NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 S 4.3142 8.1933 115.2946 56.6572 64.2962 176.2735 1 M 3.2956 8.1671 116.3086 54.3154 30.7332 175.6545 2 S 4.7476 8.9092 114.3715 57.8016 64.4143 174.9740 3 K 4.0244 8.3298 122.5312 59.6236 31.8691 176.7518 4 N 5.1139 7.6675 112.5807 51.0432 42.2062 173.7452 5 I 3.9569 8.1023 121.2281 60.2020 37.9789 175.8141 6 L 3.6956 8.5112 126.5918 55.9122 42.0596 176.1357 7 D 4.7161 8.4307 125.9356 52.3148 41.0986 175.7972 8 M 3.9611 8.6035 126.4271 58.4025 32.2144 179.3539 9 R 4.2173 8.1056 115.6554 58.7405 30.2537 176.8312 10 N 5.0870 8.0979 114.4802 53.0809 39.1611 174.3728 11 T 5.0230 8.2848 113.9071 61.7559 72.8004 173.8303 12 V 4.3356 8.4381 124.0444 59.9690 34.2501 174.1842 13 Q 5.0717 8.3694 124.8492 54.3869 31.7187 174.0515 14 I 4.7404 8.5171 126.6051 59.4722 40.1360 174.6645 15 G 3.9051 8.4755 115.6025 45.0155 0.0000 172.0981 16 I 4.8311 8.9315 126.5202 59.2972 40.2818 174.8316 17 V 4.3574 8.4750 128.0312 62.3833 32.6342 175.3307 18 V 4.8707 8.8486 120.3060 59.8553 35.6980 176.6664 19 R 3.9462 9.0004 120.4803 57.7730 30.7134 177.0707 20 D 4.5100 7.5315 115.6420 51.4567 43.2342 175.1353 21 I 3.5195 9.0620 128.6741 63.7398 38.0828 177.4849 22 E 3.9245 7.8506 119.1559 59.1824 29.3928 178.6992 23 E 3.9094 8.4930 119.2190 59.5738 29.7318 179.0750 24 S 4.2163 8.1041 115.1725 61.5745 62.8995 176.5425 25 L 4.3069 8.3969 123.3017 57.9772 41.7355 178.8466 26 Q 4.1103 8.0802 119.5976 59.0641 28.9393 177.6185 27 N 4.3222 8.3237 117.5701 56.7220 38.6014 177.0408 28 Y 3.8133 8.4421 118.0005 60.8442 37.7611 178.3464 29 A 4.4084 8.4645 121.9102 55.1556 18.6345 179.6555 30 E 3.9141 8.5566 117.2515 59.5200 29.4104 179.1349 31 F 3.7719 8.0921 119.7788 61.2682 39.3248 175.9635 32 F 4.3009 8.2514 115.5739 56.8454 39.2039 175.5742 33 G 4.0129 7.6940 108.5534 47.1450 0.0000 173.8119 34 V 4.6292 7.9777 109.9706 58.7206 35.2298 176.2316 35 E 4.1242 8.6406 121.7537 55.8118 29.8759 177.1883 36 K 3.9149 8.7725 124.8449 56.4188 32.6035 174.4957 37 P 4.5645 0.0000 0.0000 61.8214 32.7856 175.0923 38 Q 4.4028 8.2185 118.0019 54.6360 29.9657 175.4524 39 W 5.1611 7.9729 118.2696 55.4406 30.8975 174.6729 40 F 4.8336 8.5391 113.8629 55.6084 41.0000 173.1994 41 W 5.1115 9.0407 120.4274 56.3666 29.8698 176.6463 42 T 4.4783 8.8458 114.8460 61.2503 69.2969 174.0927 43 D 4.6358 8.8889 122.1775 54.4402 41.5850 176.4727 44 D 4.7196 8.4580 120.8542 52.7613 40.7169 176.4528 45 Y 4.1241 8.8912 121.1478 60.9116 38.6761 178.7759 46 S 4.4316 7.7997 112.8189 60.0585 63.3453 174.9764 47 K 4.2072 8.2044 119.6863 57.5095 33.8053 177.5281 48 A 4.5347 7.7752 120.7262 53.2889 18.5600 177.7187 49 H 3.3726 7.8113 110.5114 56.3951 27.1863 174.9449 50 T 4.2908 8.0424 115.1544 64.6360 69.6219 173.1493 51 K 5.0076 9.2498 125.2247 54.6860 35.7424 174.8526 52 F 5.3762 9.4595 128.7811 56.6335 41.5708 175.2874 53 N 4.0858 9.8524 125.7277 54.3301 36.4080 175.7586 54 G 3.9684 8.4076 105.3496 45.3510 0.0000 173.8273 55 R 4.5428 7.5212 120.4599 53.8613 31.5600 173.9066 56 P 5.0672 0.0000 0.0000 62.8383 32.1542 175.7003 57 T 4.6473 8.3204 114.6699 60.6256 70.3532 174.0045 58 K 4.3416 8.6951 125.5394 56.3744 32.4681 176.9810 59 A 4.4352 7.8489 122.4504 53.3504 18.8689 177.3275 60 R 5.1593 9.6240 119.8628 54.8558 35.2998 173.9867 61 A 5.0908 8.9717 120.9741 50.4936 23.3011 175.3861 62 K 3.9603 8.2981 119.6098 55.4074 33.5324 176.3214 63 L 4.9969 8.6386 123.5964 51.7067 45.6531 175.4323 64 A 4.6996 7.4269 121.8075 50.4076 22.6320 174.9938 65 F 5.3879 8.6105 119.6841 55.6559 42.4047 174.8626 66 F 4.7735 9.1829 119.7620 55.7331 42.7173 173.7327 67 E 4.8235 8.9767 122.5821 54.7915 31.2046 176.3549 68 L 4.6510 8.9054 125.8026 53.1046 43.1736 178.2010 