NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3415 8.3049 118.1942 55.0160 31.8617 176.1643 2 L 3.9811 8.4659 121.2428 52.6795 41.2856 175.2601 3 T 3.8813 8.7632 114.7922 64.1142 69.8064 175.0233 4 D 4.7047 7.6235 128.3016 49.8051 42.4657 173.6711 5 P 4.2025 0.0000 0.0000 65.6746 31.4740 177.7650 6 I 3.5456 7.9531 117.4284 64.5137 36.8844 178.1496 7 A 3.8567 8.1583 121.1016 55.3286 18.3186 178.8489 8 D 4.0807 8.2314 116.8591 58.2199 41.0538 178.3912 9 M 3.9714 8.5909 118.7513 58.2024 32.3666 177.8758 10 L 3.8058 8.1138 119.1093 58.3927 41.8186 180.1124 11 T 3.7406 8.6954 115.9748 66.8299 68.6538 176.9917 12 R 3.5678 7.9869 119.7545 59.0068 29.8938 179.0322 13 I 3.7760 7.4568 119.5241 64.0144 37.3357 177.9987 14 R 3.7208 8.0399 118.2140 59.4086 30.0401 177.9805 15 N 4.4130 8.9229 116.8391 55.9206 38.8243 176.9326 16 A 3.9942 7.8054 121.8222 55.6682 18.4768 179.5999 17 T 4.0030 7.9717 109.5172 64.6297 68.3527 176.7800 18 R 3.7544 7.6722 119.5306 58.2025 30.0234 178.3096 19 V 4.2560 7.4606 109.6262 60.2768 31.9980 175.0885 20 Y 3.3329 7.2926 114.2246 58.2600 36.0043 171.1969 21 K 3.9889 7.7675 117.7398 57.0463 33.2334 176.7937 22 E 4.4212 8.9013 120.8880 58.2935 30.3753 175.1013 23 S 5.6141 7.3906 111.4300 58.3673 66.2631 172.3033 24 T 4.1715 7.1051 111.4892 62.5203 71.3661 172.7688 25 D 5.2839 8.8076 128.5989 53.4733 42.8563 176.3003 26 V 4.6652 8.1803 114.0661 58.9005 36.4777 172.9550 27 P 3.7759 0.0000 0.0000 62.7162 31.5312 176.1582 28 A 4.3010 8.3710 127.3319 52.1403 19.3417 177.0625 29 S 4.5179 8.5187 113.0453 56.0303 65.9176 175.3213 30 R 3.8623 8.8810 123.9274 59.8089 29.7718 178.3867 31 F 4.4690 8.3910 119.3095 61.6834 39.2272 177.0958 32 K 3.6094 8.3538 117.9360 59.5839 31.8159 178.7423 33 E 3.5947 7.9635 118.4987 59.6180 29.2961 179.1040 34 E 4.0695 8.4016 118.6278 59.8376 29.6117 179.7847 35 I 3.5606 7.6809 119.1116 64.3133 37.1745 178.1486 36 L 3.7935 8.0787 120.1778 58.1633 41.4479 179.4473 37 R 4.0498 8.6368 118.7626 59.9390 29.8156 178.4558 38 I 3.7595 7.3222 118.6645 64.3012 37.2103 178.0224 39 L 4.1555 7.9841 119.7377 58.3552 41.2374 179.2603 40 A 4.0140 8.6064 120.7192 54.8829 18.1162 179.2055 41 R 4.1363 8.0484 116.4227 59.7948 30.3332 178.0406 42 E 4.1439 8.6598 114.4320 55.7230 29.7568 176.6749 43 G 3.8005 8.8056 107.9837 46.6891 0.0000 175.0500 44 F 4.7591 8.5824 119.3393 57.6695 40.0072 176.7373 45 I 4.7328 7.3928 112.2858 58.3368 40.2706 175.3849 46 K 3.9446 8.7865 122.4646 58.2841 32.5650 177.9305 47 G 3.8959 7.3912 104.3742 46.7521 0.0000 170.4518 48 Y 5.3820 7.3101 115.8070 56.4650 40.3454 173.2988 49 E 4.5443 8.8445 117.9212 54.4817 33.7991 174.5824 50 R 4.6820 8.5782 120.0147 56.2265 31.1033 176.2254 51 V 4.5180 8.6239 122.3377 61.5383 35.8018 173.8266 52 D 5.2986 8.8268 126.3380 52.9987 41.6413 175.9027 53 V 3.8622 8.5784 124.8414 62.0551 31.6697 175.4573 54 D 4.5028 9.5674 126.1130 55.1426 39.3160 174.4631 55 G 4.0614 8.6658 106.9203 44.3503 0.0000 174.1603 56 K 4.6301 7.6828 119.1056 53.6663 34.1369 173.7121 57 P 4.8950 0.0000 0.0000 63.5761 32.4480 174.7924 58 Y 5.1150 9.3024 123.1041 56.7108 42.1138 174.4832 59 L 4.9635 8.6820 120.4309 54.0486 45.1878 175.9582 60 R 4.2406 8.7843 123.2945 56.5339 31.7473 176.3825 61 V 4.4675 8.0523 121.2219 61.3901 34.8648 174.0729 62 Y 4.5856 8.9874 127.4867 57.2961 38.5184 175.5999 63 L 4.5355 8.6085 125.0798 54.2459 42.8182 176.5557 64 K 4.6890 8.0441 121.4517 55.0096 35.1707 174.3348 65 Y 4.8868 8.4111 122.0020 56.2438 43.0863 175.1899 66 G 4.1442 9.3917 110.1016 44.9448 0.0000 171.3398 67 P 4.8086 0.0000 0.0000 61.1293 34.0677 175.1107 68 R 4.0419 8.4284 121.0101 56.8618 30.1942 176.3900 69 R 4.5392 8.9491 125.8405 55.4502 32.7178 174.8747 70 Q 4.4382 8.6450 118.1864 55.2480 31.9086 177.4306 71 G 3.8115 8.5966 106.6743 44.0856 0.0000 170.9228 72 P 4.2162 0.0000 0.0000 63.6221 31.9934 173.5238 73 D 4.2755 8.6317 124.9711 53.8817 38.3255 171.3115 74 P 4.5874 0.0000 0.0000 62.3665 32.3147 176.9451 75 R 3.7367 7.5291 117.9511 56.3313 30.3117 174.8163 76 P 