NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1948 8.3144 121.7901 55.6630 33.5419 175.1009 2 E 3.7565 8.7385 127.3465 54.6956 30.0072 174.9696 3 S 4.4938 8.9413 123.2459 58.0163 66.2448 174.5244 4 A 3.9869 8.5396 124.4240 55.2609 18.1527 179.9975 5 A 3.9541 7.9917 118.5788 55.3928 18.5275 179.6125 6 A 4.0092 8.1935 119.3304 55.0606 18.3266 179.7896 7 K 4.1113 8.4118 119.9529 59.0177 32.2428 178.8218 8 F 4.0408 8.4732 121.0103 61.3738 39.3321 176.9115 9 E 4.0215 8.4054 118.2503 59.3938 29.0273 179.4383 10 R 3.8017 7.9318 117.7388 59.6554 30.3083 178.3752 11 Q 4.0024 8.0683 116.7482 58.1321 28.7895 176.5242 12 H 4.6607 7.8536 113.0251 54.7842 30.8269 172.9263 13 M 4.5815 7.7155 119.8612 53.6905 33.5495 176.3447 14 D 4.7129 8.1693 122.5238 52.4730 41.5778 173.9443 15 S 4.2217 8.1310 117.3130 56.7919 63.8613 174.4093 16 G 4.3680 8.0143 115.1032 44.8538 0.0000 172.0408 17 N 4.5597 8.2392 117.4917 55.2979 39.7285 176.4184 18 S 4.7300 7.5784 112.6929 55.9878 63.5439 172.5919 19 P 4.2435 0.0000 0.0000 65.5005 31.5098 178.2445 20 S 4.4796 7.8413 110.2153 57.7078 63.8928 174.0664 21 S 4.2074 7.7191 117.2614 58.6392 62.8387 175.2491 22 S 4.1966 8.7476 120.3500 61.3131 62.8487 176.5482 23 S 4.2544 7.7963 114.5398 60.5069 62.8628 174.5660 24 N 4.7280 8.2074 117.8037 53.5657 39.2090 176.0669 25 Y 4.0244 8.1556 120.7237 61.1773 38.8008 177.5240 26 C 4.1521 8.4399 117.1032 59.9533 37.1984 175.6895 27 N 4.4203 8.2771 117.5554 56.5723 38.1136 177.2932 28 L 3.9350 7.7668 120.0118 58.0292 41.7581 179.5492 29 M 3.6823 7.9347 118.9869 58.4522 31.6732 178.7466 30 M 4.1524 8.2193 119.2664 58.2935 31.9648 178.4726 31 C 4.1518 7.6860 120.0516 62.1305 31.6497 175.0432 32 C 3.9791 8.0528 119.7095 62.5970 31.1764 174.4766 33 R 4.3286 8.3919 116.0324 55.8433 29.4429 176.2911 34 K 3.8845 7.7596 115.8080 58.5525 29.7916 176.2330 35 M 4.6848 8.4170 115.4673 55.3801 32.1339 177.2074 36 T 5.0737 7.6630 107.0123 60.2704 69.6268 172.6536 37 Q 4.7495 8.3807 121.2485 56.7551 29.8442 174.3002 38 G 4.1450 10.9507 115.3607 44.9805 0.0000 173.0264 39 K 3.9129 6.9440 116.5592 55.0763 35.2961 175.1591 40 C 4.7709 8.5905 117.5078 55.5150 40.5010 173.9595 41 K 4.0700 8.6840 127.0715 56.4155 32.4356 174.8312 42 P 4.7195 0.0000 0.0000 65.1285 32.5458 176.6177 43 V 5.0600 7.5861 117.3477 61.2947 34.7415 174.2461 44 N 4.7432 9.0787 124.5128 52.7016 42.8064 172.8624 45 T 4.7970 7.7611 121.4402 61.6267 71.1544 173.3266 46 F 4.7334 9.0212 124.7988 55.6498 41.8811 174.6526 47 V 4.4828 8.3823 122.1239 61.3161 33.2245 174.6861 48 H 4.9683 9.1566 124.6002 55.8182 29.3092 174.8279 49 E 4.6015 8.0143 118.3039 54.4273 31.6786 176.4623 50 S 4.3207 8.2209 115.1035 58.3354 65.0132 174.9284 51 L 3.9462 8.5856 124.5971 58.4060 41.7610 179.2305 52 A 4.0167 7.9862 120.1808 55.3587 18.1394 179.1987 53 D 4.2952 7.7749 115.8386 57.4171 41.2595 178.9360 54 V 3.7615 7.8268 118.7844 65.9313 31.5694 178.2204 55 K 3.9255 8.6638 118.4177 59.4300 31.7683 179.0461 56 A 4.0015 8.2293 121.0264 55.0307 18.0959 179.7156 57 V 3.6830 7.6013 116.6709 66.2891 31.3156 177.1020 58 C 3.6342 7.9116 114.8269 57.9661 39.8767 174.2038 59 S 4.6660 7.6607 114.4830 57.8776 63.8108 174.8429 60 Q 4.5312 7.7805 121.6451 56.1613 27.8726 176.9735 61 K 4.2333 8.5259 128.7239 56.7623 32.9823 176.8842 62 K 4.1366 8.7314 127.7989 57.0883 31.3390 176.9546 63 V 4.5189 8.2077 116.9038 59.5491 36.4412 175.2367 64 T 4.1248 8.3402 119.6264 63.3931 69.2666 175.7360 65 C 4.6246 8.6576 123.2082 56.5346 40.9549 174.8800 66 K 3.7172 9.2758 122.9338 59.7426 31.7136 177.7983 67 N 4.6052 8.1126 113.0043 52.6307 37.3958 175.9610 