NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4112 8.2893 120.3486 55.3740 33.1305 174.6826 2 N 4.6728 8.5925 124.0100 51.3753 38.9670 172.9796 3 I 4.5977 8.8059 121.2225 59.5715 41.8900 176.2578 4 I 4.3769 8.3293 123.8898 59.6108 38.5523 175.1427 5 K 4.4598 8.6242 124.8268 54.3990 34.0602 176.0888 6 A 4.6182 8.3854 126.1909 50.6658 21.0252 174.9983 7 N 5.0518 8.1786 116.8077 51.9340 41.7963 175.6936 8 V 3.8902 8.1131 114.2157 62.6179 32.3380 176.3051 9 A 4.2046 8.1134 123.7196 52.0666 18.6164 177.9986 10 A 4.6094 8.3001 123.1516 51.2330 21.5004 174.0178 11 P 4.6735 0.0000 0.0000 64.9697 32.1563 178.7831 12 D 4.6877 8.0724 115.6741 54.2736 40.5388 175.7708 13 A 4.6195 7.6433 124.4788 51.7888 20.2988 178.3139 14 R 4.8332 9.4730 120.7279 55.1543 32.6016 175.8966 15 V 4.9424 8.9103 124.5207 59.9997 34.7988 173.9902 16 A 4.8868 8.4484 128.2674 50.0551 21.6501 175.1482 17 I 4.7536 8.7787 123.5045 59.5532 39.6145 174.6796 18 T 4.7511 8.6234 117.7930 59.9719 70.8276 173.3744 19 I 5.2213 8.2601 126.5624 58.2130 40.5433 174.5323 20 A 5.5817 8.6919 127.7954 50.7583 19.0974 177.9220 21 R 4.4471 9.0980 119.0594 58.4827 30.3832 176.8218 22 F 4.5699 8.2036 121.1649 60.0304 39.6720 174.3409 23 N 4.6787 9.8276 123.9785 54.5079 35.5341 176.1586 24 Q 4.1808 8.3332 120.4295 59.4544 28.0895 177.8766 25 F 3.8960 8.5095 121.4993 61.0708 39.4128 176.4084 26 I 4.2053 8.1952 118.6257 63.7360 37.2006 177.7182 27 N 4.3565 8.2968 116.6354 56.3544 38.2602 176.9462 28 D 4.4955 8.7789 120.8332 57.6194 40.9993 178.8132 29 S 4.0637 7.9569 113.0020 61.0264 62.4382 175.4395 30 L 4.0616 7.7788 123.2387 58.4890 41.6581 178.4867 31 L 3.8322 8.3383 120.3901 57.9054 42.0327 178.4763 32 D 4.5067 8.4060 118.7328 57.4297 40.8484 179.6956 33 G 3.5936 8.1994 105.6462 47.7909 0.0000 175.3701 34 A 3.9323 7.7915 123.3379 54.6451 18.5251 179.3118 35 V 3.4472 7.9338 116.8879 66.3297 31.5170 177.3547 36 D 4.3067 8.0741 117.1245 57.6495 40.9366 177.7646 37 A 3.9435 8.2262 121.0843 55.6947 18.3150 179.0537 38 L 3.8922 8.4325 116.8562 59.1149 41.9186 179.8342 39 T 4.1908 8.1578 110.8670 64.1457 68.6108 176.3312 40 R 3.8699 8.2982 123.3415 58.1114 30.3445 178.3154 41 I 4.2472 7.8373 118.3351 63.4775 38.1689 177.7701 42 G 3.8286 7.8205 103.6559 44.1697 0.0000 173.7973 43 Q 3.6914 7.9762 120.6768 56.5457 28.1355 172.7631 44 V 3.8223 7.5498 116.9144 61.8598 32.2212 175.2122 45 K 4.2627 8.5836 128.9508 56.2611 32.5224 176.6876 46 D 4.6966 8.8211 124.1063 54.0733 39.0370 176.1789 47 D 4.8118 7.9872 117.0880 53.7468 40.1595 176.2656 48 N 4.7242 8.5954 117.6799 53.6204 39.3142 174.0546 49 I 4.9190 7.5758 120.2703 60.1930 38.4987 175.1893 50 T 4.7222 8.8677 117.2260 59.7110 72.0026 172.9928 51 V 4.5812 8.4032 123.4315 61.0783 34.1638 174.5626 52 V 4.3137 8.9411 128.6031 60.8026 33.7523 174.4621 53 W 4.8642 8.9914 129.0808 56.5164 29.6042 176.5167 54 V 4.3512 8.6595 119.0770 59.0788 33.6252 174.6597 55 P 4.3255 0.0000 0.0000 65.1077 31.3444 176.9406 56 G 4.4890 7.9694 108.4109 42.8540 0.0000 174.1571 57 A 4.0734 8.5015 120.8905 54.9670 18.0860 179.2754 58 Y 4.2311 8.1934 116.9717 60.6617 39.0795 177.4813 59 E 4.1450 8.2629 118.6051 57.9813 29.6616 178.4960 60 L 3.8784 7.6501 119.8417 58.0423 41.5998 177.1456 61 P 4.1782 0.0000 0.0000 64.9234 31.2001 177.9263 62 L 3.8721 7.7594 117.9372 58.4724 42.1476 179.2530 63 A 3.9764 7.7567 119.9604 55.6028 18.3147 179.8356 64 T 3.8346 8.1604 108.4182 64.4869 68.7226 176.1871 65 E 3.8463 8.9680 122.8336 59.2141 29.6052 178.3421 66 A 4.0130 7.9455 120.5429 55.5864 18.1838 179.6449 67 L 4.0795 7.5637 114.9138 57.8577 41.9272 179.4583 68 A 4.2166 8.3535 120.9508 55.1735 18.2011 179.8147 69 K 