NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2769 8.3044 120.3363 55.0206 33.4034 174.5032 2 V 3.6220 8.0480 125.2451 62.3375 32.2293 173.7667 3 K 4.5564 9.3730 128.1748 54.6514 35.8210 174.3033 4 E 5.3725 8.5475 119.6793 54.6950 33.4878 175.4324 5 F 4.7903 9.5404 124.3270 56.6572 42.7162 173.2215 6 N 5.6040 8.3355 122.8875 51.9946 42.0421 173.4569 7 T 4.8161 8.8979 116.4652 61.5273 71.8312 171.6421 8 Q 5.1547 8.3703 119.7650 55.7307 31.6710 173.6223 9 T 4.6868 8.7932 113.7049 60.9119 71.4074 172.0654 10 E 4.9716 8.8232 127.8148 55.3360 30.8357 175.3506 11 L 4.9557 8.9961 125.4353 52.3294 44.5393 177.3325 12 S 5.1255 9.0777 119.3308 56.1868 61.8854 173.9652 13 V 4.4965 6.9990 119.9380 60.6269 35.3862 175.3716 14 R 4.3440 8.3262 125.9223 55.2024 31.8944 177.5946 15 L 4.0203 8.4426 125.5219 57.7264 42.1735 179.0204 16 E 4.0199 8.2390 118.3272 59.3237 29.6229 178.5671 17 A 4.0095 7.9396 120.1452 55.0650 18.5478 179.1211 18 L 3.9118 8.0069 118.8934 58.0618 42.1056 178.8883 19 W 4.3298 8.6924 128.4629 60.5530 30.6345 177.7521 20 A 3.7275 8.2086 120.6277 55.0564 17.8573 179.8515 21 V 3.4784 7.8389 116.7419 66.0159 31.4277 178.0292 22 L 3.9341 7.9678 119.5342 57.8232 42.0206 178.4096 23 S 4.3380 7.6575 112.3093 59.1540 63.3667 175.0511 24 K 4.2882 7.9199 119.2149 56.6016 34.6702 176.6097 25 D 4.6397 7.7026 116.1648 53.8104 41.3114 178.1551 26 F 4.3501 7.0250 117.6082 59.8531 37.5217 177.2499 27 I 3.7474 7.1969 119.5153 64.5111 37.0653 177.6253 28 T 4.1804 7.6085 115.5235 65.9928 68.8401 177.2772 29 V 3.4038 7.8212 120.1672 65.5317 31.5358 178.2611 30 V 3.6955 7.9277 118.1342 65.7431 31.0125 176.4063 31 P 4.4552 0.0000 0.0000 65.1509 30.9208 178.5720 32 K 4.0211 7.3732 117.8104 59.0671 32.2440 178.5560 33 V 4.1009 7.7284 110.1983 61.3001 33.1838 176.1499 34 L 4.8914 7.9015 119.4131 53.2458 41.5905 176.0548 35 P 4.4292 0.0000 0.0000 64.6318 32.0608 177.1776 36 H 4.7363 8.0830 114.4385 55.9056 29.4054 174.4960 37 I 4.2365 7.7219 118.5946 62.3698 39.2374 175.1469 38 V 4.7864 7.8386 119.7178 61.2094 32.4068 175.3375 39 K 4.3170 9.2620 130.3600 59.1964 32.6221 176.2011 40 D 4.6243 7.6555 116.6991 52.5762 42.6818 174.0431 41 V 4.5317 8.1823 118.7607 61.2137 33.7462 174.4047 42 Q 4.4358 8.8716 127.7298 54.3777 30.8771 174.6705 43 L 4.4557 8.3462 125.8732 54.5232 42.1696 175.7660 44 I 4.1811 8.7663 128.4084 63.2691 38.2518 176.4961 45 E 4.5576 7.8582 119.5299 55.9688 34.1728 176.4350 46 G 4.1547 9.4635 110.0221 45.0258 0.0000 172.9686 47 D 4.7326 8.5531 116.3616 53.4586 39.9937 175.7640 48 G 3.9789 8.0327 108.8005 46.2309 0.0000 174.7921 49 G 3.7994 7.6337 109.5989 43.6054 0.0000 172.4913 50 V 3.9804 8.1569 119.2238 64.9444 31.7179 177.5241 51 G 4.0213 9.2082 115.7430 45.1079 0.0000 173.7898 52 T 4.2460 7.9299 117.7810 63.8747 69.6810 173.2269 53 I 4.9945 8.6745 126.7013 59.5053 40.0073 174.6590 54 L 5.1789 9.0505 126.3239 52.8827 45.6461 175.3728 55 I 4.7081 8.2956 122.8469 59.6069 40.0081 174.7517 56 F 4.7294 9.0471 127.1106 56.2642 40.0318 174.7184 57 N 4.7907 8.6691 122.8133 52.4756 39.6966 175.3786 58 F 5.4720 8.7114 123.0463 56.0574 41.0297 175.8207 59 L 4.2894 8.7910 120.5130 54.3598 42.1150 177.1729 60 P 4.2746 0.0000 0.0000 65.5146 31.4454 177.7006 61 E 4.1549 8.1336 115.6416 57.3688 30.1127 176.5643 62 V 4.0828 7.9905 120.7382 61.4924 32.5609 174.6227 63 S 4.6070 8.2700 120.4476 55.6195 65.1160 171.7272 64 P 4.3811 0.0000 0.0000 63.2786 31.7468 176.2526 65 S 4.9512 8.8840 114.3653 58.7090 64.6276 172.5585 66 Y 4.6182 7.3214 117.9608 56.3653 41.4936 173.1469 67 Q 4.4883 8.6828 120.5519 54.5879 32.8272 173.1048 68 R 5.0236 9.1143 127.6132 55.2852 31.8263 174.8580 69 E 5.3481 9.3984 125.1279 54.5542 34.3488 174.1547 70 E 5.1481 9.0475 122.3863 54.4136 33.3181 174.9589 71 I 4.6720 8.9605 128.4803 61.6552 