00 0.00 0.00 0.00 2.26 2.22 0.00 125 R 8.17 4.36 0.00 1.20 1.51 0.00 2.21 0.00 0.00 2.69 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.22 0.00 126 P 0.00 4.14 0.00 2.10 2.17 0.00 2.20 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 127 K 8.50 4.08 0.00 1.74 1.92 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.39 7.81 128 T 7.75 4.19 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 1.21 0.00 0.00 129 A 7.84 4.28 1.53 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 0.00 0.00 0.00 130 R 8.81 4.67 0.00 1.80 1.88 0.00 3.33 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.54 0.00 131 D 8.53 4.99 0.00 2.88 2.95 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 0.00 132 F 7.82 5.27 0.00 3.21 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 Q 8.37 4.39 0.00 1.88 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.05 0.00 0.00 0.00 0.00 0.00 2.31 2.06 0.00 134 P 0.00 4.48 0.00 2.34 2.18 0.00 3.53 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.87 0.00 135 A 8.82 4.00 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 0.00 136 N 8.07 4.62 0.00 2.83 2.94 0.00 0.00 5.86 7.13 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 0.00 137 K 7.92 4.43 0.00 1.58 1.71 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.30 1.29 7.81 138 R 7.53 3.58 0.00 1.48 0.66 0.00 3.00 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 1.27 1.50 0.00 139 S 7.46 5.04 0.00 4.00 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 0.00 140 V 8.56 3.98 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 0.61 0.00 0.00 0.94 0.00 0.00