3.9286 8.2240 116.2333 59.6205 32.1338 178.9001 70 S 4.2076 8.0744 112.9870 59.6633 62.1809 175.8635 71 G 3.9704 8.4497 110.8034 46.2151 0.0000 176.0168 72 K 3.8863 7.6307 120.0084 56.3160 31.8585 182.1845 73 Y 5.1039 6.9497 113.8789 56.8270 40.6688 175.4854 74 D 4.7166 9.2286 121.9987 56.1418 41.8182 176.4666 75 A 4.5470 7.3683 117.3276 51.2244 22.5024 175.0929 76 V 4.7284 8.2798 119.9988 61.0292 34.6515 174.4957 77 V 4.3481 8.6522 128.1021 61.5071 33.4019 174.2147 78 A 4.8976 8.5342 130.4406 49.8326 20.6127 175.2917 79 L 5.3320 7.9696 123.0283 52.6683 44.4563 176.4416 80 G 4.1722 7.6414 108.5347 46.0713 0.0000 171.8172 81 T 5.0755 8.5101 115.8605 61.5354 72.1841 174.4239 82 V 4.2135 8.9468 124.8287 61.3804 34.2059 173.8681 83 I 4.7036 8.2031 128.7695 59.5897 38.6076 176.0238 84 R 3.6466 8.4658 127.8587 56.6199 30.3012 176.3439 85 G 4.4363 8.3325 115.9397 44.2606 0.0000 172.9064 86 G 3.6398 8.7871 107.6320 47.4869 0.0000 173.3111 87 T 4.5309 7.5955 108.2905 59.6851 71.6181 173.4948 88 A 4.4582 8.3660 121.3137 52.7276 18.8489 178.6117 89 H 4.2724 8.3490 119.7989 60.2456 29.6361 176.8737 90 F 4.0189 8.4747 121.9170 61.5241 39.0001 176.5701 91 E 3.6026 7.9437 118.2147 59.5938 29.3112 178.4389 92 Y 4.3275 7.3934 115.8885 60.9365 38.1411 177.3734 93 V 3.6808 7.7126 119.3121 65.8069 31.5298 177.7530 94 A 4.0849 7.8714 120.4821 55.1629 18.1250 179.7075 95 G 3.6203 8.1373 104.7253 47.8009 0.0000 176.0844 96 G 3.8520 8.6988 108.3475 45.8079 0.0000 174.8463 97 A 4.2527 7.8136 123.0074 54.3783 19.6169 179.1548 98 S 4.1646 8.2894 111.8955 61.8759 62.3891 176.2631 99 N 4.4445 8.5120 119.3797 55.9301 38.3443 177.3866 100 G 3.7500 7.7015 106.3119 48.0740 0.0000 175.4359 101 L 3.9928 8.0119 121.6463 57.2730 41.8670 179.6020 102 A 3.9818 8.0127 120.5364 55.0867 18.2513 179.5846 103 S 3.9615 8.2799 111.6814 61.5382 62.4931 176.1620 104 V 3.5469 7.7616 120.7327 66.2788 31.0898 177.7498 105 A 4.3519 7.8442 121.2248 54.8083 18.0047 179.4279 106 Q 3.8904 7.6592 116.3862 59.2123 29.1554 177.8461 107 D 4.5163 8.0749 119.4426 57.0925 41.2272 178.4751 108 S 4.3630 8.2496 112.6461 58.6190 63.4858 175.5008 109 G 3.8847 8.0998 109.6254 45.7482 0.0000 173.7617 110 V 4.0029 7.4575 120.8223 61.6203 33.0946 173.5438 111 P 4.5740 0.0000 0.0000 62.5161 32.5804 175.1782 112 V 4.8387 8.3833 123.5138 61.0307 33.9999 174.2535 113 A 4.4329 8.8669 130.4070 51.0421 20.3834 176.2247 114 F 4.8270 9.0120 126.5918 56.1947 38.4755 175.8841 115 G 3.9578 8.0641 117.8076 44.8584 0.0000 170.9382 116 V 4.5393 6.1565 117.3956 60.6163 33.8876 176.0818 117 L 4.2681 8.7274 129.4235 55.1406 42.8013 176.6968 118 T 5.2193 8.7074 112.4271 58.8767 68.9422 172.5704 119 T 4.6077 8.1729 121.0054 61.0542 72.0821 174.9601 120 E 4.1580 9.8356 120.5849 57.1804 30.6865 177.2132 121 S 4.7064 7.5951 112.0678 55.5514 67.6096 174.7684 122 I 3.6839 8.2551 123.3213 64.3453 36.6139 177.9195 123 E 3.9206 8.2216 118.9151 59.8018 29.6067 178.7157 124 Q 4.2782 8.0797 117.3363 58.7895 28.7777 178.4765 125 A 3.9904 7.8295 121.4056 55.4632 18.3305 179.6482 126 I 3.7482 7.8736 118.1248 64.7828 37.1224 178.5218 127 E 4.5707 8.1729 120.5378 58.0106 29.3117 178.3889 128 R 4.5440 8.0152 115.8514 55.6681 30.5506 176.6698 129 A 4.7359 7.2339 121.9165 52.7113 19.4589 177.0559 130 G 4.4492 7.8824 108.1407 48.1252 0.0000 175.5172 131 T 4.6302 7.5364 115.0478 60.1517 68.7420 175.7051 132 K 3.7840 9.2289 117.0876 59.3259 31.7481 177.7623 133 A 4.5661 7.7867 119.3258 52.0233 19.9799 178.8511 134 G 3.7628 8.0411 110.8318 47.2007 0.0000 173.6654 135 N 5.2765 8.2246 117.2071 50.9037 40.7215 175.5774 136 K 3.9905 8.8933 128.6976 59.0903 32.1040 178.9977 137 G 4.0608 8.2894 