68 G 3.9424 8.1038 108.0780 45.6968 0.0000 174.4432 69 Q 4.2133 8.3833 119.3320 56.3366 29.2018 176.4264 70 T 4.6694 8.3113 108.6697 61.5056 69.2248 173.8246 71 N 5.0394 7.9819 118.3457 53.6374 38.3234 174.4039 72 C 5.4508 7.5122 116.2650 57.1602 44.6357 172.7284 73 Y 5.2158 8.6678 117.4083 56.8013 42.2519 173.7049 74 Q 5.1773 9.6576 126.2556 53.9919 31.5271 174.9043 75 S 4.5897 8.9727 122.1616 58.2750 63.1209 174.7869 76 K 4.1304 9.9744 123.3755 59.2203 32.6461 177.0753 77 S 5.0438 7.6297 113.2572 56.0561 66.0215 174.3634 78 T 4.0693 8.2793 111.4586 62.2683 69.5754 173.4211 79 M 5.0390 8.9600 121.8799 53.4818 36.8354 175.0087 80 R 4.5262 9.4972 121.6337 56.0260 31.3055 175.8461 81 I 5.1174 8.8850 117.1574 59.3840 41.9625 174.2386 82 T 5.1574 8.9308 119.4932 62.0080 71.7881 172.8591 83 D 5.0360 9.2622 126.9002 53.3601 43.1451 174.7775 84 C 5.5988 9.3801 120.8258 55.3386 38.2369 173.1612 85 R 5.3531 8.8616 122.7098 53.9534 33.4727 174.9830 86 E 4.6559 9.1347 123.4641 56.3816 30.0759 177.6173 87 T 4.2678 8.2818 114.1263 60.4547 70.3859 174.9338 88 G 3.7584 8.6134 110.2319 48.8871 0.0000 175.1175 89 S 4.1665 8.1521 115.1209 61.0901 62.9986 175.3292 90 S 4.0080 7.2989 113.1592 58.7602 62.5184 173.5268 91 K 4.4885 8.4810 126.4812 54.9953 35.4143 174.3250 92 Y 4.3254 8.6907 127.5484 57.6539 39.1491 173.6439 93 P 3.2999 0.0000 0.0000 62.5237 31.8990 176.8114 94 N 4.6442 7.9064 119.8696 52.3689 37.0105 172.3177 95 C 4.6106 8.0424 116.8980 56.2973 38.4738 173.1399 96 A 5.0881 8.5630 126.0544 50.2911 21.7225 174.4093 97 Y 5.0965 9.2055 118.9357 55.9853 42.0969 174.9514 98 K 4.4757 9.4538 124.5712 55.8052 33.9198 175.2658 99 T 5.0896 8.5862 124.1670 62.6879 70.1859 174.3170 100 T 4.6641 8.8518 122.2942 61.9722 72.5964 172.7348 101 Q 5.0482 8.7816 125.2880 54.6722 30.5387 175.3258 102 V 4.5993 8.7331 115.7558 59.9901 37.1848 173.8427 103 E 5.1636 8.7221 120.7500 54.9027 31.4709 175.8368 104 K 4.7544 8.7596 123.0691 54.6920 37.4744 175.7235 105 H 4.7102 8.9736 119.7607 56.0795 29.8942 174.7944 106 I 4.8627 8.7522 115.8460 59.3385 40.6872 174.3708 107 I 4.9476 8.3120 124.4712 59.7128 40.1293 175.0992 108 V 4.7203 8.6212 119.2462 59.2626 36.0567 174.6096 109 A 5.0185 8.8318 125.0905 51.6146 20.2045 175.7579 110 C 5.4599 9.2405 119.5538 55.3869 44.3107 173.6068 111 G 4.0174 9.1993 109.0487 46.3018 0.0000 172.8944 112 G 4.2153 9.2299 107.5427 44.5467 0.0000 172.3183 113 K 4.6792 8.0702 116.8202 53.7867 34.8145 175.0326 114 P 4.2961 0.0000 0.0000 62.3936 31.8683 176.1607 115 S 4.6406 8.3310 115.7829 58.1426 62.7055 173.5103 116 V 4.6173 8.6290 119.7614 58.4606 36.3476 173.3395 117 P 4.8084 0.0000 0.0000 63.4140 31.0683 176.9056 118 V 4.4995 9.2041 116.2087 61.3589 34.0773 175.3007 119 H 4.8769 8.0077 119.4230 54.6947 33.5198 171.6913 120 F 4.4752 8.4975 127.5045 57.3624 39.5252 174.5131 121 D 4.6165 8.3254 126.7678 56.1228 41.7975 175.8717 122 A 4.6519 6.6458 117.1283 51.4160 22.3832 174.7098 123 S 5.3196 8.9029 113.4621 56.5307 66.4660 174.5881 124 V 4.1441 8.7716 120.4006 62.0970 31.5472 175.0968 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 K 8.31 4.19 0.00 1.72 1.80 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.51 7.81 2 E 8.74 3.76 0.00 2.13 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 2.40 2.37 0.00 3 S 8.94 4.49 0.00 4.10 3.99 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 4 A 8.54 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 5 A 7.99 3.95 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 A 8.19 4.01 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 7 K 8.41 4.11 0.00 2.01 