37.3671 176.3137 72 T 4.7081 8.8659 118.1309 62.1796 70.0707 174.9589 73 E 4.9029 8.0797 120.9092 54.7824 34.2981 174.7471 74 F 4.9369 8.7727 125.4728 57.7296 42.0405 173.0312 75 D 4.8016 9.4549 127.5937 52.4396 42.9922 175.9232 76 E 4.0437 9.2494 127.2558 59.4093 29.9421 180.0188 77 S 3.9554 8.1910 112.4145 60.5732 63.1222 174.9208 78 S 4.3173 8.0579 112.4460 57.0600 63.9299 173.2410 79 H 2.0000 6.6932 117.8498 56.8208 26.3507 173.7260 80 E 5.2864 7.6208 119.5372 54.4333 32.9424 175.1789 81 I 5.2214 9.2241 126.1779 59.3178 42.0334 173.8480 82 G 4.6748 9.3475 115.5764 43.3140 0.0000 171.3860 83 L 5.4161 9.1587 124.1274 52.8097 45.1252 175.1040 84 Q 4.9235 9.1105 125.5500 54.1691 31.4375 174.5186 85 V 4.3566 8.7026 127.6275 62.9159 31.5622 175.4979 86 I 4.4925 8.6554 121.0462 61.1282 39.5154 175.1919 87 E 4.5171 8.3414 121.8239 56.5342 33.0877 176.7280 88 G 3.7789 8.7417 114.2472 45.9862 0.0000 174.4618 89 G 3.5434 7.2800 109.3308 46.5995 0.0000 176.8131 90 Y 4.2029 8.9087 121.4884 60.7775 37.6005 177.4496 91 L 4.7435 7.7160 116.4996 54.9480 41.8331 177.3158 92 S 4.7285 8.3651 114.7280 58.4433 62.0488 174.8458 93 Q 5.1943 7.8707 118.1561 54.8585 29.5787 176.9898 94 G 3.8543 8.3637 106.0383 46.0913 0.0000 174.2315 95 L 4.5863 7.9618 120.7223 54.6996 42.3727 177.3952 96 S 4.6711 8.8489 117.2291 59.5537 64.5116 173.7180 97 Y 4.9194 7.8583 121.2137 56.5858 42.4396 172.9864 98 Y 4.9318 7.7601 125.8999 56.5981 42.4958 172.9134 99 K 4.9493 8.7040 127.6592 54.9746 36.4490 174.6642 100 T 4.8223 8.9881 123.3240 62.0080 71.4128 173.0420 101 T 5.0145 8.7387 123.4216 61.7359 71.7170 172.9765 102 F 5.2825 9.4085 125.6772 55.6797 41.6026 174.6929 103 K 5.0816 9.3105 124.6128 54.6543 34.9933 174.5993 104 L 5.4530 8.7584 127.5487 53.2052 44.1178 176.0428 105 S 4.6556 8.8441 116.0108 56.6217 66.9870 172.8555 106 E 4.3138 8.7259 122.6939 56.2737 30.2072 175.9200 107 I 4.2328 8.5208 126.8482 62.6693 38.6133 174.9916 108 E 4.6550 7.4636 116.9878 54.9288 33.3646 174.9830 109 E 3.9193 9.0322 118.8390 59.8446 29.7041 178.9723 110 D 4.9155 7.9327 117.6387 53.6018 42.4945 175.0538 111 K 4.9593 7.9895 115.3619 54.6728 37.0155 175.7756 112 T 5.0433 8.8361 120.3867 61.6518 72.6057 172.6567 113 L 4.3978 8.9001 128.9422 54.3097 43.9088 175.2721 114 V 4.7545 8.9771 127.0554 61.3759 33.5615 173.9566 115 N 5.2325 9.1619 126.9023 52.3988 40.2628 174.4077 116 V 4.6676 8.9236 124.0052 60.8494 34.4843 173.8814 117 K 5.0219 8.8227 129.3156 53.9207 34.6711 174.4275 118 I 4.6860 9.0025 129.2030 59.7578 39.4307 174.7115 119 S 5.4361 8.7781 124.1846 56.9856 65.1860 173.0051 120 Y 5.5177 8.6955 121.7069 56.4585 41.7240 172.9605 121 D 4.8777 9.1741 118.4342 53.5454 45.2038 173.4824 122 H 5.3873 8.7649 119.9891 54.1541 31.6409 173.6980 123 D 4.7759 8.9445 122.3696 53.2876 41.5166 177.5885 124 S 4.2508 9.0120 121.3299 60.9206 63.1714 174.7786 125 D 4.6002 8.4420 119.4600 54.8023 41.1853 176.2188 126 I 4.3558 7.2488 120.4488 59.8042 38.4225 175.7677 127 E 4.0719 8.8753 125.2384 59.2287 29.5633 177.4972 128 E 3.9411 8.0276 119.0781 56.8453 29.9803 175.6904 129 K 4.4459 8.0504 126.2492 55.2518 33.5133 174.0393 130 V 3.9547 7.9688 126.0288 62.2724 32.3316 175.3218 131 T 4.4918 8.2374 118.0170 59.8853 70.7122 174.1336 132 P 4.2758 0.0000 0.0000 65.1043 31.0291 178.7526 133 T 3.4799 7.4564 114.9646 66.4183 68.5104 176.0849 134 K 4.0321 7.6381 119.9295 59.6813 32.3059 179.6976 135 T 3.7890 7.6284 110.2985 64.5894 68.5021 176.6761 136 S 4.0756 7.9108 117.3288 61.3487 62.8337 176.5771 137 Q 3.9878 7.8041 121.5114 58.8482 28.4200 178.8832 138 S 4.1676 7.9834 115.7636 61.8490 62.9501 176.7447 139 T 4.1015 7.8897 117.9821 66.7637 68.1895 176.9024 140 L 4.1347 8.3709 121.2654 57.7496 41.4986 179.2556 141 M 4.0234 8.2775 118.3378 58.7555 32.1443 177.3447 142 Y 