NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.2523 8.4449 121.4667 55.1563 30.8097 175.5262 3 P 4.2451 0.0000 0.0000 61.5941 32.2660 176.1383 4 A 4.0814 8.9228 124.7273 54.9412 19.1282 179.7802 5 A 4.4375 7.9223 120.5073 54.5534 18.4469 179.4739 6 R 3.9601 7.9148 117.0886 59.1181 30.1857 178.5912 7 R 3.9498 7.9241 118.2424 59.4778 30.1318 178.5194 8 R 4.1610 8.1034 117.6827 59.2785 30.0766 178.8257 9 A 4.1767 8.1546 120.0701 55.2865 18.3559 179.7575 10 R 3.9873 8.2508 116.5340 59.4700 30.0704 179.0666 11 E 4.1664 8.3792 118.3166 59.8962 29.4821 179.3213 12 C 4.2327 8.6704 116.8372 62.7416 28.0663 176.0858 13 A 3.8787 8.2766 122.5406 54.7941 17.8267 179.7285 14 V 3.4321 7.9336 117.0375 66.3238 31.5805 178.3168 15 Q 3.8157 7.4998 117.4270 58.9333 28.5809 178.7895 16 A 4.0573 7.9693 121.8733 55.0510 18.3002 179.6243 17 L 4.0354 8.2511 118.0161 58.0759 41.6809 179.0116 18 Y 3.9961 8.3009 119.5623 60.9511 38.7316 178.4140 19 S 4.2484 8.3706 115.9796 61.5019 62.4245 176.6092 20 W 4.2685 8.5081 131.0473 60.5497 30.2298 178.1838 21 Q 3.4887 8.2022 117.4730 58.2743 28.1430 177.9828 22 L 4.0961 7.4698 118.9663 56.9114 42.2354 178.9721 23 S 4.1984 8.3954 113.4900 59.7637 63.2183 174.9631 24 Q 3.3994 7.4054 117.5975 56.4187 26.4983 173.5034 25 N 4.6306 7.8127 114.6401 52.8147 39.4518 175.7191 26 D 4.7616 8.5076 121.5825 53.2689 41.7268 177.2992 27 I 3.5374 8.6128 120.9666 64.3206 37.7847 178.0225 28 A 3.9879 7.9529 121.1273 55.2848 18.1857 179.2283 29 D 4.3880 8.5849 117.3851 57.2885 40.8991 178.9550 30 V 3.7049 7.9833 118.8404 66.0874 31.5465 177.6140 31 E 4.0605 8.8166 119.0839 59.5022 29.5383 177.9505 32 Y 4.0036 8.2254 119.4064 61.0007 38.9067 178.1469 33 Q 4.0834 8.5545 118.9524 58.8583 28.8274 178.6074 34 F 3.9176 8.5115 121.5962 61.5146 39.3106 177.3220 35 L 3.9692 8.0633 116.7370 57.4398 41.3922 179.1610 36 A 3.9302 7.5481 120.3195 54.7282 18.4457 178.7480 37 E 4.0396 7.7455 116.3732 57.8457 30.2540 177.0692 38 Q 3.9206 6.9079 116.1754 55.0945 29.4287 175.8946 39 D 4.5072 8.1620 120.0761 53.8386 40.2160 176.2596 40 V 4.3930 7.7246 122.3383 60.4984 32.4089 178.8752 41 K 3.9768 8.2309 122.5773 59.2829 32.5190 177.2398 42 D 4.8418 8.0640 117.1625 52.6041 39.6811 175.0356 43 V 4.3103 7.2847 118.7320 61.5565 33.2303 176.1755 44 D 4.5925 8.7512 126.3951 53.7929 40.5232 177.1095 45 V 3.6845 8.1960 126.6102 65.5697 31.8284 176.8446 46 L 3.9877 8.0789 119.6770 58.7279 41.9065 178.2136 47 Y 4.1550 8.3080 118.7335 60.6587 38.7728 177.8916 48 F 4.0762 8.4830 121.6441 61.3981 39.5275 177.4169 49 R 3.6703 8.2358 117.6866 59.1376 29.7487 178.9207 50 E 3.8690 8.1916 118.4613 58.8859 29.3637 179.4368 51 L 3.3224 7.3245 119.1187 57.4841 41.6977 179.1372 52 L 3.3922 6.9274 118.1642 57.6097 41.5396 179.2413 53 A 3.7456 7.5209 120.3573 55.1803 18.0560 179.6826 54 G 2.7870 7.2240 102.6526 47.6980 0.0000 175.7522 55 V 3.5469 7.4597 120.9949 65.5633 31.4120 177.8664 56 A 3.1271 7.5567 119.2808 55.2330 18.0409 179.3079 57 T 4.1278 7.6100 113.1053 65.1386 68.8490 175.3639 58 N 5.1129 7.7488 117.6463 53.1180 39.7025 177.2053 59 T 3.9286 8.2970 115.8640 66.9064 68.6739 175.6694 60 A 4.0233 8.1358 122.0455 55.5217 18.0342 178.9014 61 Y 4.0252 8.0447 117.3640 60.8894 37.8739 178.0413 62 L 4.0072 8.4583 120.2797 57.8441 41.6449 179.2225 63 D 4.7693 8.5676 119.3366 57.1985 40.4888 178.9758 64 G 3.5343 7.7926 105.5699 47.6990 0.0000 175.4379 65 L 4.0815 7.2708 118.7344 56.9017 41.8481 178.2170 66 M 4.4057 7.2849 118.1715 57.1652 32.8701 177.7111 67 K 3.8046 8.1084 119.1868 59.3522 32.1573 177.2027 68 P 4.1931 0.0000 0.0000 64.3393 31.1796 176.9815 69 Y 4.7764 7.2269 113.7353 57.8204 38.4381 176.8247 70 L 4.2871 7.9501 120.9572 55.1330 41.7328 178.2246 71 S 4.0308 8.8747 110.9112 58.1611 61.0810 169.2922 72 R 4.4869 7.1494 112.3348 56.0216 32.3233 173.9656 73 L 4.1739 8.1327 117.7383 54.3977 42.1242 178.2068 74 L 3.9550 8.6031 124.8186 58.0087 42.0893 177.1542 75 E 4.3437 8.0844 116.3954 56.3389 29.5762 175.7235 76 E 4.6291 7.9353 115.4900 56.5342 30.1406 176.8481 