4.7019 0.0000 0.0000 62.3018 32.4357 174.9733 77 E 4.6565 8.7034 120.9539 55.1804 31.7022 174.9409 78 Q 4.5624 8.4080 123.8846 55.2221 29.7771 176.7332 79 V 3.8199 8.3190 122.1759 65.4230 32.2908 176.8117 80 I 4.0624 7.1678 121.8173 59.4799 35.6370 174.4790 81 H 3.9703 8.3171 120.9852 58.5523 29.1114 174.9417 82 H 4.2970 7.9263 115.2369 53.7758 31.9877 171.8628 83 I 4.0736 6.0418 130.1083 60.7777 39.2126 171.9859 84 R 4.5655 7.5053 127.7872 54.1156 33.1931 174.1906 85 R 4.0422 8.5540 126.0777 56.4284 30.5507 174.2295 86 I 4.2063 8.4505 125.3161 62.6902 38.7829 175.4026 87 S 4.0978 7.9166 120.4182 58.9201 63.4387 173.3802 88 K 4.8275 8.2281 126.3117 53.1861 35.0397 174.5638 89 P 4.2203 0.0000 0.0000 64.0295 31.8103 175.9479 90 G 3.8925 9.0595 105.9018 45.8518 0.0000 172.5466 91 R 3.7911 7.2961 119.5345 55.8573 30.2382 173.0979 92 R 4.4652 7.0618 120.0090 55.2289 31.6428 176.9429 93 V 4.0668 7.2600 117.9797 61.8447 34.2573 173.1276 94 Y 5.3563 8.3934 125.4007 56.4087 40.5633 175.7846 95 V 4.5889 8.8127 115.3908 59.5566 36.2302 175.5610 96 G 4.2246 8.5426 111.7681 44.2056 0.0000 175.3475 97 V 3.6690 8.4009 120.2353 64.4882 31.3878 178.7531 98 K 3.9940 8.1327 118.6512 58.7123 31.9910 177.2579 99 E 4.5192 8.4845 116.6136 55.9173 29.5435 175.6483 100 I 4.0360 7.5133 121.3399 59.6354 37.2032 174.3116 101 P 4.2031 0.0000 0.0000 63.3618 31.2632 176.8675 102 R 4.1867 8.1907 122.7766 54.2175 28.8429 173.9115 103 V 3.4103 8.0297 121.7789 63.6281 32.5629 176.2680 104 R 3.6336 8.7858 128.0399 59.5443 27.2209 176.4309 105 R 3.7733 8.7738 107.1962 57.3306 28.3541 177.9808 106 G 4.1048 7.9577 107.5002 45.6842 0.0000 175.9026 107 L 4.1695 8.3958 119.1197 56.3134 42.1121 176.7005 108 G 4.4751 7.7227 107.1459 44.1898 0.0000 171.0201 109 I 4.9557 8.4500 111.8874 60.1931 41.9778 173.5320 110 A 4.8726 8.8112 122.1039 50.8628 22.9497 175.3013 111 I 4.7866 8.2332 121.9892 59.8416 39.4562 175.3447 112 L 5.1438 9.1733 126.9160 53.0477 45.4093 175.2010 113 S 5.1667 8.9310 114.7869 56.9163 65.1004 172.9384 114 T 5.1657 9.0173 116.9198 59.4011 72.0722 175.1521 115 S 4.1433 8.9346 115.8069 60.5205 62.9705 174.9503 116 K 4.4054 7.8552 120.1157 55.9818 32.4829 176.9613 117 G 3.8435 8.3344 107.2680 44.4883 0.0000 172.6939 118 V 4.6982 8.0275 118.7629 62.0028 32.2297 175.2468 119 L 5.0263 8.6219 126.9805 54.4829 44.7436 175.3839 120 T 4.6470 8.5568 110.2318 60.8775 70.5609 174.7092 121 D 4.3754 8.8833 121.2814 56.6687 38.9303 178.6848 122 R 4.0009 7.9833 119.1966 58.7424 30.1882 178.2684 123 E 3.9941 8.2694 117.4848 59.6883 29.5567 179.3159 124 A 3.9943 8.7076 120.5796 55.6357 17.9273 179.0836 125 R 3.7937 8.9250 117.9204 59.3518 29.8669 178.1976 126 K 4.1069 8.7895 120.4256 59.7469 32.3542 177.8263 127 L 4.2749 8.0920 117.9640 54.8312 42.1830 176.7234 128 G 3.9207 9.3014 106.1532 47.2389 0.0000 173.6826 129 V 4.5406 7.9486 111.1317 59.2057 35.6490 174.5265 130 G 4.2927 8.8646 109.0816 44.2557 0.0000 171.2355 131 G 4.2099 7.5696 102.9078 45.4511 0.0000 170.7954 132 E 4.4770 8.2847 120.8393 55.8398 30.7191 178.2873 133 L 4.3302 9.5491 131.6993 62.9198 41.6853 180.0825 134 I 2.8092 6.9208 111.7236 57.9641 40.3495 176.6510 135 C 5.2450 5.7800 128.9157 58.4688 34.1460 174.3436 136 E 5.0553 8.2201 111.3940 56.3803 31.7111 173.9878 137 V 4.1081 7.9697 123.9326 60.6949 33.4457 175.7253 138 W 4.7759 8.0395 123.3999 56.7341 28.2774 174.7961 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 4.34 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 2 L 8.47 3.98 0.00 1.73 1.68 0.96 0.50 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 3 T 8.76 3.88 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 1.21 0.00 0.00 4 D 7.62 4.70 0.00 2.75 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 5 P 0.00 4.20 0.00 2.22 2.10 0.00 3.70 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 2.13 2.20 0.00 6 I 7.95 3.55 2.03 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.89 0.80 0.00 0.00 7 A 8.16 3.86 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 8 D 8.23 