NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3182 8.2644 123.5822 52.6123 20.0573 175.8144 2 T 4.3995 8.2297 112.3000 61.7756 69.8025 172.1987 3 K 5.3389 8.3422 121.4026 54.9124 37.2042 174.5502 4 A 5.2614 9.1246 123.9472 51.2066 23.4226 175.1440 5 V 5.0459 8.6102 116.6000 60.9285 35.2783 172.9510 6 A 4.8638 9.0475 123.4937 50.4369 22.7668 175.0703 7 V 4.4532 8.3976 122.3422 61.4141 33.5816 174.5132 8 L 4.8204 9.1912 129.3632 54.0808 43.0995 176.2227 9 K 4.8206 9.0085 122.2081 55.4322 37.0859 176.2496 10 G 4.9045 8.0093 109.3118 44.8122 0.0000 171.7814 11 D 4.5091 8.8031 117.8668 55.9715 41.7332 177.1084 12 G 4.2124 7.6151 109.3980 44.1834 0.0000 171.7102 13 P 4.3977 0.0000 0.0000 63.7990 32.1058 176.4892 14 V 4.1001 7.5896 120.6092 63.2691 31.8007 174.9158 15 Q 5.1961 7.6693 124.3457 55.5287 32.4567 173.6897 16 G 4.5637 7.5458 107.1187 46.4481 0.0000 171.1346 17 I 5.0188 7.5751 119.5637 59.3750 40.4935 174.9267 18 I 4.5893 8.6359 127.8091 59.4771 39.8629 174.5068 19 N 5.0029 8.5261 124.3108 51.3970 41.2551 173.8981 20 F 5.3678 8.8960 119.7462 55.8115 43.2973 173.7477 21 E 5.1519 9.7866 123.5214 54.7221 33.2721 173.6190 22 Q 4.9735 9.2732 128.6196 54.2171 30.2823 174.8406 23 K 4.1143 9.0731 128.5453 58.7109 32.7414 176.7754 24 E 4.7530 7.8695 117.4649 54.0140 32.1501 176.9962 25 S 4.2159 8.8014 117.8394 60.2913 63.1516 174.5590 26 N 4.9341 8.8228 115.1415 52.8500 40.2682 174.7611 27 G 3.8809 7.8303 107.8722 44.2296 0.0000 170.8264 28 P 4.6458 0.0000 0.0000 62.9514 32.3271 175.8230 29 V 4.6529 9.0562 121.0485 61.2522 33.8986 174.4973 30 K 4.9723 9.3521 128.0173 55.4484 34.1752 175.7681 31 V 4.8708 9.5017 125.1072 60.8180 34.3109 174.2564 32 W 6.0872 7.7938 123.5712 55.1793 32.2730 174.7766 33 G 4.0711 7.5438 105.5876 46.3206 0.0000 170.3586 34 S 5.2702 7.9000 113.1742 56.4689 66.0814 173.3890 35 I 4.9971 8.6639 126.7503 59.3277 40.7432 174.7129 36 K 4.7972 9.0715 125.4028 55.6238 36.1719 176.9577 37 G 3.8204 8.8749 106.5856 45.7209 0.0000 173.4014 38 L 4.5271 7.5614 119.8091 52.9309 43.3181 176.3411 39 T 4.3736 8.0888 110.7453 60.8532 69.7267 174.2601 40 E 4.1424 8.5360 124.4074 57.6078 30.5010 175.2102 41 G 3.7752 8.4955 110.2497 43.8342 0.0000 172.5647 42 L 4.6503 8.1946 118.7218 55.1597 42.7698 176.8104 43 H 4.9657 8.9969 119.2405 53.8806 33.1834 173.2654 44 G 4.1731 9.2361 111.3978 47.2518 0.0000 172.5265 45 F 5.4752 8.9539 124.9836 57.3787 42.2285 172.7886 46 H 5.0451 8.7909 122.3387 54.2692 34.0780 172.4865 47 V 4.5184 8.5818 120.3136 62.0511 33.1293 174.7273 48 H 5.0667 9.5990 126.2119 54.3648 30.7081 175.6084 49 E 3.6408 8.9430 123.0526 59.2153 29.3794 177.1596 50 F 4.9752 8.1465 118.0969 55.0679 41.5215 176.7032 51 G 4.2811 8.4309 111.2758 44.4861 0.0000 173.8400 52 D 4.7383 8.0380 118.9638 52.5966 42.1902 174.5983 53 N 5.1199 8.5182 125.4725 53.5031 39.2522 175.7768 54 T 3.9563 8.7553 109.7853 63.3402 69.6294 174.0847 55 A 4.6669 7.8587 124.9931 51.1565 19.8205 175.7833 56 G 4.0021 7.8633 112.2414 46.4589 0.0000 174.9264 57 C 4.4277 8.5740 115.0480 59.5414 39.6058 175.6866 58 T 3.8634 7.5208 117.6427 66.3390 67.8125 175.7079 59 S 4.5550 7.4866 112.2470 59.1469 63.5395 175.4235 60 A 4.4575 7.5336 126.3195 54.0772 18.3434 178.7467 61 G 4.1704 7.9539 104.7084 44.1148 0.0000 170.6241 62 P 4.6905 0.0000 0.0000 62.1165 33.9133 175.1562 63 H 4.5624 8.3925 116.3582 55.6126 29.6500 175.5759 64 F 4.2711 9.0404 125.1160 58.2503 40.2053 174.8593 65 N 5.1042 8.0217 126.0254 51.3093 38.7008 173.0069 66 P 4.1566 0.0000 0.0000 65.0915 31.9930 177.8952 67 L 4.3037 7.6334 116.7242 53.5988 42.1766 176.3547 68 S 3.5750 7.4079 114.1300 