77 L 3.8876 7.9379 123.2617 57.7179 42.4910 177.9777 78 G 4.0705 8.3060 107.4578 45.6967 0.0000 174.0754 79 Q 3.9806 9.1090 124.2373 58.9848 28.8001 178.8740 80 V 3.6996 7.9756 118.6392 66.2839 31.6317 177.5255 81 E 4.0742 8.3417 117.7067 59.4047 29.2451 179.2377 82 K 3.9672 8.4975 119.4968 59.4502 32.2957 178.6476 83 A 4.0299 8.1226 120.9721 55.1880 18.3315 179.6117 84 V 3.5837 8.1992 117.0883 66.3620 31.5789 178.2858 85 L 4.0529 8.4304 118.9952 57.8483 41.4625 179.6391 86 R 3.9886 8.4738 118.4711 59.2751 29.9866 179.1999 87 I 3.7136 8.0434 119.3249 64.3317 37.1626 178.2547 88 A 4.0312 7.9880 121.5347 55.3988 18.1902 179.7784 89 L 4.1026 8.2148 117.4960 57.7450 41.6178 179.0821 90 Y 4.1448 8.1578 119.7191 60.7804 38.7461 178.1053 91 E 3.7928 8.3004 119.3779 59.3324 29.3864 179.2035 92 L 3.9721 8.0974 118.3615 57.7344 41.8557 179.2509 93 S 4.5498 8.0706 111.4973 59.3227 63.6294 174.7607 94 K 4.3886 7.8594 118.4233 55.3246 34.2362 176.4985 95 R 4.4463 7.7017 118.6628 53.7634 30.1553 176.3079 96 S 4.1651 8.4785 119.6328 61.2696 63.0902 175.5116 97 D 4.5115 8.0566 116.8328 53.7276 39.4358 175.7838 98 V 4.2685 7.4493 120.5713 60.3395 33.0996 173.9912 99 P 4.4784 0.0000 0.0000 62.5394 33.2952 176.3776 100 Y 4.0303 8.1542 122.7543 61.0753 38.8747 179.0647 101 K 3.9792 8.3141 118.6318 59.4857 32.2621 179.3270 102 V 3.5397 7.8183 117.5872 66.0333 31.1750 177.6347 103 A 4.1573 7.9363 120.4088 55.2570 18.2955 179.7776 104 I 3.5810 7.4719 117.7303 64.5844 37.2558 178.1725 105 N 4.3250 8.5336 118.2729 56.7366 38.6622 176.7108 106 E 3.9790 8.7038 120.2480 59.3352 29.4818 179.1247 107 A 4.0439 7.7719 120.4345 55.1639 18.4022 179.7352 108 I 3.7056 7.6939 117.8995 64.7733 37.3202 178.6301 109 E 4.0595 8.2371 119.2204 59.1006 29.1981 179.4798 110 L 4.1662 8.2319 119.3831 57.7655 41.8896 179.2886 111 A 4.1617 8.5269 121.0481 54.9220 18.0204 179.9198 112 K 4.0085 7.8081 116.7250 59.6008 32.2121 179.5390 113 S 4.0566 7.8331 114.2882 60.9426 62.9234 175.3145 114 F 4.7146 8.1844 116.5863 57.0755 39.8256 175.3795 115 G 4.0996 7.6476 109.0919 42.9588 0.0000 172.9284 116 A 4.1487 8.2764 121.4799 51.7781 18.9074 177.9869 117 E 3.9105 8.7782 120.5050 59.4321 29.7917 178.8763 118 D 4.9094 7.8463 116.2740 53.4049 40.3370 178.4122 119 S 4.2656 8.2700 117.8285 62.4533 62.2441 175.1605 120 H 4.3190 8.3008 117.6882 58.4320 28.1978 177.5487 121 K 3.8479 7.2918 120.2947 59.2242 31.8933 178.9778 122 F 4.0685 8.1607 120.2215 61.3058 39.4439 177.0398 123 V 3.5619 7.9090 117.8964 66.0644 31.2842 177.4944 124 N 4.3453 8.9355 117.2123 56.5001 38.4691 176.9241 125 G 3.5502 8.1630 107.3748 47.8482 0.0000 175.8041 126 V 3.3622 7.4730 120.8685 65.6457 31.5663 178.2172 127 L 3.9006 7.9425 118.6204 57.6411 41.1370 179.0968 128 D 4.3273 8.2319 118.7803 56.7880 40.7244 178.1144 129 K 3.9936 6.9106 116.9877 57.8528 32.9586 178.4884 130 A 3.9661 7.6784 120.9339 54.8000 18.3179 179.5634 131 A 3.9350 7.9839 119.3319 54.9523 18.3676 178.2134 132 P 4.2128 0.0000 0.0000 65.2373 31.1510 179.1387 133 V 3.6213 7.6510 116.5022 65.9759 31.6590 177.6878 134 I 4.1115 7.4985 118.1733 63.0028 38.2515 176.7734 135 R 4.5853 8.6815 121.2516 52.7492 30.2190 173.9715 136 P 4.5552 0.0000 0.0000 64.6291 31.6133 177.4780 137 N 4.4108 8.0298 111.9537 52.7446 37.8956 174.6102 138 K 2.6983 7.7813 117.9225 56.4582 29.8543 175.5509 139 K 4.1669 7.5522 122.4080 57.3069 32.4433 175.6543 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 E 8.44 4.25 0.00 1.90 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 0.00 2.18 2.37 0.00 3 P 0.00 4.25 0.00 2.27 1.93 0.00 3.57 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 2.05 2.11 0.00 4 A 8.92 4.08 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 5 A 7.92 4.44 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 6 R 7.91 3.96 0.00 1.81 2.05 0.00 2.82 0.00 0.00 2.33 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.07 0.00 7 R 7.92 3.95 0.00 1.95 2.09 0.00 3.26 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.92 0.00 8 R 8.10 4.16 0.00 2.11 2.02 