69 G 3.8248 7.8949 116.3389 45.9910 0.0000 171.8898 70 P 4.4118 0.0000 0.0000 63.3946 31.6236 174.7613 71 L 5.1449 7.8674 122.5967 53.3227 44.9498 174.5426 72 Q 5.0105 8.8512 127.0694 54.4175 31.5864 173.8397 73 L 4.9211 8.8663 127.5209 53.3064 43.7553 175.0996 74 E 4.7991 8.9731 125.5663 54.3046 32.1513 174.4733 75 L 4.7193 8.3402 127.4636 53.5626 44.0636 175.7830 76 I 4.3444 8.5750 123.5940 59.4066 40.8345 174.0456 77 E 4.9934 8.7296 129.3139 52.5845 30.8124 173.3918 78 P 4.9303 0.0000 0.0000 62.3676 32.8028 176.7592 79 D 4.8418 8.4698 120.6528 53.1494 41.4396 175.9343 80 E 4.3908 8.6245 117.9541 57.0205 29.9010 176.1049 81 N 4.6701 8.1824 117.0473 52.0562 39.2904 172.9749 82 P 4.4475 0.0000 0.0000 62.7637 32.1277 176.7530 83 S 3.4311 7.5533 115.6705 56.3915 66.2780 176.8094 84 T 3.3698 7.1589 116.8253 64.6537 66.7492 176.3257 85 W 4.0444 6.6730 120.3500 59.7352 29.1181 178.3234 86 R 3.9411 8.2412 118.8483 59.3442 29.6539 177.9963 87 E 3.9465 8.2100 119.1702 59.2432 29.5310 178.5962 88 F 4.0393 8.4321 120.6196 61.1645 39.5269 176.6423 89 L 3.9825 8.4570 120.2290 58.4055 41.7149 178.4368 90 D 4.3333 8.0479 117.5222 57.4922 40.9488 178.6381 91 K 4.1036 7.7101 117.4530 57.8361 32.3589 176.6263 92 N 4.4601 8.0538 115.3251 51.8727 40.6781 174.9213 93 G 3.8902 8.1077 104.9836 44.3719 0.0000 172.7574 94 E 4.7809 8.0784 117.2657 55.2425 29.9414 177.4242 95 G 4.1043 8.2875 110.2388 45.3761 0.0000 171.3233 96 I 4.0651 8.1255 120.6251 61.8635 37.2223 175.6316 97 H 3.6653 8.8671 126.5893 58.0978 30.8046 174.1877 98 H 4.9613 7.4167 111.3102 54.9658 32.0720 172.5441 99 I 4.8599 8.6356 118.7931 59.4270 40.2697 174.7821 100 A 5.1421 9.0472 128.9363 50.0220 22.0785 174.9346 101 F 5.0903 8.7903 118.9093 55.5321 42.8268 174.6783 102 V 4.4810 8.5739 122.7383 62.6756 32.1983 175.4599 103 V 4.5680 8.8360 120.4352 59.3569 34.5237 176.0483 104 K 3.9973 8.8485 124.2095 58.7027 32.6479 176.7421 105 D 4.7701 7.7518 117.1547 51.5170 43.2863 175.0535 106 M 3.9499 9.1946 126.8698 58.8867 32.3372 177.3046 107 D 4.4157 8.2112 118.4500 57.7455 41.0283 179.3828 108 R 4.0018 8.1926 115.8923 58.8972 29.5188 178.7773 109 K 3.8784 7.9965 120.3324 59.4078 32.2551 179.0786 110 V 3.4188 8.2217 118.8620 65.4748 31.2276 177.6808 111 E 4.0198 7.9921 119.3289 59.2949 29.6889 178.2520 112 E 3.9617 8.2242 118.7001 59.8589 29.5906 179.7114 113 L 4.0459 7.8720 118.4810 57.8156 41.4893 179.2497 114 Y 4.4214 7.9185 116.8859 61.3407 37.6411 178.8631 115 R 4.0292 8.2152 117.6263 58.5533 30.1547 178.1974 116 K 4.4696 7.6434 116.0613 55.9013 32.1703 177.1676 117 G 3.8610 8.2592 107.5485 46.3475 0.0000 173.8239 118 M 4.6362 8.0900 120.4761 54.0648 34.2594 174.9365 119 K 4.8695 9.1068 118.7942 55.7557 36.2662 174.9744 120 V 4.4923 8.6210 126.3488 62.5673 31.6806 175.5248 121 I 4.3299 9.2159 122.0382 62.3868 39.6562 175.3705 122 Q 5.8625 8.2820 122.4006 55.6314 32.5395 173.1131 123 K 4.4362 8.3336 123.5349 55.3912 36.8990 174.8714 124 G 4.1029 6.4348 106.8393 46.7413 0.0000 171.2986 125 D 5.6750 8.6601 119.4160 52.5724 44.6802 175.7729 126 F 5.3269 8.3374 114.0620 55.0805 41.1328 173.6496 127 E 4.0202 8.4624 121.0446 59.3392 29.1995 177.5540 128 G 3.9646 9.1235 112.6129 44.1256 0.0000 172.9688 129 G 2.6726 6.2810 106.2786 45.4601 0.0000 171.6789 130 R 4.9332 6.9041 115.2215 55.3817 33.4603 173.2776 131 Y 5.5549 8.7270 116.4770 56.0510 42.4178 174.0224 132 A 4.7430 8.7990 121.1042 51.2325 23.0702 174.9257 133 Y 4.7264 9.6892 121.8897 57.4060 39.4915 175.0161 134 I 4.8995 8.7384 125.7421 58.9791 39.1932 176.1811 135 D 4.8978 8.4519 126.5380 53.1285 36.9185 176.7111 136 T 4.3635 7.7762 107.4998 62.2359 70.6226 176.8092 137 L 3.9961 8.0985 125.2962 58.6224 42.2787 179.1912 138 