4.08 0.00 2.76 2.79 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 9 M 8.59 3.97 0.00 2.12 1.92 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.45 0.00 10 L 8.11 3.81 0.00 1.78 1.64 0.83 0.85 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 11 T 8.70 3.74 4.34 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 1.16 0.00 0.00 12 R 7.99 3.57 0.00 1.98 1.98 0.00 3.22 0.00 0.00 3.16 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 13 I 7.46 3.78 2.01 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 1.34 0.73 0.80 0.00 0.00 14 R 8.04 3.72 0.00 1.74 1.96 0.00 3.15 0.00 0.00 3.09 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.52 0.00 15 N 8.92 4.41 0.00 2.76 2.79 0.00 0.00 6.74 7.04 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 16 A 7.81 3.99 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 17 T 7.97 4.00 4.35 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 1.07 0.00 0.00 18 R 7.67 3.75 0.00 1.92 1.96 0.00 3.04 0.00 0.00 3.43 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 19 V 7.46 4.26 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 0.79 0.00 0.00 1.03 0.00 0.00 20 Y 7.29 3.33 0.00 2.97 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 21 K 7.77 3.99 0.00 1.81 1.98 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.56 7.81 22 E 8.90 4.42 0.00 2.07 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 2.55 2.45 0.00 23 S 7.39 5.61 0.00 3.22 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 T 7.11 4.17 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 1.21 0.00 0.00 25 D 8.81 5.28 0.00 2.51 2.59 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 26 V 8.18 4.67 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 0.74 0.00 0.00 0.87 0.00 0.00 27 P 0.00 3.78 0.00 1.75 1.64 0.00 3.62 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 1.96 1.95 0.00 28 A 8.37 4.30 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 29 S 8.52 4.52 0.00 4.00 3.90 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 30 R 8.88 3.86 0.00 1.89 2.12 0.00 3.35 0.00 0.00 3.30 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.70 0.00 31 F 8.39 4.47 0.00 2.97 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 32 K 8.35 3.61 0.00 1.91 1.70 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.41 7.81 33 E 7.96 3.59 0.00 2.27 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 2.33 2.37 0.00 34 E 8.40 4.07 0.00 2.28 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 0.00 2.65 2.73 0.00 35 I 7.68 3.56 1.72 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.26 0.76 0.00 0.00 36 L 8.08 3.79 0.00 1.24 1.09 0.30 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 37 R 8.64 4.05 0.00 2.14 2.01 0.00 3.16 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 1.73 1.86 0.00 38 I 7.32 3.76 2.08 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.53 0.98 0.00 0.00 39 L 7.98 4.16 0.00 1.93 1.84 0.98 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.61 4.01 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.05 4.14 0.00 1.99 2.17 0.00 3.27 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 42 E 8.66 4.14 0.00 1.94 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 2.35 2.51 0.00 43 G 8.81 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 44 F 8.58 4.76 0.00 3.16 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 45 I 7.39 4.73 2.13 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.86 0.95 0.00 0.00 46 K 8.79 3.94 0.00 2.03 2.01 0.00 2.06 0.00 0.00 1.78 0.00 0.00 2.97 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.53 1.48 7.81 47 G 7.39 3.90 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 48 Y 7.31 5.38 0.00 3.23 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 8.84 4.54 0.00 2.04 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 2.54 2.42 0.00 50 R 8.58 4.68 0.00 1.79 2.00 0.00 3.24 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.70 0.00 51 V 8.62 4.52 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 0.92 0.00 0.00 