2.05 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.47 1.31 7.81 8 F 8.47 4.04 0.00 3.18 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 9 E 8.41 4.02 0.00 2.26 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 2.49 2.66 0.00 10 R 7.93 3.80 0.00 1.77 2.06 0.00 3.23 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 11 Q 8.07 4.00 0.00 1.56 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.48 0.00 0.00 0.00 0.00 0.00 2.27 2.48 0.00 12 H 7.85 4.66 0.00 1.88 2.74 0.00 5.62 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.72 4.58 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.69 0.00 14 D 8.17 4.71 0.00 2.52 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 15 S 8.13 4.22 0.00 3.91 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 16 G 8.01 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 0.00 0.00 0.00 0.00 17 N 8.24 4.56 0.00 2.73 2.89 0.00 0.00 6.69 7.57 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 18 S 7.58 4.73 0.00 3.82 3.74 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 19 P 0.00 4.24 0.00 2.17 2.19 0.00 3.84 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 1.99 1.96 0.00 20 S 7.84 4.48 0.00 4.00 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 21 S 7.72 4.21 0.00 3.93 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 22 S 8.75 4.20 0.00 4.01 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 S 7.80 4.25 0.00 4.00 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 24 N 8.21 4.73 0.00 3.05 2.89 0.00 0.00 6.44 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 25 Y 8.16 4.02 0.00 3.09 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 26 C 8.44 4.15 0.00 3.16 3.07 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 27 N 8.28 4.42 0.00 2.91 2.93 0.00 0.00 7.14 6.74 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 28 L 7.77 3.93 0.00 1.64 1.56 0.88 0.97 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 29 M 7.93 3.68 0.00 0.77 1.21 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.47 0.00 30 M 8.22 4.15 0.00 1.67 1.83 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.35 0.00 31 C 7.69 4.15 0.00 3.03 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 C 8.05 3.98 0.00 2.86 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 33 R 8.39 4.33 0.00 1.98 2.02 0.00 3.56 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.89 0.00 34 K 7.76 3.88 0.00 1.95 1.94 0.00 1.69 0.00 0.00 1.87 0.00 0.00 3.17 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.37 1.55 7.81 35 M 8.42 4.68 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.41 0.00 36 T 7.66 5.07 4.42 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 1.41 0.00 0.00 37 Q 8.38 4.75 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.63 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 38 G 10.95 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 39 K 6.94 3.91 0.00 1.71 1.64 0.00 1.43 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.36 7.81 40 C 8.59 4.77 0.00 3.11 3.17 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 41 K 8.68 4.07 0.00 1.84 1.80 0.00 1.78 0.00 0.00 1.63 0.00 0.00 3.19 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.62 1.44 7.81 42 P 0.00 4.72 0.00 2.15 2.10 0.00 3.63 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 2.10 0.00 43 V 7.59 5.06 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 0.79 0.00 0.00 0.97 0.00 0.00 44 N 9.08 4.74 0.00 2.66 2.26 0.00 0.00 6.73 6.81 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 45 T 7.76 4.80 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 0.85 0.00 0.00 