NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3746 8.3044 120.3477 55.0202 33.4551 174.2910 2 L 4.0589 8.1521 122.8199 53.8517 42.4144 172.8581 3 T 3.9838 7.9301 116.8147 62.0259 69.8562 174.0157 4 D 4.5699 7.7905 129.0409 52.4425 42.2100 174.6436 5 P 4.0793 0.0000 0.0000 65.9638 31.4043 178.1357 6 I 3.3915 7.4795 117.1655 65.0850 37.1325 177.1830 7 A 3.7986 9.4137 121.4196 55.3502 17.9401 179.1731 8 D 4.2302 8.1982 114.0770 58.1073 41.7314 178.4727 9 M 3.6261 8.4928 115.8317 59.3313 31.8222 178.2955 10 L 3.6055 7.9958 116.5908 58.4847 41.9483 179.2586 11 T 3.9876 8.8567 115.1000 67.3601 68.5321 176.5536 12 R 3.9701 9.0308 120.3552 59.6369 30.1411 179.1733 13 I 3.6868 7.7450 119.2954 64.1861 37.0572 178.1005 14 R 3.7337 8.3389 119.2896 59.5751 29.9787 178.0196 15 N 4.3720 9.2822 116.3924 56.2746 38.5907 176.8199 16 A 3.9986 8.0828 122.3662 55.8785 18.3146 179.4220 17 T 3.7302 8.0164 113.7930 66.8814 68.3523 176.6808 18 R 3.6110 7.2723 117.9422 59.5553 30.1245 178.6554 19 V 3.9912 7.7835 106.9835 61.2130 31.3126 175.7527 20 Y 4.4443 7.6411 115.7150 57.9670 36.7650 173.7120 21 K 4.6374 7.7695 125.8052 55.3879 31.8873 177.8770 22 E 5.5490 8.4769 127.3363 56.5644 31.8238 175.5333 23 S 4.9591 8.0107 111.0657 58.3848 65.2248 175.7365 24 T 4.6392 8.4172 118.0192 60.6797 70.9536 172.4868 25 D 5.5994 8.9118 127.6736 53.5530 42.3159 176.0862 26 V 4.6813 8.2675 119.6201 59.4451 35.2390 172.3827 27 P 3.4261 0.0000 0.0000 61.8397 31.5573 176.2627 28 A 4.2829 7.8964 127.2942 52.5161 19.3575 176.8464 29 S 4.5095 8.4332 112.0832 57.1995 65.0031 175.2728 30 R 3.7819 8.5043 120.6045 59.4563 29.8016 178.0164 31 F 3.5280 7.7869 115.6286 61.5868 40.5438 178.3893 32 K 4.2133 8.8690 118.9962 59.4963 32.6237 178.3212 33 E 3.6794 8.0149 117.6945 60.1835 29.6459 178.0808 34 E 3.8126 8.7523 118.5421 58.8157 29.3635 179.3216 35 I 3.7133 7.6692 118.8157 64.7985 37.6385 177.7440 36 L 3.8293 8.0624 119.9524 58.0527 41.3531 179.4908 37 R 3.7599 8.2630 118.6511 59.5375 29.9751 178.1775 38 I 3.6945 7.7735 118.8097 64.6922 37.0758 177.8958 39 L 4.1662 8.5203 119.4763 57.6356 41.3628 179.1195 40 A 4.2062 9.2366 120.1012 53.6469 17.7053 181.1695 41 R 3.6663 6.4744 118.7866 57.3375 31.1759 177.7102 42 E 4.1397 8.6137 116.2534 56.9650 29.3677 177.8362 43 G 3.8626 10.6191 106.9855 46.1669 0.0000 174.9472 44 F 4.6347 8.4619 121.3300 58.9813 39.2848 176.1952 45 I 4.8174 7.4470 111.1952 58.4112 40.5053 175.1213 46 K 3.9772 8.5795 122.0862 57.7762 32.2337 177.6287 47 G 4.2233 7.2318 104.9017 45.3983 0.0000 169.8517 48 Y 6.0332 7.9065 117.3153 55.3980 40.5009 174.2055 49 E 4.4256 9.0331 125.2871 54.4405 32.0199 175.1174 50 R 4.5515 8.3533 124.7086 56.4910 30.9477 176.0681 51 V 4.5467 8.6039 120.9635 61.7643 35.7562 172.8034 52 D 5.4704 8.8275 126.3593 52.6895 42.7497 175.9307 53 V 4.2139 8.7968 124.3790 60.6530 33.2755 175.5132 54 D 4.4030 9.3687 122.9925 55.2168 39.3048 173.5512 55 G 4.0330 8.5020 101.7472 45.5989 0.0000 173.9296 56 K 4.6915 7.8845 118.9322 53.0868 34.9125 173.8555 57 P 4.9217 0.0000 0.0000 63.6756 32.5341 174.7817 58 Y 4.9215 10.3349 122.0244 57.3857 42.6956 173.5697 59 L 5.0626 8.6159 119.9710 54.7980 46.9291 175.2176 60 R 4.4558 9.4376 124.7228 55.5366 31.4793 175.8569 61 V 4.6831 8.7121 126.0443 61.4773 33.0303 174.2554 62 Y 4.6493 9.2126 127.8927 57.5003 38.8576 175.3284 63 L 4.5336 8.4592 124.6623 54.1554 42.9157 176.2089 64 K 4.8417 8.4873 123.0957 55.3401 34.2517 174.4706 65 Y 4.7657 8.4897 122.1521 56.8093 43.1444 173.8705 66 G 4.3263 8.5508 108.8824 44.4246 0.0000 171.0212 67 P 4.8160 0.0000 0.0000 61.1552 33.3655 175.5432 68 R 4.0131 8.6463 122.2242 57.3355 30.6771 175.1171 69 R 4.8204 8.4108 120.6486 54.5458 33.8912 174.8398 70 Q 4.5096 8.9264 118.7619 54.9203 31.1672 174.6983 71 G 3.9789 8.9143 106.1030 42.5349 0.0000 172.6986 72 P 4.2781 0.0000 0.0000 64.9010 30.8987 175.9710 73 D 4.9042 7.5980 116.5406 51.5855 44.1216 172.6559 74 P 4.8470 0.0000 0.0000 61.4337 30.2413 174.1562 75 R 3.2718 8.6061 126.2306 54.3762 29.1743 173.9459 76 P 4.8294 0.0000 0.0000 61.9663 