R 3.9243 8.0977 115.5814 59.0828 30.3127 177.7371 139 A 4.2289 8.0525 119.2639 54.2578 18.6379 177.9659 140 L 4.3694 8.5705 114.3771 54.3017 42.4800 178.3135 141 K 4.3250 9.3239 117.1411 56.3309 30.2073 175.8933 142 V 4.4449 7.0449 116.1899 60.6628 34.3820 172.5760 143 M 4.4387 8.4888 121.4402 55.1510 33.6159 174.6504 144 I 5.0146 8.6007 127.0540 59.9603 39.7303 174.2838 145 E 5.0615 9.1608 126.8192 54.3442 33.0070 174.2515 146 L 5.3305 8.9089 125.7785 53.0856 44.5946 175.4075 147 L 5.4173 9.0316 122.6421 52.9277 45.7005 175.1257 148 E 4.8969 9.2903 123.1529 54.5637 32.7146 173.7784 149 N 5.1035 8.7388 124.3050 51.4091 40.6362 174.6452 150 Y 4.5045 7.8048 120.8103 58.4485 37.9230 175.6338 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 0 S 8.19 4.31 0.00 3.88 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 1 M 8.17 3.30 0.00 2.31 2.20 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.66 0.00 2 S 8.91 4.75 0.00 3.89 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 3 K 8.33 4.02 0.00 1.75 1.93 0.00 1.58 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.55 7.81 4 N 7.67 5.11 0.00 2.65 2.66 0.00 0.00 6.92 7.45 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 5 I 8.10 3.96 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.72 0.88 0.00 0.00 6 L 8.51 3.70 0.00 1.54 1.55 0.78 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 7 D 8.43 4.72 0.00 2.76 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 8 M 8.60 3.96 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.45 0.00 9 R 8.11 4.22 0.00 1.79 2.04 0.00 3.24 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 10 N 8.10 5.09 0.00 2.96 2.81 0.00 0.00 6.77 7.93 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 11 T 8.28 5.02 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 1.20 0.00 0.00 12 V 8.44 4.34 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 0.75 0.00 0.00 0.63 0.00 0.00 13 Q 8.37 5.07 0.00 2.11 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.77 0.00 0.00 0.00 0.00 0.00 2.24 2.45 0.00 14 I 8.52 4.74 1.80 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.60 0.84 0.00 0.00 15 G 8.48 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 0.00 0.00 0.00 16 I 8.93 4.83 1.70 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.58 0.98 0.00 0.00 17 V 8.48 4.36 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 1.14 0.00 0.00 0.83 0.00 0.00 18 V 8.85 4.87 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 0.72 0.00 0.00 0.83 0.00 0.00 19 R 9.00 3.95 0.00 1.76 1.93 0.00 3.08 0.00 0.00 3.13 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.53 0.00 20 D 7.53 4.51 0.00 2.56 2.43 0.00 0.00 0.00 0.00 0.00 0.00 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 I 9.06 3.52 1.46 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.20 -0.00 0.00 0.00 22 E 7.85 3.92 0.00 2.18 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 2.45 2.51 0.00 23 E 8.49 3.91 0.00 2.13 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 0.00 2.29 2.35 0.00 24 S 8.10 4.22 0.00 3.92 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 25 L 8.40 4.31 0.00 1.87 2.04 1.07 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.08 4.11 0.00 2.27 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.57 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 27 N 8.32 4.32 0.00 3.02 2.72 0.00 0.00 7.05 6.79 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 28 Y 8.44 3.81 0.00 2.87 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.46 4.41 1.68 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 0.00 0.00 30 E 8.56 3.91 0.00 2.20 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 2.58 2.49 0.00 31 F 8.09 3.77 0.00 2.76 2.71 