107.7317 47.3291 0.0000 175.6023 138 A 4.0418 7.8822 123.3729 54.3214 18.4539 179.2452 139 E 3.8409 8.4664 117.8950 59.3889 29.7604 178.9059 140 A 4.0641 8.5581 122.4121 54.4471 18.3927 179.4204 141 A 3.9138 8.1678 119.4319 55.2941 18.3776 179.9353 142 L 3.9257 8.0925 117.7448 58.1899 41.3169 179.8818 143 T 3.8394 8.1162 109.3986 64.4909 68.4545 176.3421 144 A 3.9801 7.9403 123.7906 55.0567 18.4585 179.2571 145 L 3.8629 7.8250 117.2218 58.1181 41.7519 179.2145 146 E 4.1807 8.3214 120.5266 59.0654 29.4081 178.8798 147 M 4.0468 8.0056 118.2175 58.3880 31.9382 178.4695 148 I 3.6922 7.6284 119.9255 64.8000 37.2804 178.1980 149 N 4.3167 7.9720 116.4576 56.2885 38.1621 177.5806 150 V 3.5754 7.8626 118.9687 66.0814 31.7268 177.8968 151 L 4.0792 8.4392 119.0033 57.7093 41.3938 179.1716 152 K 3.8500 8.0849 118.6127 59.4958 32.0981 176.8045 153 A 4.5074 8.0563 120.1388 51.7209 19.5394 177.2243 154 I 3.9237 7.9560 121.1420 63.1284 37.6796 174.0689 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 4.41 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 2 N 8.59 4.67 0.00 2.95 2.79 0.00 0.00 6.06 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 3 I 8.81 4.60 1.87 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 1.41 0.67 0.91 0.00 0.00 4 I 8.33 4.38 1.87 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 1.41 0.60 0.91 0.00 0.00 5 K 8.62 4.46 0.00 1.71 1.70 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.39 7.81 6 A 8.39 4.62 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 7 N 8.18 5.05 0.00 2.73 2.64 0.00 0.00 6.87 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 V 8.11 3.89 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 0.86 0.00 0.00 0.93 0.00 0.00 9 A 8.11 4.20 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 10 A 8.30 4.61 1.26 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 11 P 0.00 4.67 0.00 2.23 2.38 0.00 3.86 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 2.07 1.94 0.00 12 D 8.07 4.69 0.00 2.69 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 13 A 7.64 4.62 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 14 R 9.47 4.83 0.00 1.42 1.79 0.00 3.21 0.00 0.00 3.09 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.40 0.00 15 V 8.91 4.94 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 0.96 0.00 0.00 0.95 0.00 0.00 16 A 8.45 4.89 0.34 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 17 I 8.78 4.75 1.68 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.84 0.73 0.00 0.00 18 T 8.62 4.75 4.14 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 1.09 0.00 0.00 19 I 8.26 5.22 0.79 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 -0.03 0.33 0.00 0.00 20 A 8.69 5.58 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 R 9.10 4.45 0.00 2.08 2.51 0.00 3.06 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.69 0.00 22 F 8.20 4.57 0.00 3.14 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 23 N 9.83 4.68 0.00 2.97 3.00 0.00 0.00 6.88 7.97 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 24 Q 8.33 4.18 0.00 2.53 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.70 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 25 F 8.51 3.90 0.00 3.13 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 26 I 8.20 4.21 2.12 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.88 0.95 0.00 0.00 27 N 8.30 4.36 0.00 2.87 2.92 0.00 0.00 7.07 8.08 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 28 D 8.78 4.50 0.00 2.66 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 29 S 7.96 4.06 0.00 3.81 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 30 L 7.78 4.06 0.00 1.92 1.63 0.95 0.53 