1.01 0.00 0.00 52 D 8.83 5.30 0.00 2.62 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 V 8.58 3.86 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.78 0.00 0.00 54 D 9.57 4.50 0.00 2.79 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 55 G 8.67 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 56 K 7.68 4.63 0.00 2.17 1.80 0.00 1.66 0.00 0.00 1.84 0.00 0.00 3.12 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.44 7.81 57 P 0.00 4.89 0.00 2.10 2.22 0.00 3.64 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 1.98 1.98 0.00 58 Y 9.30 5.12 0.00 2.91 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 8.68 4.96 0.00 1.58 1.64 0.79 1.28 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 60 R 8.78 4.24 0.00 1.82 1.37 0.00 3.13 0.00 0.00 3.12 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.81 0.00 61 V 8.05 4.47 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 0.98 0.00 0.00 1.02 0.00 0.00 62 Y 8.99 4.59 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 63 L 8.61 4.54 0.00 1.60 1.21 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.04 4.69 0.00 1.78 1.56 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.30 1.46 7.81 65 Y 8.41 4.89 0.00 3.10 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 66 G 9.39 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 0.00 0.00 0.00 0.00 67 P 0.00 4.81 0.00 2.14 2.22 0.00 3.76 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 8.43 4.04 0.00 1.81 1.86 0.00 3.17 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 69 R 8.95 4.54 0.00 1.90 1.85 0.00 3.15 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.77 0.00 70 Q 8.64 4.44 0.00 1.90 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.51 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 71 G 8.60 3.81 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 0.00 0.00 0.00 72 P 0.00 4.22 0.00 2.19 2.07 0.00 3.86 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 1.99 1.95 0.00 73 D 8.63 4.28 0.00 2.84 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.59 0.00 2.19 2.23 0.00 3.90 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 1.98 1.88 0.00 75 R 7.53 3.74 0.00 1.90 1.90 0.00 3.44 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.48 0.00 76 P 0.00 4.70 0.00 2.19 2.29 0.00 2.74 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 1.74 1.79 0.00 77 E 8.70 4.66 0.00 2.11 1.87 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 2.27 2.33 0.00 78 Q 8.41 4.56 0.00 1.92 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.88 0.00 0.00 0.00 0.00 0.00 2.30 2.15 0.00 79 V 8.32 3.82 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 0.98 0.00 0.00 0.98 0.00 0.00 80 I 7.17 4.06 1.69 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.77 0.70 0.00 0.00 81 H 8.32 3.97 0.00 2.68 3.07 0.00 5.84 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 7.93 4.30 0.00 1.40 2.00 0.00 6.06 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 6.04 4.07 1.57 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.54 0.66 0.00 0.00 84 R 7.51 4.57 0.00 1.86 1.87 0.00 3.43 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 85 R 8.55 4.04 0.00 1.81 1.77 0.00 3.42 0.00 0.00 3.27 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 86 I 8.45 4.21 2.16 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 1.12 0.75 0.89 0.00 0.00 87 S 7.92 4.10 0.00 3.79 3.72 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 88 K 8.23 4.83 0.00 1.73 1.65 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.59 1.30 7.81 89 P 0.00 4.22 0.00 2.17 2.08 0.00 3.91 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 90 G 9.06 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 91 R 7.30 3.79 0.00 1.90 2.00 0.00 3.31 0.00 0.00 3.32 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.32 0.00 92 R 7.06 4.47 0.00 1.37 1.48 0.00 3.42 0.00 0.00 2.94 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 93 V 7.26 4.07 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 0.94 0.00 0.00 0.83 0.00 0.00 94 Y 8.39 