59.8696 60.6695 170.8542 69 R 4.5656 8.4067 118.1977 54.2916 33.2287 176.4343 70 K 4.4451 8.7419 118.1309 55.8639 33.7241 176.6131 71 H 4.1498 8.6435 123.0684 56.8564 30.5211 174.7700 72 G 4.0587 7.4467 109.7654 45.9476 0.0000 172.1839 73 G 4.1512 9.0973 109.1986 43.2902 0.0000 173.3074 74 P 4.3725 0.0000 0.0000 65.3817 31.1663 177.7612 75 K 4.1948 7.9008 116.3697 57.7575 32.5152 176.8703 76 D 4.5976 7.6480 119.1740 53.7058 41.4904 176.2811 77 E 3.9002 8.7000 123.5031 58.7382 29.9913 176.3455 78 E 4.2303 7.9418 121.3067 55.4639 28.8869 174.7281 79 R 4.8716 7.6036 120.2152 56.5227 32.1130 174.0876 80 H 4.6162 9.0383 116.1481 54.8895 29.6219 177.1978 81 V 3.4599 8.1869 122.1072 66.2176 31.4881 177.1646 82 G 3.9151 8.2251 104.7247 47.0512 0.0000 173.5150 83 D 4.9337 8.1068 121.1232 53.9722 40.0453 175.7783 84 L 4.5154 8.4707 121.2072 52.9706 42.6423 178.2756 85 G 4.0617 8.4825 109.6013 46.6058 0.0000 174.5424 86 N 5.6974 8.7028 121.1432 51.2710 42.3501 173.0373 87 V 4.4398 8.4218 112.5865 59.8943 35.9767 174.8518 88 T 5.0331 8.3023 119.1248 61.8548 71.0999 173.1200 89 A 4.7584 8.8263 129.0502 50.8010 20.9938 177.2341 90 D 5.0269 8.9438 122.2580 51.8248 41.3755 177.1502 91 K 3.8698 8.5771 117.3339 59.9086 32.2788 177.1428 92 D 4.5687 8.4860 117.7481 53.9128 41.0629 177.0254 93 G 4.2938 8.6072 108.4228 44.7914 0.0000 172.7039 94 V 4.7805 7.8620 119.2290 60.7465 34.1089 174.2321 95 A 5.1434 9.1395 130.0538 49.8780 20.6620 175.2126 96 D 5.2527 8.5114 123.4216 53.2510 39.9789 175.7778 97 V 3.5212 8.2082 122.3002 63.1708 33.0279 174.9208 98 S 4.8115 8.4358 122.5474 57.6173 63.7276 172.6349 99 I 4.8428 9.3517 127.6113 59.2018 41.5491 174.1241 100 E 5.1729 8.7876 124.7907 54.6235 32.4662 174.2193 101 D 4.9101 9.2727 125.5230 52.8739 44.9476 175.6783 102 S 4.7025 8.9396 119.3290 58.5405 63.8142 174.8762 103 V 4.0422 8.0846 121.0681 64.4746 32.0392 176.6118 104 I 4.1263 7.7587 111.0609 60.8682 38.4814 174.3573 105 S 4.6662 8.4384 114.7748 57.4498 65.5372 174.0862 106 L 4.6571 8.7683 122.0167 54.1065 41.5418 176.4517 107 S 4.4411 7.8997 112.2980 58.5107 66.1884 175.8623 108 G 3.8267 8.4677 108.7665 44.7895 0.0000 173.5208 109 D 4.4447 8.6698 117.1580 57.3053 40.9937 176.9673 110 H 5.0923 8.0272 114.6163 55.4642 29.0796 174.3016 111 S 4.9937 8.1427 114.1935 58.1077 62.7330 173.9851 112 I 3.9142 8.0350 118.9464 60.3630 38.0356 175.3391 113 I 3.7134 7.1632 123.2863 62.9062 37.4775 176.5836 114 G 3.8104 9.4150 113.5174 45.3801 0.0000 172.9117 115 R 4.8752 7.4063 119.1633 54.7868 33.6957 174.5192 116 T 4.9544 8.0381 115.4562 62.0433 71.2849 173.6909 117 L 4.7637 8.6964 128.9065 54.1364 43.9984 175.4113 118 V 5.0054 8.6916 125.8185 60.9354 35.2194 174.1892 119 V 5.0432 8.6376 126.7362 60.4480 33.7663 175.0811 120 H 5.1741 9.2020 122.4594 54.4759 30.1926 175.1860 121 E 4.1851 9.2782 121.4564 59.0318 30.0865 176.2354 122 K 4.8281 8.5312 117.3345 53.8431 36.5324 175.4460 123 A 4.5421 8.4015 121.7574 52.3631 19.7121 176.0298 124 D 4.9218 9.4075 121.0950 52.9559 41.7116 176.1991 125 D 4.5996 9.2709 124.9678 53.0961 39.5939 176.5779 126 L 3.4693 9.7189 118.4667 56.1478 39.7041 175.4006 127 G 3.9920 8.8816 104.4136 46.0253 0.0000 174.8341 128 K 4.5322 8.1283 117.0703 56.0100 32.2360 177.6480 129 G 3.7185 7.7416 108.6227 45.2055 0.0000 175.9576 130 G 3.9148 8.4137 107.4454 45.3212 0.0000 172.2914 131 N 5.0810 7.5019 115.2673 49.9709 40.1624 174.6262 132 E 4.0352 8.6187 118.0973 59.3501 29.5650 178.1749 133 E 3.9297 8.1304 119.0406 59.1661 29.4800 178.5021 134 S 4.1902 8.7702 114.0353 61.3232 62.3854 175.3993 135 T 4.3448 7.6350 109.5540 62.2322 68.4931 