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 31 L 8.34 3.83 0.00 1.77 1.79 0.77 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.41 4.51 0.00 2.87 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 33 G 8.20 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.79 3.93 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 35 V 7.93 3.45 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 0.97 0.00 0.00 0.91 0.00 0.00 36 D 8.07 4.31 0.00 2.86 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 37 A 8.23 3.94 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 38 L 8.43 3.89 0.00 1.85 1.74 0.89 0.61 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 39 T 8.16 4.19 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 1.23 0.00 0.00 40 R 8.30 3.87 0.00 1.83 2.24 0.00 3.24 0.00 0.00 3.59 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 41 I 7.84 4.25 2.06 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 1.45 0.97 0.91 0.00 0.00 42 G 7.82 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 Q 7.98 3.69 0.00 2.35 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.95 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 44 V 7.55 3.82 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 0.88 0.00 0.00 1.05 0.00 0.00 45 K 8.58 4.26 0.00 1.80 1.68 0.00 1.93 0.00 0.00 1.87 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.37 7.81 46 D 8.82 4.70 0.00 2.83 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 47 D 7.99 4.81 0.00 2.78 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 48 N 8.60 4.72 0.00 2.87 2.99 0.00 0.00 6.91 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 49 I 7.58 4.92 1.88 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 1.40 0.53 0.89 0.00 0.00 50 T 8.87 4.72 4.31 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 1.51 0.00 0.00 51 V 8.40 4.58 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 0.48 0.00 0.00 0.84 0.00 0.00 52 V 8.94 4.31 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 0.94 0.00 0.00 0.86 0.00 0.00 53 W 8.99 4.86 0.00 3.20 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 54 V 8.66 4.35 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 0.82 0.00 0.00 0.96 0.00 0.00 55 P 0.00 4.33 0.00 2.19 2.30 0.00 3.75 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.05 0.00 56 G 7.97 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 A 8.50 4.07 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 58 Y 8.19 4.23 0.00 2.91 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 59 E 8.26 4.14 0.00 2.03 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 0.00 2.63 2.58 0.00 60 L 7.65 3.88 0.00 1.77 1.70 0.85 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 61 P 0.00 4.18 0.00 2.03 1.87 0.00 3.66 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.10 0.00 62 L 7.76 3.87 0.00 1.63 1.67 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 63 A 7.76 3.98 1.30 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 0.00 0.00 64 T 8.16 3.83 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 1.24 0.00 0.00 65 E 8.97 3.85 0.00 2.00 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 2.34 0.00 66 A 7.95 4.01 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 67 L 7.56 4.08 0.00 1.75 1.65 0.66 1.00 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 68 A 8.35 4.22 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 69 K 8.22 3.93 0.00 1.86 1.91 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.64 1.60 7.81 70 S 8.07 4.21 0.00 3.92 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 0.00 71 G 8.45 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 72 K 7.63 3.89 0.00 1.83 