46 F 9.02 4.73 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 47 V 8.38 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 0.87 0.00 0.00 1.03 0.00 0.00 48 H 9.16 4.97 0.00 3.14 3.26 0.00 5.69 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.01 4.60 0.00 1.98 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 2.27 2.25 0.00 50 S 8.22 4.32 0.00 4.05 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 51 L 8.59 3.95 0.00 1.79 1.73 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 52 A 7.99 4.02 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 53 D 7.77 4.30 0.00 2.87 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 54 V 7.83 3.76 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 1.08 0.00 0.00 1.00 0.00 0.00 55 K 8.66 3.93 0.00 1.91 1.82 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.62 7.81 56 A 8.23 4.00 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 57 V 7.60 3.68 2.20 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 1.15 0.00 0.00 1.09 0.00 0.00 58 C 7.91 3.63 0.00 2.89 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 59 S 7.66 4.67 0.00 3.87 3.79 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 60 Q 7.78 4.53 0.00 2.22 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.99 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 61 K 8.53 4.23 0.00 1.87 1.88 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.78 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.41 1.41 7.81 62 K 8.73 4.14 0.00 1.58 1.55 0.00 1.65 0.00 0.00 1.51 0.00 0.00 2.73 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.69 1.42 7.81 63 V 8.21 4.52 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 0.75 0.00 0.00 0.85 0.00 0.00 64 T 8.34 4.12 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 65 C 8.66 4.62 0.00 3.14 3.13 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 0.00 66 K 9.28 3.72 0.00 1.70 1.90 0.00 1.91 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.51 7.81 67 N 8.11 4.61 0.00 2.80 2.89 0.00 0.00 6.16 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 68 G 8.10 3.94 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 0.00 0.00 0.00 69 Q 8.38 4.21 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 70 T 8.31 4.67 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 71 N 7.98 5.04 0.00 3.00 3.05 0.00 0.00 6.05 7.68 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 72 C 7.51 5.45 0.00 3.15 2.94 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 73 Y 8.67 5.22 0.00 2.92 2.93 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 74 Q 9.66 5.18 0.00 1.99 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 75 S 8.97 4.59 0.00 3.91 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 76 K 9.97 4.13 0.00 1.87 2.01 0.00 1.57 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.64 1.44 7.81 77 S 7.63 5.04 0.00 3.75 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 78 T 8.28 4.07 4.18 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 1.00 0.00 0.00 79 M 8.96 5.04 0.00 1.93 1.99 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 80 R 9.50 4.53 0.00 1.84 1.90 0.00 3.06 0.00 0.00 3.21 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.58 0.00 81 I 8.89 5.12 1.95 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 1.42 0.97 1.05 0.00 0.00 82 T 8.93 5.16 4.47 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 1.36 0.00 0.00 83 D 9.26 5.04 0.00 2.60 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 84 C 9.38 5.60 0.00 2.82 2.82 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 85 R 8.86 5.35 0.00 1.81 1.84 0.00 