4.3351 8.1209 119.6362 61.1165 38.8743 178.3585 143 L 3.6933 8.0871 119.5215 57.7899 41.7159 179.7763 144 R 3.9317 8.2752 118.1746 59.3490 29.9663 179.3817 145 R 4.0319 8.3361 118.0993 58.9834 30.0461 179.0069 146 L 3.9481 8.0364 119.2299 57.6662 41.4448 178.9675 147 E 3.9249 8.2952 119.3154 59.3892 29.5200 178.8981 148 R 3.9146 8.0654 118.4902 59.6768 29.9671 177.6825 149 Y 4.1070 8.0292 118.0358 60.4029 38.8608 177.2887 150 L 4.3319 7.8937 116.5070 55.1143 42.1406 178.1425 151 S 4.4701 7.3718 116.1457 60.3004 63.5503 174.1558 152 N 4.3982 7.7714 114.8430 52.0141 41.0666 174.4668 153 G 3.7622 8.1045 113.6753 45.6742 0.0000 173.7078 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 4.28 0.00 1.90 1.97 0.00 0.00 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.53 0.00 2 V 8.05 3.62 1.84 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 0.68 0.00 0.00 0.36 0.00 0.00 3 K 9.37 4.56 0.00 0.79 1.41 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.37 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.22 1.31 7.81 4 E 8.55 5.37 0.00 1.82 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 2.20 2.24 0.00 5 F 9.54 4.79 0.00 3.06 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 6 N 8.34 5.60 0.00 2.54 2.61 0.00 0.00 6.50 7.05 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 7 T 8.90 4.82 4.40 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 1.36 0.00 0.00 8 Q 8.37 5.15 0.00 2.17 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.02 6.44 0.00 0.00 0.00 0.00 0.00 2.24 2.37 0.00 9 T 8.79 4.69 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 1.27 0.00 0.00 10 E 8.82 4.97 0.00 1.90 1.88 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 2.27 2.34 0.00 11 L 9.00 4.96 0.00 1.55 1.55 0.96 0.56 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 12 S 9.08 5.13 0.00 3.93 3.91 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 13 V 7.00 4.50 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 0.94 0.00 0.00 14 R 8.33 4.34 0.00 1.91 1.85 0.00 3.48 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.73 0.00 15 L 8.44 4.02 0.00 1.71 1.64 0.79 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.24 4.02 0.00 2.12 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 2.45 2.49 0.00 17 A 7.94 4.01 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 18 L 8.01 3.91 0.00 1.82 1.74 0.88 0.78 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 19 W 8.69 4.33 0.00 3.38 3.18 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 0.00 0.00 0.00 20 A 8.21 3.73 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 21 V 7.84 3.48 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 1.01 0.00 0.00 1.06 0.00 0.00 22 L 7.97 3.93 0.00 1.58 1.62 0.40 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 23 S 7.66 4.34 0.00 3.01 2.63 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 0.00 0.00 0.00 0.00 24 K 7.92 4.29 0.00 1.81 1.72 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.15 0.00 0.00 3.35 0.00 0.00 0.00 0.00 1.38 1.26 7.81 25 D 7.70 4.64 0.00 2.63 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 26 F 7.02 4.35 0.00 3.39 3.41 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 27 I 7.20 3.75 1.72 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.51 0.90 0.00 0.00 28 T 7.61 4.18 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 29 V 7.82 3.40 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 0.58 0.00 0.00 0.88 0.00 0.00 30 V 7.93 3.70 2.38 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 1.00 0.00 0.00 1.09 0.00 0.00 31 P 0.00 4.46 0.00 2.21 2.11 0.00 3.79 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 2.20 2.18 0.00 32 K 7.37 4.02 0.00 1.82 1.83 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.21 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.56 