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 32 F 8.25 4.30 0.00 3.33 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 33 G 7.69 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 0.00 0.00 0.00 34 V 7.98 4.63 2.25 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 0.98 0.00 0.00 1.32 0.00 0.00 35 E 8.64 4.12 0.00 1.99 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 2.34 2.33 0.00 36 K 8.77 3.91 0.00 1.76 1.78 0.00 1.78 0.00 0.00 1.87 0.00 0.00 3.18 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.58 7.81 37 P 0.00 4.56 0.00 1.93 1.64 0.00 3.68 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.44 0.00 38 Q 8.22 4.40 0.00 2.02 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.87 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 39 W 7.97 5.16 0.00 3.19 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 40 F 8.54 4.83 0.00 3.17 3.04 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 0.00 0.00 0.00 41 W 9.04 5.11 0.00 3.36 3.22 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 42 T 8.85 4.48 4.39 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 1.06 0.00 0.00 43 D 8.89 4.64 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 44 D 8.46 4.72 0.00 2.97 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 45 Y 8.89 4.12 0.00 3.17 3.12 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 0.00 0.00 0.00 46 S 7.80 4.43 0.00 4.15 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 47 K 8.20 4.21 0.00 1.84 1.88 0.00 1.80 0.00 0.00 1.79 0.00 0.00 3.01 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.40 1.35 7.81 48 A 7.78 4.53 1.54 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 49 H 7.81 3.37 0.00 3.17 3.23 0.00 5.68 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 8.04 4.29 4.74 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 1.42 0.00 0.00 51 K 9.25 5.01 0.00 1.74 1.76 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.68 7.81 52 F 9.46 5.38 0.00 2.94 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 53 N 9.85 4.09 0.00 2.38 2.57 0.00 0.00 7.16 7.48 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 54 G 8.41 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 55 R 7.52 4.54 0.00 1.84 1.95 0.00 3.07 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 56 P 0.00 5.07 0.00 1.94 1.98 0.00 3.69 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.17 0.00 57 T 8.32 4.65 4.37 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 1.43 0.00 0.00 58 K 8.70 4.34 0.00 1.80 1.86 0.00 1.87 0.00 0.00 1.73 0.00 0.00 2.75 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.29 1.33 7.81 59 A 7.85 4.44 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 60 R 9.62 5.16 0.00 1.83 2.05 0.00 3.09 0.00 0.00 2.99 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.90 0.00 61 A 8.97 5.09 0.66 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 0.00 0.00 62 K 8.30 3.96 0.00 0.79 0.74 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.30 0.21 7.81 63 L 8.64 5.00 0.00 0.27 0.45 0.59 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 64 A 7.43 4.70 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 F 8.61 5.39 0.00 2.85 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 66 F 9.18 4.77 0.00 2.77 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 67 E 8.98 4.82 0.00 1.80 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 2.17 2.32 0.00 68 L 8.91 4.65 0.00 1.45 1.42 0.06 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 69 G 7.89 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 70 P 0.00 4.41 0.00 2.25 2.32 0.00 3.80 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 71 L 7.87 5.14 0.00 1.77 1.66 0.92 