32.5833 175.5694 77 E 4.4405 8.7437 121.3073 55.9792 31.0774 175.6259 78 Q 4.2382 8.5504 124.2912 56.1844 29.1792 176.4639 79 V 3.6613 8.2934 123.7838 65.9351 32.0377 177.7077 80 I 3.9093 7.0423 123.3344 59.8628 35.5273 175.6763 81 H 3.8078 7.6910 121.1101 57.6410 28.7775 176.1156 82 H 4.2976 5.8583 121.5310 55.3293 32.2654 174.2100 83 I 5.1984 7.2883 126.2461 60.6562 38.9933 172.7267 84 R 4.5627 7.4873 123.9866 55.1766 32.4578 174.3879 85 R 4.2453 8.4689 120.3981 56.2850 30.5650 174.5951 86 I 4.2685 7.3518 120.1313 62.8851 39.6780 176.1759 87 S 4.3325 7.9275 115.9939 58.0880 63.0288 174.0448 88 K 4.4958 8.7308 126.0172 53.4517 35.6407 173.6163 89 P 4.0121 0.0000 0.0000 65.1098 30.9487 175.4421 90 G 3.5251 7.9305 112.7527 43.6452 0.0000 171.1282 91 R 3.9576 7.8214 123.5194 56.8209 29.5496 173.7859 92 R 4.4047 7.5792 119.7983 56.5234 31.6918 175.3661 93 V 4.5591 8.8263 121.0080 61.6598 34.8808 173.2699 94 Y 4.9745 8.9691 125.2834 56.3244 40.3634 175.7807 95 V 4.0479 9.2544 125.4653 62.1197 34.1909 175.2503 96 G 3.7926 8.7226 109.6001 46.0896 0.0000 177.2853 97 V 3.1203 9.0657 125.1171 61.7336 33.9633 176.4364 98 K 3.9223 8.8597 119.2123 59.2523 32.7998 177.9281 99 E 4.0836 8.5678 116.2741 57.9477 29.5574 177.0529 100 I 3.8770 8.6232 122.0372 59.9899 37.0520 174.2565 101 P 4.2943 0.0000 0.0000 63.1942 31.4206 176.9539 102 R 4.2092 8.0854 119.9029 54.0968 29.0769 174.8191 103 V 3.3351 8.2199 121.4246 63.9927 31.6447 175.1274 104 R 3.1873 8.8421 120.9840 59.0769 26.9900 177.3345 105 R 3.4272 7.9257 126.3406 57.3486 28.3959 175.7920 106 G 4.0499 8.1895 110.1103 45.6852 0.0000 173.9592 107 L 4.4983 8.7049 118.4363 54.6563 42.1434 176.7141 108 G 4.8961 7.9572 108.2613 45.2151 0.0000 172.6681 109 I 5.1215 8.8092 112.4483 59.5068 40.7138 175.6392 110 A 4.2679 8.9721 123.5869 51.0058 21.2431 176.6000 111 I 3.4904 7.4429 114.5877 62.5589 34.5906 172.2289 112 L 4.4515 7.9806 122.1490 53.8528 44.8866 177.1041 113 S 4.9709 8.5644 113.8822 57.0328 65.1522 173.0155 114 T 5.1041 9.0868 117.3857 59.3580 71.8545 175.1700 115 S 4.0980 8.7404 115.3056 60.6099 63.3281 175.9976 116 K 4.0657 7.7301 120.6348 57.3417 32.3528 177.2137 117 G 3.8049 6.8161 103.7326 45.9848 0.0000 170.3271 118 V 4.5842 8.0189 119.7832 61.6623 32.7228 176.3033 119 L 4.9422 8.6252 126.7762 54.6470 44.4196 174.9734 120 T 4.2180 9.7750 111.4422 61.4053 70.0001 174.1247 121 D 4.3483 9.1083 120.5503 56.5127 39.9599 178.7183 122 R 3.9890 8.1484 118.4958 58.7165 30.3353 178.2037 123 E 3.7279 8.1667 118.2787 59.4706 29.4829 178.9236 124 A 3.9976 8.4776 120.8606 55.1364 18.3718 179.8336 125 R 3.8659 8.4194 117.0242 60.0223 29.9431 178.5549 126 K 3.7333 8.7388 115.9897 60.7596 32.1299 178.4456 127 L 4.0832 8.3537 123.0187 55.4468 43.1789 177.2921 128 G 3.9492 8.3135 107.1555 44.7262 0.0000 173.3427 129 V 4.4295 7.2253 115.8067 61.4064 35.2642 174.0123 130 G 4.0988 8.3058 114.2099 44.7479 0.0000 173.1400 131 G 4.0317 7.5479 104.2549 45.7091 0.0000 171.7571 132 E 4.8229 8.2104 122.8000 54.8152 30.5284 176.8279 133 L 4.0764 8.4329 130.4194 55.9580 42.5900 177.3730 134 I 3.9694 8.4974 128.8416 62.6468 38.2806 176.4181 135 C 5.5059 6.9435 118.3230 57.9894 32.3012 173.8479 136 E 4.6773 7.7097 121.9440 55.9750 30.8554 175.9688 137 V 4.8213 8.1091 121.5374 61.3328 35.6788 174.3563 138 W 4.8788 8.4500 123.6421 57.5108 28.4426 174.0825 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.37 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.52 0.00 2 L 8.15 4.06 0.00 1.71 1.51 0.89 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 3 T 7.93 3.98 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 4 D 7.79 4.57 0.00 2.76 2.50 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 5 P 0.00 4.08 0.00 2.05 2.00 0.00 3.59 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 6 I 7.48 3.39 2.01 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.66 0.68 0.00 0.00 7 A 9.41 3.80 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 8 D 8.20 4.23 0.00 2.76 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 9 M 8.49 3.63 0.00 2.29 