5.36 0.00 2.92 2.83 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 95 V 8.81 4.59 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 0.89 0.00 0.00 1.04 0.00 0.00 96 G 8.54 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 97 V 8.40 3.67 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 0.78 0.00 0.00 0.94 0.00 0.00 98 K 8.13 3.99 0.00 1.78 1.93 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.45 1.48 7.81 99 E 8.48 4.52 0.00 2.13 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.26 0.00 100 I 7.51 4.04 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.68 0.93 0.00 0.00 101 P 0.00 4.20 0.00 2.18 2.08 0.00 3.77 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 102 R 8.19 4.19 0.00 1.78 1.88 0.00 3.23 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 103 V 8.03 3.41 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 1.07 0.00 0.00 1.03 0.00 0.00 104 R 8.79 3.63 0.00 1.82 1.69 0.00 3.02 0.00 0.00 2.75 7.27 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 8.77 3.77 0.00 1.75 1.89 0.00 3.17 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 106 G 7.96 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 0.00 107 L 8.40 4.17 0.00 1.68 1.79 0.91 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 108 G 7.72 4.48 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 0.00 109 I 8.45 4.96 2.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.91 1.21 0.00 0.00 110 A 8.81 4.87 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 0.00 111 I 8.23 4.79 1.87 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 0.93 0.93 0.00 0.00 112 L 9.17 5.14 0.00 1.54 1.61 1.01 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.93 5.17 0.00 4.08 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 0.00 114 T 9.02 5.17 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 1.28 0.00 0.00 115 S 8.93 4.14 0.00 3.99 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 0.00 116 K 7.86 4.41 0.00 1.77 1.86 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.39 1.36 7.81 117 G 8.33 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 0.00 118 V 8.03 4.70 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 0.98 0.00 0.00 1.17 0.00 0.00 119 L 8.62 5.03 0.00 1.77 1.93 0.94 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 120 T 8.56 4.65 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 1.37 0.00 0.00 121 D 8.88 4.38 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 0.00 122 R 7.98 4.00 0.00 1.89 2.07 0.00 3.16 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.78 0.00 123 E 8.27 3.99 0.00 2.34 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 0.00 2.35 2.37 0.00 124 A 8.71 3.99 1.47 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 0.00 0.00 0.00 125 R 8.93 3.79 0.00 1.94 2.08 0.00 3.14 0.00 0.00 3.10 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 126 K 8.79 4.11 0.00 1.75 2.16 0.00 1.85 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.49 7.81 127 L 8.09 4.27 0.00 2.04 1.73 0.93 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 128 G 9.30 3.92 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 0.00 0.00 0.00 129 V 7.95 4.54 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 0.79 0.00 0.00 0.95 0.00 0.00 130 G 8.86 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 0.00 0.00 0.00 131 G 7.57 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 E 8.28 4.48 0.00 2.31 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 0.00 2.35 2.04 0.00 133 L 9.55 4.33 0.00 1.76 1.60 0.92 1.02 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 0.00 134 I 6.92 2.81 2.16 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.99 0.87 0.00 0.00 135 C 5.78 5.24 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 0.00 136 E 8.22 5.06 0.00 2.09 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 0.00 2.33 2.30 0.00 137 V 7.97 4.11 1.83 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 0.70 0.00 0.00 138 W 8.04 4.78 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