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.85 5.01 0.00 2.10 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 73 L 8.87 4.92 0.00 1.51 1.34 0.83 0.73 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 74 E 8.97 4.80 0.00 2.10 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.51 0.00 75 L 8.34 4.72 0.00 1.36 1.32 0.93 0.28 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 76 I 8.58 4.34 1.50 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.29 -0.02 0.00 0.00 77 E 8.73 4.99 0.00 1.63 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 1.95 2.07 0.00 78 P 0.00 4.93 0.00 2.24 2.15 0.00 3.72 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 2.01 2.04 0.00 79 D 8.47 4.84 0.00 2.91 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 80 E 8.62 4.39 0.00 2.01 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 2.30 2.29 0.00 81 N 8.18 4.67 0.00 2.97 2.82 0.00 0.00 6.95 7.37 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 82 P 0.00 4.45 0.00 2.23 2.20 0.00 3.77 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 2.10 2.14 0.00 83 S 7.55 3.43 0.00 3.32 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 84 T 7.16 3.37 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 85 W 6.67 4.04 0.00 3.41 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 86 R 8.24 3.94 0.00 1.97 1.91 0.00 3.47 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.78 0.00 87 E 8.21 3.95 0.00 2.32 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 2.39 2.50 0.00 88 F 8.43 4.04 0.00 3.38 3.30 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 89 L 8.46 3.98 0.00 1.97 1.88 0.95 1.19 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 90 D 8.05 4.33 0.00 2.68 2.73 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 0.00 0.00 0.00 91 K 7.71 4.10 0.00 1.75 1.90 0.00 1.70 0.00 0.00 1.48 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.40 7.81 92 N 8.05 4.46 0.00 1.94 1.72 0.00 0.00 7.26 8.58 0.00 0.00 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 G 8.11 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 94 E 8.08 4.78 0.00 1.99 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 2.33 2.29 0.00 95 G 8.29 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 96 I 8.13 4.07 1.89 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 1.28 0.60 0.90 0.00 0.00 97 H 8.87 3.67 0.00 2.34 3.19 0.00 5.79 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 98 H 7.42 4.96 0.00 3.47 3.46 0.00 5.45 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 I 8.64 4.86 1.84 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.68 0.48 0.00 0.00 100 A 9.05 5.14 1.17 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 0.00 101 F 8.79 5.09 0.00 2.98 2.91 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 0.00 102 V 8.57 4.48 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 0.82 0.00 0.00 0.99 0.00 0.00 103 V 8.84 4.57 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 0.74 0.00 0.00 1.03 0.00 0.00 104 K 8.85 4.00 0.00 1.73 1.85 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.38 7.81 105 D 7.75 4.77 0.00 2.70 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 0.00 106 M 9.19 3.95 0.00 2.19 2.09 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.64 0.00 107 D 8.21 4.42 0.00 2.91 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 0.00 108 R 8.19 4.00 0.00 2.08 2.19 0.00 3.05 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 109 K 8.00 3.88 0.00 2.03 1.93 0.00 1.63 0.00 0.00 1.53 0.00 0.00 2.84 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.41 1.58 7.81 110 V 8.22 3.42 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 0.36 0.00 0.00 0.85 0.00 0.00 111 E 7.99 4.02 0.00 2.24 