1.57 7.81 33 V 7.73 4.10 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 0.54 0.00 0.00 1.10 0.00 0.00 34 L 7.90 4.89 0.00 1.81 1.61 0.84 0.88 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 35 P 0.00 4.43 0.00 2.06 2.15 0.00 3.43 0.00 0.00 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.95 0.00 36 H 8.08 4.74 0.00 3.18 3.38 0.00 5.64 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 I 7.72 4.24 1.87 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.74 0.71 0.00 0.00 38 V 7.84 4.79 2.19 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 0.94 0.00 0.00 1.13 0.00 0.00 39 K 9.26 4.32 0.00 1.83 1.97 0.00 1.91 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.40 7.81 40 D 7.66 4.62 0.00 2.74 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 41 V 8.18 4.53 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 0.10 0.00 0.00 0.88 0.00 0.00 42 Q 8.87 4.44 0.00 1.82 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.64 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 43 L 8.35 4.46 0.00 1.60 1.54 0.99 1.01 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 44 I 8.77 4.18 1.90 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 1.26 0.90 0.87 0.00 0.00 45 E 7.86 4.56 0.00 1.85 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 2.28 2.30 0.00 46 G 9.46 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 0.00 0.00 0.00 0.00 47 D 8.55 4.73 0.00 2.69 2.65 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 48 G 8.03 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 49 G 7.63 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 50 V 8.16 3.98 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 0.92 0.00 0.00 1.08 0.00 0.00 51 G 9.21 4.02 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 0.00 0.00 0.00 52 T 7.93 4.25 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 1.31 0.00 0.00 53 I 8.67 4.99 1.86 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 1.24 0.96 0.91 0.00 0.00 54 L 9.05 5.18 0.00 1.36 1.01 0.63 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 55 I 8.30 4.71 1.71 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 1.18 0.58 0.78 0.00 0.00 56 F 9.05 4.73 0.00 2.69 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 57 N 8.67 4.79 0.00 2.73 2.68 0.00 0.00 6.60 7.49 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 58 F 8.71 5.47 0.00 2.99 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 59 L 8.79 4.29 0.00 1.70 1.63 1.09 1.22 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 60 P 0.00 4.27 0.00 2.06 2.14 0.00 3.71 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 2.05 2.13 0.00 61 E 8.13 4.15 0.00 1.97 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 2.33 2.25 0.00 62 V 7.99 4.08 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 0.73 0.00 0.00 0.88 0.00 0.00 63 S 8.27 4.61 0.00 3.81 3.66 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 64 P 0.00 4.38 0.00 2.00 1.85 0.00 3.67 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.04 0.00 65 S 8.88 4.95 0.00 4.01 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 0.00 66 Y 7.32 4.62 0.00 2.93 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 67 Q 8.68 4.49 0.00 2.06 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.87 0.00 0.00 0.00 0.00 0.00 2.18 2.15 0.00 68 R 9.11 5.02 0.00 2.11 1.97 0.00 3.13 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 69 E 9.40 5.35 0.00 2.10 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 2.25 2.34 0.00 70 E 9.05 5.15 0.00 2.01 1.77 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 2.22 2.42 0.00 71 I 8.96 4.67 2.11 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 1.31 0.37 1.14 0.00 0.00 72 T 8.87 4.71 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 1.34 0.00 