0.00 3.61 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.95 0.00 9 A 8.15 4.18 1.71 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 0.00 0.00 0.00 0.00 0.00 0.00 10 R 8.25 3.99 0.00 2.24 2.10 0.00 3.41 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.09 0.00 11 E 8.38 4.17 0.00 2.36 2.31 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 2.55 2.79 0.00 12 C 8.67 4.23 0.00 3.05 2.49 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 13 A 8.28 3.88 1.29 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 14 V 7.93 3.43 1.80 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 0.65 0.00 0.00 0.99 0.00 0.00 15 Q 7.50 3.82 0.00 2.29 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.15 2.12 0.00 16 A 7.97 4.06 1.05 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 17 L 8.25 4.04 0.00 1.96 1.81 0.63 0.52 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 18 Y 8.30 4.00 0.00 3.15 3.16 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 0.00 19 S 8.37 4.25 0.00 4.24 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 20 W 8.51 4.27 0.00 3.35 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 21 Q 8.20 3.49 0.00 1.93 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.64 0.00 0.00 0.00 0.00 0.00 2.22 2.59 0.00 22 L 7.47 4.10 0.00 1.43 1.55 0.76 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 23 S 8.40 4.20 0.00 3.98 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 24 Q 7.41 3.40 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.92 0.00 0.00 0.00 0.00 0.00 2.01 2.13 0.00 25 N 7.81 4.63 0.00 2.86 2.83 0.00 0.00 6.87 7.44 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 26 D 8.51 4.76 0.00 2.96 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 I 8.61 3.54 1.10 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.85 0.68 0.00 0.00 28 A 7.95 3.99 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 29 D 8.58 4.39 0.00 2.98 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 30 V 7.98 3.70 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 1.14 0.00 0.00 31 E 8.82 4.06 0.00 2.01 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 0.00 2.45 2.41 0.00 32 Y 8.23 4.00 0.00 3.28 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 33 Q 8.55 4.08 0.00 2.33 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.57 0.00 0.00 0.00 0.00 0.00 2.54 2.70 0.00 34 F 8.51 3.92 0.00 3.41 3.31 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 0.00 35 L 8.06 3.97 0.00 1.61 1.66 1.07 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 36 A 7.55 3.93 1.07 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 0.00 0.00 0.00 0.00 0.00 0.00 37 E 7.75 4.04 0.00 1.96 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 2.18 2.27 0.00 38 Q 6.91 3.92 0.00 1.45 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.89 0.00 0.00 0.00 0.00 0.00 1.54 1.16 0.00 39 D 8.16 4.51 0.00 2.57 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 40 V 7.72 4.39 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 0.79 0.00 0.00 0.85 0.00 0.00 41 K 8.23 3.98 0.00 1.87 2.08 0.00 1.56 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.42 1.37 7.81 42 D 8.06 4.84 0.00 2.83 2.89 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 43 V 7.28 4.31 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 0.79 0.00 0.00 0.94 0.00 0.00 44 D 8.75 4.59 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 45 V 8.20 3.68 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 1.06 0.00 0.00 1.02 0.00 0.00 46 L 8.08 3.99 0.00 1.82 1.77 0.98 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 47 Y 8.31 4.16 0.00 3.30 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 48 F 8.48 4.08 0.00 3.19 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 R 8.24 3.67 0.00 2.01 1.99 0.00 3.60 0.00 0.00 3.28 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.96 0.00 50 E 8.19 3.87 0.00 1.98 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 2.31 2.45 0.00 51 L 7.32 3.32 0.00 1.41 1.30 0.83 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 