1.83 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.59 0.00 10 L 8.00 3.61 0.00 1.84 1.54 0.84 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.86 3.99 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 1.16 0.00 0.00 12 R 9.03 3.97 0.00 1.90 2.00 0.00 3.13 0.00 0.00 3.32 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.85 0.00 13 I 7.74 3.69 1.85 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 1.31 0.90 0.83 0.00 0.00 14 R 8.34 3.73 0.00 1.58 1.98 0.00 3.19 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 15 N 9.28 4.37 0.00 2.74 2.81 0.00 0.00 6.91 6.93 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 16 A 8.08 4.00 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 17 T 8.02 3.73 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 0.85 0.00 0.00 18 R 7.27 3.61 0.00 1.74 1.93 0.00 3.02 0.00 0.00 3.10 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.54 0.00 19 V 7.78 3.99 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 0.71 0.00 0.00 1.04 0.00 0.00 20 Y 7.64 4.44 0.00 2.98 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 21 K 7.77 4.64 0.00 1.95 1.46 0.00 1.78 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.55 7.81 22 E 8.48 5.55 0.00 1.98 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 2.23 2.12 0.00 23 S 8.01 4.96 0.00 3.32 3.85 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 24 T 8.42 4.64 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 1.19 0.00 0.00 25 D 8.91 5.60 0.00 2.55 2.60 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 26 V 8.27 4.68 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 0.88 0.00 0.00 0.90 0.00 0.00 27 P 0.00 3.43 0.00 1.75 1.59 0.00 3.64 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.09 0.00 28 A 7.90 4.28 1.25 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 29 S 8.43 4.51 0.00 3.98 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 30 R 8.50 3.78 0.00 1.86 2.00 0.00 3.42 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.60 0.00 31 F 7.79 3.53 0.00 3.05 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 32 K 8.87 4.21 0.00 1.86 1.80 0.00 1.80 0.00 0.00 1.51 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.35 7.81 33 E 8.01 3.68 0.00 2.14 2.29 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 2.34 2.43 0.00 34 E 8.75 3.81 0.00 2.07 1.81 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 2.28 2.37 0.00 35 I 7.67 3.71 1.89 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.94 1.01 0.00 0.00 36 L 8.06 3.83 0.00 1.50 1.07 0.89 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 37 R 8.26 3.76 0.00 1.72 2.03 0.00 3.12 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 38 I 7.77 3.69 2.10 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 1.65 0.62 0.97 0.00 0.00 39 L 8.52 4.17 0.00 1.80 1.84 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 40 A 9.24 4.21 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 41 R 6.47 3.67 0.00 1.97 1.95 0.00 3.19 0.00 0.00 3.24 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.89 0.00 42 E 8.61 4.14 0.00 2.12 1.81 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 2.36 2.51 0.00 43 G 10.62 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 0.00 0.00 0.00 44 F 8.46 4.63 0.00 3.27 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 45 I 7.45 4.82 2.18 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.65 0.95 0.00 0.00 46 K 8.58 3.98 0.00 2.04 2.00 0.00 1.98 0.00 0.00 1.77 0.00 0.00 2.94 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.56 1.54 7.81 47 G 7.23 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 0.00 0.00 0.00 48 Y 7.91 6.03 0.00 3.10 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 49 E 9.03 4.43 0.00 2.32 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 2.31 2.28 0.00 50 R 8.35 4.55 0.00 1.74 1.88 0.00 3.28 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.68 0.00 51 V 8.60 4.55 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 0.93 0.00 0.00 1.03 0.00 0.00 52 D 8.83 5.47 0.00 2.59 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 