175.3592 136 K 4.3084 7.6899 119.5543 57.8874 34.2316 176.6865 137 T 4.0893 8.2338 106.3087 60.1634 70.2020 175.4353 138 G 3.9700 8.0917 110.3407 45.1249 0.0000 173.2435 139 N 4.3221 7.8036 114.3341 54.2231 36.5785 174.9574 140 A 4.4679 7.0019 118.7743 51.6355 19.2700 180.0175 141 G 3.6062 7.9096 104.6742 44.4594 0.0000 173.4655 142 S 4.3917 8.3174 113.6488 58.6252 64.6325 173.9838 143 R 4.4587 8.3447 119.9065 55.1902 29.9243 176.5105 144 L 4.3160 8.7295 125.8405 57.4035 43.0353 177.1840 145 A 5.0891 7.7601 117.8521 51.3312 22.7666 174.0943 146 C 5.6710 8.4007 113.7438 55.5472 46.5895 172.8174 147 G 4.7150 8.0259 102.9921 46.0019 0.0000 172.8801 148 V 4.2369 8.3710 123.0268 62.4561 32.7503 175.5710 149 I 4.0907 9.0752 129.6364 61.1131 37.9082 175.3395 150 G 4.4053 8.8442 114.7099 43.8427 0.0000 172.0110 151 I 4.3424 8.2662 121.4336 61.2637 37.7664 175.2615 152 A 4.9624 8.6660 127.6477 50.0198 22.8555 176.0571 153 Q 4.1269 8.4172 115.4127 56.5880 28.9151 175.3570 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 A 8.26 4.32 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 T 8.23 4.40 4.27 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 1.25 0.00 0.00 3 K 8.34 5.34 0.00 1.90 1.69 0.00 1.92 0.00 0.00 2.07 0.00 0.00 2.96 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.50 1.44 7.81 4 A 9.12 5.26 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 5 V 8.61 5.05 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.95 0.00 0.00 6 A 9.05 4.86 1.31 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 0.00 0.00 7 V 8.40 4.45 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 0.98 0.00 0.00 0.92 0.00 0.00 8 L 9.19 4.82 0.00 1.77 1.59 1.03 0.63 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 9 K 9.01 4.82 0.00 1.66 1.62 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.39 7.81 10 G 8.01 4.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 D 8.80 4.51 0.00 2.68 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 12 G 7.62 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.40 0.00 2.18 2.17 0.00 3.77 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 2.10 1.94 0.00 14 V 7.59 4.10 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 0.79 0.00 0.00 0.97 0.00 0.00 15 Q 7.67 5.20 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.61 0.00 0.00 0.00 0.00 0.00 2.46 2.15 0.00 16 G 7.55 4.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 I 7.58 5.02 1.81 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 1.32 1.13 0.82 0.00 0.00 18 I 8.64 4.59 1.82 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.17 0.41 0.00 0.00 19 N 8.53 5.00 0.00 1.44 1.54 0.00 0.00 6.41 8.56 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 20 F 8.90 5.37 0.00 2.82 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 21 E 9.79 5.15 0.00 2.44 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 0.00 2.32 2.56 0.00 22 Q 9.27 4.97 0.00 2.10 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.72 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 23 K 9.07 4.11 0.00 1.78 1.85 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.44 1.49 7.81 24 E 7.87 4.75 0.00 2.01 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 0.00 2.29 2.20 0.00 25 S 8.80 4.22 0.00 3.98 4.04 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 26 N 8.82 4.93 0.00 2.74 2.91 0.00 0.00 6.86 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 27 G 7.83 3.88 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 0.00 0.00 0.00 28 P 0.00 4.65 0.00 2.13 2.11 0.00 3.75 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 29 V 9.06 4.65 