0.00 73 E 8.08 4.90 0.00 2.03 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 2.43 0.00 74 F 8.77 4.94 0.00 3.16 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 75 D 9.45 4.80 0.00 2.73 2.47 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 76 E 9.25 4.04 0.00 2.16 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 2.81 2.49 0.00 77 S 8.19 3.96 0.00 3.91 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 78 S 8.06 4.32 0.00 3.90 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 79 H 6.69 2.00 0.00 3.13 2.59 0.00 5.75 0.00 0.00 0.00 0.00 8.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.62 5.29 0.00 1.99 1.73 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 2.25 2.44 0.00 81 I 9.22 5.22 1.84 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 1.31 1.88 1.06 0.00 0.00 82 G 9.35 4.67 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 0.00 0.00 0.00 83 L 9.16 5.42 0.00 1.62 1.61 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 84 Q 9.11 4.92 0.00 2.04 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.01 0.00 0.00 0.00 0.00 0.00 2.17 2.15 0.00 85 V 8.70 4.36 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 1.08 0.00 0.00 86 I 8.66 4.49 1.90 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 1.28 0.87 0.98 0.00 0.00 87 E 8.34 4.52 0.00 2.08 1.86 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 2.41 2.37 0.00 88 G 8.74 3.78 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 0.00 0.00 0.00 89 G 7.28 3.54 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 0.00 90 Y 8.91 4.20 0.00 2.67 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 7.72 4.74 0.00 1.80 1.71 1.01 0.89 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 92 S 8.37 4.73 0.00 3.87 3.78 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 93 Q 7.87 5.19 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.62 0.00 0.00 0.00 0.00 0.00 2.26 2.45 0.00 94 G 8.36 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 95 L 7.96 4.59 0.00 1.96 1.72 1.04 0.84 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 96 S 8.85 4.67 0.00 3.93 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 97 Y 7.86 4.92 0.00 3.06 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 98 Y 7.76 4.93 0.00 3.09 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 99 K 8.70 4.95 0.00 1.49 1.43 0.00 1.68 0.00 0.00 1.84 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.29 1.51 7.81 100 T 8.99 4.82 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 0.60 0.00 0.00 101 T 8.74 5.01 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 1.29 0.00 0.00 102 F 9.41 5.28 0.00 3.08 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 0.00 103 K 9.31 5.08 0.00 1.80 1.65 0.00 1.58 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.37 7.81 104 L 8.76 5.45 0.00 1.51 1.53 1.15 0.91 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 0.00 105 S 8.84 4.66 0.00 3.81 3.87 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 0.00 106 E 8.73 4.31 0.00 1.92 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 2.28 2.51 0.00 107 I 8.52 4.23 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 1.37 1.16 0.91 0.00 0.00 108 E 7.46 4.65 0.00 1.96 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 109 E 9.03 3.92 0.00 2.00 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 2.38 2.31 0.00 110 D 7.93 4.92 0.00 2.81 2.55 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 0.00 111 K 7.99 4.96 0.00 1.63 1.62 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.35 1.41 7.81 112 T 8.84 5.04 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 113 L 8.90 4.40 0.00 1.77 1.54 0.94 1.01 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 0.00 114 V 8.98 4.75 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 1.14 