53 V 8.80 4.21 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 0.06 0.00 0.00 0.77 0.00 0.00 54 D 9.37 4.40 0.00 2.77 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 55 G 8.50 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 0.00 0.00 0.00 56 K 7.88 4.69 0.00 2.30 1.97 0.00 1.58 0.00 0.00 2.11 0.00 0.00 3.12 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.44 7.81 57 P 0.00 4.92 0.00 2.11 2.22 0.00 3.66 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 2.00 1.99 0.00 58 Y 10.33 4.92 0.00 3.07 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 59 L 8.62 5.06 0.00 1.73 1.76 1.01 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 60 R 9.44 4.46 0.00 1.65 1.13 0.00 2.94 0.00 0.00 2.99 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 61 V 8.71 4.68 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 1.00 0.00 0.00 1.05 0.00 0.00 62 Y 9.21 4.65 0.00 2.97 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 63 L 8.46 4.53 0.00 1.92 1.44 1.05 0.63 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 64 K 8.49 4.84 0.00 1.91 1.83 0.00 1.78 0.00 0.00 1.97 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.39 1.52 7.81 65 Y 8.49 4.77 0.00 2.97 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.55 4.33 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 0.00 67 P 0.00 4.82 0.00 2.14 2.20 0.00 3.79 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.98 0.00 68 R 8.65 4.01 0.00 1.80 1.88 0.00 3.12 0.00 0.00 3.19 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 69 R 8.41 4.82 0.00 1.70 1.80 0.00 3.26 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.79 0.00 70 Q 8.93 4.51 0.00 2.02 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.61 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 71 G 8.91 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 0.00 0.00 0.00 72 P 0.00 4.28 0.00 2.19 2.23 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 2.01 1.99 0.00 73 D 7.60 4.90 0.00 2.67 2.57 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 74 P 0.00 4.85 0.00 2.14 1.66 0.00 3.93 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 1.89 1.93 0.00 75 R 8.61 3.27 0.00 1.95 1.60 0.00 3.37 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.51 0.00 76 P 0.00 4.83 0.00 2.25 2.34 0.00 3.14 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.91 0.00 77 E 8.74 4.44 0.00 2.13 1.89 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 2.45 2.42 0.00 78 Q 8.55 4.24 0.00 1.84 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.85 0.00 0.00 0.00 0.00 0.00 2.27 2.12 0.00 79 V 8.29 3.66 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 0.98 0.00 0.00 0.98 0.00 0.00 80 I 7.04 3.91 1.60 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 0.90 0.69 0.52 0.00 0.00 81 H 7.69 3.81 0.00 2.51 2.70 0.00 5.89 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 5.86 4.30 0.00 1.43 1.34 0.00 5.89 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.29 5.20 1.55 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.28 0.66 0.00 0.00 84 R 7.49 4.56 0.00 1.78 1.82 0.00 3.14 0.00 0.00 3.27 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 85 R 8.47 4.25 0.00 1.72 1.81 0.00 3.13 0.00 0.00 3.21 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.78 0.00 86 I 7.35 4.27 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 1.19 0.77 0.94 0.00 0.00 87 S 7.93 4.33 0.00 3.82 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 K 8.73 4.50 0.00 1.68 1.61 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.56 7.81 89 P 0.00 4.01 0.00 2.16 2.13 0.00 3.75 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 90 G 7.93 3.53 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 0.00 91 R 7.82 3.96 0.00 1.99 2.24 0.00 3.26 0.00 0.00 3.28 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.49 0.00 92 R 7.58 4.40 0.00 1.96 2.28 0.00 3.35 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.71 0.00 93 V 8.83 4.56 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 0.93 0.00 0.00 1.03 0.00 0.00 94 Y 8.97 4.97 