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 0.00 2.36 2.44 0.00 112 E 8.22 3.96 0.00 2.21 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 2.34 2.52 0.00 113 L 7.87 4.05 0.00 1.54 1.66 0.88 0.92 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 0.00 114 Y 7.92 4.42 0.00 3.20 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 0.00 115 R 8.22 4.03 0.00 2.01 2.03 0.00 3.18 0.00 0.00 3.25 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.87 0.00 116 K 7.64 4.47 0.00 1.94 1.85 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.64 7.81 117 G 8.26 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 M 8.09 4.64 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.77 0.00 119 K 9.11 4.87 0.00 1.86 1.67 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.54 7.81 120 V 8.62 4.49 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 0.93 0.00 0.00 0.88 0.00 0.00 121 I 9.22 4.33 1.97 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.24 1.01 0.00 0.00 122 Q 8.28 5.86 0.00 2.31 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.77 0.00 0.00 0.00 0.00 0.00 2.57 2.52 0.00 123 K 8.33 4.44 0.00 1.72 1.76 0.00 1.62 0.00 0.00 1.83 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.39 7.81 124 G 6.43 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 0.00 125 D 8.66 5.68 0.00 2.76 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 0.00 126 F 8.34 5.33 0.00 3.27 3.28 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 0.00 127 E 8.46 4.02 0.00 2.18 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 2.67 2.47 0.00 128 G 9.12 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 0.00 129 G 6.28 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 0.00 0.00 0.00 130 R 6.90 4.93 0.00 1.83 2.07 0.00 3.15 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.48 0.00 131 Y 8.73 5.55 0.00 3.23 3.28 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 0.00 132 A 8.80 4.74 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 0.00 133 Y 9.69 4.73 0.00 3.10 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 0.00 134 I 8.74 4.90 1.94 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 1.45 0.83 0.99 0.00 0.00 135 D 8.45 4.90 0.00 2.72 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 0.00 136 T 7.78 4.36 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 1.27 0.00 0.00 137 L 8.10 4.00 0.00 1.80 1.77 0.99 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 138 R 8.10 3.92 0.00 1.87 2.00 0.00 3.28 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 139 A 8.05 4.23 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 0.00 140 L 8.57 4.37 0.00 1.96 1.76 0.98 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 141 K 9.32 4.33 0.00 1.99 2.03 0.00 1.78 0.00 0.00 1.79 0.00 0.00 3.13 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.53 7.81 142 V 7.04 4.44 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 0.62 0.00 0.00 0.95 0.00 0.00 143 M 8.49 4.44 0.00 2.30 1.97 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.96 2.84 0.00 144 I 8.60 5.01 1.99 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.97 1.18 0.00 0.00 145 E 9.16 5.06 0.00 1.64 1.55 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 1.94 1.63 0.00 146 L 8.91 5.33 0.00 1.61 1.57 0.90 0.48 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 0.00 147 L 9.03 5.42 0.00 1.60 1.64 0.88 0.88 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 0.00 148 E 9.29 4.90 0.00 2.03 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 0.00 2.28 2.32 0.00 149 N 8.74 5.10 0.00 2.64 2.72 0.00 0.00 7.19 7.46 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 0.00 150 Y 7.80 4.50 0.00 2.98 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