0.00 0.00 0.99 0.00 0.00 115 N 9.16 5.23 0.00 2.78 2.73 0.00 0.00 6.00 8.46 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 0.00 116 V 8.92 4.67 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 0.86 0.00 0.00 0.99 0.00 0.00 117 K 8.82 5.02 0.00 1.88 1.60 0.00 1.70 0.00 0.00 1.75 0.00 0.00 2.85 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.34 7.81 118 I 9.00 4.69 1.97 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 1.09 0.55 0.41 0.00 0.00 119 S 8.78 5.44 0.00 3.88 3.91 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 0.00 120 Y 8.70 5.52 0.00 3.05 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 0.00 121 D 9.17 4.88 0.00 2.65 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.76 5.39 0.00 3.12 3.26 0.00 5.94 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 D 8.94 4.78 0.00 2.77 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 0.00 124 S 9.01 4.25 0.00 4.03 4.01 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 0.00 0.00 0.00 125 D 8.44 4.60 0.00 2.82 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 0.00 126 I 7.25 4.36 1.90 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 1.32 0.55 0.96 0.00 0.00 127 E 8.88 4.07 0.00 1.96 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 2.32 2.24 0.00 128 E 8.03 3.94 0.00 2.00 1.84 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 2.47 2.31 0.00 129 K 8.05 4.45 0.00 1.71 1.59 0.00 1.74 0.00 0.00 1.54 0.00 0.00 2.67 0.00 0.00 2.52 0.00 0.00 0.00 0.00 1.04 1.17 7.81 130 V 7.97 3.95 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 0.52 0.00 0.00 0.90 0.00 0.00 131 T 8.24 4.49 4.13 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 1.14 0.00 0.00 132 P 0.00 4.28 0.00 1.46 1.44 0.00 3.64 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.26 0.00 133 T 7.46 3.48 4.16 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 0.00 0.00 0.00 1.21 0.00 0.00 134 K 7.64 4.03 0.00 1.78 1.72 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.49 7.81 135 T 7.63 3.79 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 0.16 0.00 0.00 136 S 7.91 4.08 0.00 4.01 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 0.00 137 Q 7.80 3.99 0.00 2.22 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.84 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 138 S 7.98 4.17 0.00 4.07 3.91 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 0.00 139 T 7.89 4.10 4.46 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 1.38 0.00 0.00 140 L 8.37 4.13 0.00 1.73 1.77 1.00 1.06 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 0.00 141 M 8.28 4.02 0.00 2.30 2.09 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.62 0.00 142 Y 8.12 4.34 0.00 3.02 3.27 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 0.00 143 L 8.09 3.69 0.00 1.93 1.69 1.12 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 144 R 8.28 3.93 0.00 1.97 2.00 0.00 3.31 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.85 0.00 145 R 8.34 4.03 0.00 2.02 2.03 0.00 3.35 0.00 0.00 3.21 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 146 L 8.04 3.95 0.00 1.66 1.61 0.40 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 147 E 8.30 3.92 0.00 2.02 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 2.32 2.34 0.00 148 R 8.07 3.91 0.00 1.97 2.11 0.00 3.38 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 1.67 1.67 0.00 149 Y 8.03 4.11 0.00 3.05 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 0.00 150 L 7.89 4.33 0.00 1.76 1.70 0.97 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 151 S 7.37 4.47 0.00 3.94 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 0.00 152 N 7.77 4.40 0.00 2.73 2.83 0.00 0.00 6.12 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 G 8.10 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