0.00 2.77 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 95 V 9.25 4.05 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 0.98 0.00 0.00 0.95 0.00 0.00 96 G 8.72 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 97 V 9.07 3.12 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 0.79 0.00 0.00 0.94 0.00 0.00 98 K 8.86 3.92 0.00 1.77 1.97 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.47 1.46 7.81 99 E 8.57 4.08 0.00 2.05 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 2.36 2.44 0.00 100 I 8.62 3.88 1.91 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 0.54 0.92 0.00 0.00 101 P 0.00 4.29 0.00 2.17 2.07 0.00 3.76 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 2.00 2.01 0.00 102 R 8.09 4.21 0.00 1.78 1.91 0.00 3.21 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 103 V 8.22 3.34 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 1.18 0.00 0.00 1.03 0.00 0.00 104 R 8.84 3.19 0.00 1.46 1.49 0.00 2.78 0.00 0.00 2.68 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 105 R 7.93 3.43 0.00 1.73 2.19 0.00 3.21 0.00 0.00 3.18 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.65 0.00 106 G 8.19 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 0.00 0.00 0.00 107 L 8.70 4.50 0.00 1.53 1.76 0.94 0.80 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 0.00 108 G 7.96 4.90 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 0.00 0.00 0.00 109 I 8.81 5.12 1.99 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 1.09 0.00 0.00 110 A 8.97 4.27 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 0.00 111 I 7.44 3.49 1.91 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 1.48 0.77 0.96 0.00 0.00 112 L 7.98 4.45 0.00 1.66 1.60 1.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.56 4.97 0.00 3.82 3.65 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 0.00 0.00 0.00 0.00 114 T 9.09 5.10 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 1.24 0.00 0.00 115 S 8.74 4.10 0.00 4.00 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 0.00 116 K 7.73 4.07 0.00 1.87 1.88 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.52 7.81 117 G 6.82 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 0.00 118 V 8.02 4.58 2.00 0.00 0.00 0.00 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 0.64 0.00 0.00 119 L 8.63 4.94 0.00 1.89 1.72 0.94 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 120 T 9.78 4.22 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 1.33 0.00 0.00 121 D 9.11 4.35 0.00 2.85 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 R 8.15 3.99 0.00 1.87 2.06 0.00 3.15 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.73 0.00 123 E 8.17 3.73 0.00 2.06 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 124 A 8.48 4.00 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 0.00 125 R 8.42 3.87 0.00 1.97 1.99 0.00 3.17 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 126 K 8.74 3.73 0.00 1.89 1.81 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.64 7.81 127 L 8.35 4.08 0.00 1.79 1.74 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.31 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 0.00 129 V 7.23 4.43 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 0.81 0.00 0.00 0.96 0.00 0.00 130 G 8.31 4.10 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 0.00 0.00 0.00 131 G 7.55 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 0.00 0.00 0.00 132 E 8.21 4.82 0.00 1.65 1.70 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 2.08 1.66 0.00 133 L 8.43 4.08 0.00 1.75 1.55 0.93 0.94 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 0.00 134 I 8.50 3.97 2.32 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.51 0.92 0.00 0.00 135 C 6.94 5.51 0.00 3.21 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 E 7.71 4.68 0.00 2.24 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 2.38 2.15 0.00 137 V 8.11 4.82 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 -0.20 0.00 0.00 0.81 0.00 0.00 138 W 8.45 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