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 1.23 0.00 0.00 1.08 0.00 0.00 30 K 9.35 4.97 0.00 1.90 1.84 0.00 1.63 0.00 0.00 1.49 0.00 0.00 2.78 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.44 7.81 31 V 9.50 4.87 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 0.57 0.00 0.00 1.07 0.00 0.00 32 W 7.79 6.09 0.00 3.48 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 33 G 7.54 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 34 S 7.90 5.27 0.00 3.87 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 35 I 8.66 5.00 1.81 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 0.67 0.95 0.00 0.00 36 K 9.07 4.80 0.00 1.76 1.87 0.00 1.34 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.34 7.81 37 G 8.87 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 38 L 7.56 4.53 0.00 1.79 1.41 0.82 0.48 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 39 T 8.09 4.37 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 1.24 0.00 0.00 40 E 8.54 4.14 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 2.30 2.45 0.00 41 G 8.50 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 42 L 8.19 4.65 0.00 1.51 1.59 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.00 4.97 0.00 3.05 3.29 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 9.24 4.17 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 0.00 45 F 8.95 5.48 0.00 2.99 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 46 H 8.79 5.05 0.00 3.09 3.11 0.00 5.85 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.58 4.52 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 0.90 0.00 0.00 0.88 0.00 0.00 48 H 9.60 5.07 0.00 3.02 3.43 0.00 5.71 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.94 3.64 0.00 1.66 1.16 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 1.47 2.05 0.00 50 F 8.15 4.98 0.00 3.13 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 51 G 8.43 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 0.00 0.00 0.00 0.00 52 D 8.04 4.74 0.00 2.62 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 53 N 8.52 5.12 0.00 2.69 2.74 0.00 0.00 7.26 7.70 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 54 T 8.76 3.96 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 1.24 0.00 0.00 55 A 7.86 4.67 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 G 7.86 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.57 4.43 0.00 2.96 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 58 T 7.52 3.86 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 1.23 0.00 0.00 59 S 7.49 4.56 0.00 4.16 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 60 A 7.53 4.46 1.41 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 0.00 0.00 61 G 7.95 4.17 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 0.00 62 P 0.00 4.69 0.00 2.05 2.21 0.00 3.70 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 1.97 1.99 0.00 63 H 8.39 4.56 0.00 2.86 3.20 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.04 4.27 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 65 N 8.02 5.10 0.00 2.55 2.43 0.00 0.00 6.91 7.71 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 66 P 0.00 4.16 0.00 2.05 1.89 0.00 2.97 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.06 0.00 67 L 7.63 4.30 0.00 1.55 1.66 0.87 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.41 3.57 0.00 3.94 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 69 R 8.41 4.57 0.00 1.87 1.99 0.00 3.25 0.00 0.00 3.40 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 70 K 8.74 4.45 0.00 1.63 1.69 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.79 