1.75 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.39 1.28 7.81 73 Y 6.95 5.10 0.00 3.05 2.97 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 74 D 9.23 4.72 0.00 2.55 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 75 A 7.37 4.55 1.20 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 0.00 0.00 0.00 76 V 8.28 4.73 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 0.92 0.00 0.00 0.84 0.00 0.00 77 V 8.65 4.35 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 0.88 0.00 0.00 0.88 0.00 0.00 78 A 8.53 4.90 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 79 L 7.97 5.33 0.00 1.39 1.40 0.84 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 80 G 7.64 4.17 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 0.00 81 T 8.51 5.08 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 1.19 0.00 0.00 82 V 8.95 4.21 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 0.88 0.00 0.00 0.86 0.00 0.00 83 I 8.20 4.70 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 1.24 0.69 0.88 0.00 0.00 84 R 8.47 3.65 0.00 0.67 1.38 0.00 3.06 0.00 0.00 2.98 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.18 0.00 85 G 8.33 4.44 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 0.00 0.00 0.00 86 G 8.79 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 T 7.60 4.53 4.31 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 1.24 0.00 0.00 88 A 8.37 4.46 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 89 H 8.35 4.27 0.00 3.30 3.41 0.00 5.62 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 90 F 8.47 4.02 0.00 3.11 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 91 E 7.94 3.60 0.00 1.95 1.12 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 2.02 2.19 0.00 92 Y 7.39 4.33 0.00 2.98 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 V 7.71 3.68 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 1.04 0.00 0.00 0.72 0.00 0.00 94 A 7.87 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 G 8.14 3.62 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 0.00 0.00 0.00 96 G 8.70 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 0.00 0.00 0.00 97 A 7.81 4.25 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.29 4.16 0.00 3.75 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 N 8.51 4.44 0.00 2.80 2.83 0.00 0.00 6.95 8.35 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 0.00 100 G 7.70 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 0.00 101 L 8.01 3.99 0.00 2.04 1.82 1.03 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 102 A 8.01 3.98 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 0.00 103 S 8.28 3.96 0.00 3.96 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 0.00 104 V 7.76 3.55 2.23 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 1.02 0.00 0.00 0.91 0.00 0.00 105 A 7.84 4.35 1.45 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 0.00 0.00 106 Q 7.66 3.89 0.00 2.08 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.92 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 107 D 8.07 4.52 0.00 2.69 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 0.00 108 S 8.25 4.36 0.00 4.03 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 0.00 109 G 8.10 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 0.00 110 V 7.46 4.00 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 0.96 0.00 0.00 1.00 0.00 0.00 111 P 0.00 4.57 0.00 2.12 1.96 0.00 3.78 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 2.12 2.08 0.00 112 V 8.38 4.84 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 0.81 0.00 0.00 0.98 0.00 0.00 113 A 8.87 4.43 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 0.00 