52 L 6.93 3.39 0.00 1.14 1.23 0.05 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.52 3.75 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 G 7.22 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 0.00 0.00 0.00 55 V 7.46 3.55 1.75 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 0.95 0.00 0.00 0.82 0.00 0.00 56 A 7.56 3.13 0.44 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 57 T 7.61 4.13 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 1.16 0.00 0.00 58 N 7.75 5.11 0.00 2.99 2.93 0.00 0.00 6.92 7.62 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 59 T 8.30 3.93 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 1.45 0.00 0.00 60 A 8.14 4.02 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 61 Y 8.04 4.03 0.00 3.04 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 62 L 8.46 4.01 0.00 1.80 1.76 1.13 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 63 D 8.57 4.77 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 64 G 7.79 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 65 L 7.27 4.08 0.00 1.60 1.71 0.73 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 66 M 7.28 4.41 0.00 2.33 2.21 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.62 0.00 67 K 8.11 3.80 0.00 1.72 1.78 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.66 7.81 68 P 0.00 4.19 0.00 0.70 1.71 0.00 3.04 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.91 0.00 69 Y 7.23 4.78 0.00 2.99 2.85 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 70 L 7.95 4.29 0.00 1.89 1.86 0.98 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 71 S 8.87 4.03 0.00 4.12 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 R 7.15 4.49 0.00 1.96 1.93 0.00 3.16 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 73 L 8.13 4.17 0.00 1.73 1.62 0.91 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.60 3.96 0.00 1.59 1.71 0.95 0.96 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 75 E 8.08 4.34 0.00 1.93 1.90 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 2.22 2.34 0.00 76 E 7.94 4.63 0.00 2.09 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 2.22 2.33 0.00 77 L 7.94 3.89 0.00 1.82 1.71 1.13 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 78 G 8.31 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 Q 9.11 3.98 0.00 2.35 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.84 0.00 0.00 0.00 0.00 0.00 2.46 2.25 0.00 80 V 7.98 3.70 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 1.27 0.00 0.00 0.98 0.00 0.00 81 E 8.34 4.07 0.00 2.28 2.15 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 2.58 2.48 0.00 82 K 8.50 3.97 0.00 1.97 2.02 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.51 7.81 83 A 8.12 4.03 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 84 V 8.20 3.58 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 1.15 0.00 0.00 1.09 0.00 0.00 85 L 8.43 4.05 0.00 1.82 1.75 1.07 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 86 R 8.47 3.99 0.00 2.09 2.02 0.00 3.33 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.81 0.00 87 I 8.04 3.71 2.07 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 0.80 0.98 0.00 0.00 88 A 7.99 4.03 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 89 L 8.21 4.10 0.00 1.76 1.75 0.98 0.60 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 90 Y 8.16 4.14 0.00 3.14 3.16 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 0.00 91 E 8.30 3.79 0.00 2.27 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 2.56 2.72 0.00 92 L 8.10 3.97 0.00 1.70 1.74 0.84 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 93 S 8.07 4.55 0.00 4.18 4.07 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 0.00 0.00 0.00 0.00 94 K 7.86 4.39 0.00 0.91 1.48 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.29 1.47 7.81 95 R 7.70 4.45 0.00 1.91 2.03 0.00 3.24 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.84 0.00 96 S 8.48 4.17 0.00 3.85 3.93 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 0.00 0.00 0.00 0.00 97 