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.51 7.81 71 H 8.64 4.15 0.00 3.08 3.25 0.00 5.96 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 7.45 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 G 9.10 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 74 P 0.00 4.37 0.00 2.23 2.39 0.00 3.79 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.05 0.00 75 K 7.90 4.19 0.00 1.77 1.91 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.47 7.81 76 D 7.65 4.60 0.00 2.79 2.64 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 77 E 8.70 3.90 0.00 1.92 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 78 E 7.94 4.23 0.00 2.06 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 0.00 2.32 2.30 0.00 79 R 7.60 4.87 0.00 1.95 1.77 0.00 2.70 0.00 0.00 3.85 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.57 0.00 80 H 9.04 4.62 0.00 3.49 3.36 0.00 5.64 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.19 3.46 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.49 0.00 0.00 82 G 8.23 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 D 8.11 4.93 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 84 L 8.47 4.52 0.00 1.93 1.94 0.98 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.48 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 N 8.70 5.70 0.00 2.59 2.71 0.00 0.00 6.53 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 87 V 8.42 4.44 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 -0.25 0.00 0.00 0.71 0.00 0.00 88 T 8.30 5.03 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 1.20 0.00 0.00 89 A 8.83 4.76 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 90 D 8.94 5.03 0.00 2.81 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 8.58 3.87 0.00 1.88 2.00 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.41 1.47 7.81 92 D 8.49 4.57 0.00 2.82 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 93 G 8.61 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 V 7.86 4.78 2.35 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 0.82 0.00 0.00 0.92 0.00 0.00 95 A 9.14 5.14 1.15 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 96 D 8.51 5.25 0.00 2.56 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 97 V 8.21 3.52 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 0.67 0.00 0.00 0.59 0.00 0.00 98 S 8.44 4.81 0.00 3.89 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 I 9.35 4.84 1.98 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 1.15 0.88 1.02 0.00 0.00 100 E 8.79 5.17 0.00 1.96 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 0.00 2.22 2.33 0.00 101 D 9.27 4.91 0.00 2.80 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 0.00 102 S 8.94 4.70 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 0.00 103 V 8.08 4.04 2.26 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 0.77 0.00 0.00 0.94 0.00 0.00 104 I 7.76 4.13 1.94 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 1.60 0.81 1.05 0.00 0.00 105 S 8.44 4.67 0.00 3.82 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.77 4.66 0.00 1.93 1.63 1.00 0.96 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 0.00 107 S 7.90 4.44 0.00 3.91 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 0.00 108 G 8.47 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 0.00 0.00 0.00 0.00 109 D 8.67 4.44 0.00 2.61 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 0.00 110 H 8.03 5.09 0.00 3.23 3.31 0.00 5.64 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 S 8.14 4.99 0.00 3.94 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 0.00 112 I 8.03 3.91 1.60 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.16 