114 F 9.01 4.83 0.00 2.99 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 0.00 115 G 8.06 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 0.00 116 V 6.16 4.54 1.20 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 0.70 0.00 0.00 0.07 0.00 0.00 117 L 8.73 4.27 0.00 1.62 1.58 0.92 0.69 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 0.00 118 T 8.71 5.22 4.45 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 1.24 0.00 0.00 119 T 8.17 4.61 4.41 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 1.23 0.00 0.00 120 E 9.84 4.16 0.00 1.95 1.92 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 2.30 2.30 0.00 121 S 7.60 4.71 0.00 3.95 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 0.00 122 I 8.26 3.68 1.84 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 1.48 0.70 0.87 0.00 0.00 123 E 8.22 3.92 0.00 1.93 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 0.00 2.30 2.50 0.00 124 Q 8.08 4.28 0.00 2.31 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 125 A 7.83 3.99 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 0.00 126 I 7.87 3.75 2.01 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.18 0.99 0.00 0.00 127 E 8.17 4.57 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 2.34 2.39 0.00 128 R 8.02 4.54 0.00 1.86 1.94 0.00 3.12 0.00 0.00 3.19 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 129 A 7.23 4.74 1.28 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 0.00 0.00 0.00 130 G 7.88 4.45 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 0.00 0.00 0.00 131 T 7.54 4.63 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 132 K 9.23 3.78 0.00 1.77 1.96 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.49 7.81 133 A 7.79 4.57 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 0.00 134 G 8.04 3.76 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 0.00 0.00 0.00 135 N 8.22 5.28 0.00 2.70 2.66 0.00 0.00 6.93 7.09 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 0.00 136 K 8.89 3.99 0.00 1.83 1.83 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.47 7.81 137 G 8.29 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 0.00 0.00 0.00 138 A 7.88 4.04 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 0.00 139 E 8.47 3.84 0.00 2.04 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 2.31 2.33 0.00 140 A 8.56 4.06 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 A 8.17 3.91 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 0.00 142 L 8.09 3.93 0.00 1.98 1.72 0.91 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 143 T 8.12 3.84 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 144 A 7.94 3.98 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 0.00 145 L 7.82 3.86 0.00 1.85 1.88 0.96 0.89 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 0.00 146 E 8.32 4.18 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.24 0.00 147 M 8.01 4.05 0.00 2.10 2.35 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 2.63 2.91 0.00 148 I 7.63 3.69 2.05 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 1.68 0.84 0.92 0.00 0.00 149 N 7.97 4.32 0.00 2.94 2.86 0.00 0.00 6.73 8.72 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 0.00 150 V 7.86 3.58 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 0.83 0.00 0.00 0.98 0.00 0.00 151 L 8.44 4.08 0.00 1.92 1.69 0.92 0.66 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 0.00 152 K 8.08 3.85 0.00 1.83 2.10 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.51 7.81 153 A 8.06 4.51 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 I 7.96 3.92 1.87 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 1.16 0.72 0.91 0.00 0.00