3.18 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 1.59 1.64 0.00 86 E 9.13 4.66 0.00 1.80 1.78 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 1.87 1.90 0.00 87 T 8.28 4.27 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 1.20 0.00 0.00 88 G 8.61 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 89 S 8.15 4.17 0.00 3.84 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 90 S 7.30 4.01 0.00 3.80 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 91 K 8.48 4.49 0.00 1.78 1.57 0.00 1.72 0.00 0.00 1.58 0.00 0.00 2.87 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.38 1.40 7.81 92 Y 8.69 4.33 0.00 2.95 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 P 0.00 3.30 0.00 1.72 0.92 0.00 3.64 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 94 N 7.91 4.64 0.00 2.89 2.75 0.00 0.00 7.04 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 95 C 8.04 4.61 0.00 3.12 3.07 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 96 A 8.56 5.09 1.13 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 0.00 0.00 0.00 97 Y 9.21 5.10 0.00 2.99 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 98 K 9.45 4.48 0.00 1.80 1.74 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.59 7.81 99 T 8.59 5.09 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 1.32 0.00 0.00 100 T 8.85 4.66 4.28 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 1.23 0.00 0.00 101 Q 8.78 5.05 0.00 1.90 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.80 0.00 0.00 0.00 0.00 0.00 2.20 2.31 0.00 102 V 8.73 4.60 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 0.73 0.00 0.00 0.96 0.00 0.00 103 E 8.72 5.16 0.00 1.81 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 2.29 0.00 104 K 8.76 4.75 0.00 1.74 1.85 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.44 7.81 105 H 8.97 4.71 0.00 3.11 3.23 0.00 5.58 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.75 4.86 1.78 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.21 1.11 0.00 0.00 107 I 8.31 4.95 1.70 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 1.17 0.64 0.83 0.00 0.00 108 V 8.62 4.72 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 0.66 0.00 0.00 0.94 0.00 0.00 109 A 8.83 5.02 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 0.00 110 C 9.24 5.46 0.00 2.86 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 0.00 111 G 9.20 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 0.00 112 G 9.23 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 0.00 113 K 8.07 4.68 0.00 1.69 1.69 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.44 7.81 114 P 0.00 4.30 0.00 2.02 1.97 0.00 3.67 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 2.02 2.07 0.00 115 S 8.33 4.64 0.00 3.85 3.71 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 0.00 116 V 8.63 4.62 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 0.71 0.00 0.00 0.98 0.00 0.00 117 P 0.00 4.81 0.00 1.96 2.02 0.00 3.61 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 118 V 9.20 4.50 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 0.73 0.00 0.00 1.01 0.00 0.00 119 H 8.01 4.88 0.00 3.23 3.10 0.00 5.85 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.50 4.48 0.00 3.03 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 8.33 4.62 0.00 2.64 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 0.00 122 A 6.65 4.65 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 0.00 123 S 8.90 5.32 0.00 4.03 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 0.00 124 V 8.77 4.14 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 0.71 0.00 0.00 0.94 0.00 0.00