D 8.06 4.51 0.00 2.77 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 98 V 7.45 4.27 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 0.85 0.00 0.00 0.98 0.00 0.00 99 P 0.00 4.48 0.00 2.23 1.98 0.00 3.69 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 2.12 2.14 0.00 100 Y 8.15 4.03 0.00 3.14 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 0.00 101 K 8.31 3.98 0.00 1.90 1.90 0.00 1.77 0.00 0.00 1.79 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.67 1.67 7.81 102 V 7.82 3.54 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 1.15 0.00 0.00 0.94 0.00 0.00 103 A 7.94 4.16 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 0.00 104 I 7.47 3.58 1.71 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 1.17 0.69 0.84 0.00 0.00 105 N 8.53 4.33 0.00 2.87 2.82 0.00 0.00 7.31 7.56 0.00 0.00 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 8.70 3.98 0.00 2.06 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 2.50 2.51 0.00 107 A 7.77 4.04 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.69 3.71 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 1.57 0.59 0.93 0.00 0.00 109 E 8.24 4.06 0.00 2.16 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 2.50 2.50 0.00 110 L 8.23 4.17 0.00 1.96 1.89 1.01 0.87 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 0.00 111 A 8.53 4.16 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 K 7.81 4.01 0.00 1.91 1.84 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.53 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.38 1.60 7.81 113 S 7.83 4.06 0.00 3.52 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 F 8.18 4.71 0.00 3.18 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 0.00 115 G 7.65 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 0.00 116 A 8.28 4.15 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 0.00 117 E 8.78 3.91 0.00 1.93 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 2.32 2.43 0.00 118 D 7.85 4.91 0.00 2.92 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 S 8.27 4.27 0.00 4.13 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 0.00 120 H 8.30 4.32 0.00 3.43 3.68 0.00 5.52 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 K 7.29 3.85 0.00 2.06 1.90 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.35 1.16 7.81 122 F 8.16 4.07 0.00 3.14 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 V 7.91 3.56 2.27 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 0.97 0.00 0.00 1.13 0.00 0.00 124 N 8.94 4.35 0.00 2.94 2.78 0.00 0.00 7.13 8.47 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 0.00 125 G 8.16 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 0.00 0.00 0.00 126 V 7.47 3.36 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 1.07 0.00 0.00 0.39 0.00 0.00 127 L 7.94 3.90 0.00 1.70 1.57 0.88 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 128 D 8.23 4.33 0.00 2.78 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 0.00 129 K 6.91 3.99 0.00 0.79 1.06 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.23 1.45 7.81 130 A 7.68 3.97 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 0.00 131 A 7.98 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 P 0.00 4.21 0.00 2.17 2.12 0.00 3.66 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 2.19 2.25 0.00 133 V 7.65 3.62 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 1.04 0.00 0.00 134 I 7.50 4.11 2.04 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 1.55 0.75 0.97 0.00 0.00 135 R 8.68 4.59 0.00 2.05 1.89 0.00 3.43 0.00 0.00 3.38 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 136 P 0.00 4.56 0.00 2.02 2.13 0.00 3.73 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.08 0.00 137 N 8.03 4.41 0.00 2.77 2.89 0.00 0.00 6.03 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 K 7.78 2.70 0.00 1.54 1.08 0.00 1.52 0.00 0.00 1.51 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.67 1.19 7.81 139 K 7.55 4.17 0.00 1.86 1.77 0.00 1.50 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.45 1.40 7.81