0.91 0.00 0.00 113 I 7.16 3.71 1.78 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.81 0.84 0.00 0.00 114 G 9.42 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 R 7.41 4.88 0.00 1.59 1.83 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.34 0.00 116 T 8.04 4.95 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 1.17 0.00 0.00 117 L 8.70 4.76 0.00 1.78 1.52 0.43 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.69 5.01 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 0.72 0.00 0.00 0.71 0.00 0.00 119 V 8.64 5.04 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 0.74 0.00 0.00 1.01 0.00 0.00 120 H 9.20 5.17 0.00 3.19 3.59 0.00 5.66 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.28 4.19 0.00 2.08 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 0.00 2.37 2.34 0.00 122 K 8.53 4.83 0.00 1.78 1.69 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.85 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.36 1.38 7.81 123 A 8.40 4.54 1.23 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 0.00 0.00 0.00 0.00 0.00 0.00 124 D 9.41 4.92 0.00 2.77 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 0.00 125 D 9.27 4.60 0.00 2.89 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 0.00 126 L 9.72 3.47 0.00 1.76 1.78 0.94 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.88 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 0.00 0.00 0.00 128 K 8.13 4.53 0.00 1.87 1.81 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.53 7.81 129 G 7.74 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 G 8.41 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 0.00 131 N 7.50 5.08 0.00 2.77 2.79 0.00 0.00 6.06 7.66 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 0.00 132 E 8.62 4.04 0.00 2.05 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 2.37 2.36 0.00 133 E 8.13 3.93 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 134 S 8.77 4.19 0.00 4.06 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 0.00 135 T 7.63 4.34 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 136 K 7.69 4.31 0.00 1.79 1.79 0.00 1.67 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.31 1.60 7.81 137 T 8.23 4.09 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 1.19 0.00 0.00 138 G 8.09 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 0.00 139 N 7.80 4.32 0.00 2.92 2.91 0.00 0.00 6.87 7.16 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 0.00 140 A 7.00 4.47 1.23 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 0.00 0.00 0.00 0.00 0.00 0.00 141 G 7.91 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 S 8.32 4.39 0.00 3.96 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 0.00 143 R 8.34 4.46 0.00 1.68 1.84 0.00 3.26 0.00 0.00 3.14 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.67 0.00 144 L 8.73 4.32 0.00 1.73 1.70 0.99 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.76 5.09 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 0.00 146 C 8.40 5.67 0.00 2.99 3.10 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 0.00 147 G 8.03 4.71 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 0.00 148 V 8.37 4.24 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 0.76 0.00 0.00 0.94 0.00 0.00 149 I 9.08 4.09 1.81 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.34 0.43 0.00 0.00 150 G 8.84 4.41 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 0.00 0.00 0.00 151 I 8.27 4.34 1.86 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 1.25 0.54 0.91 0.00 0.00 152 A 8.67 4.96 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 0.00 153 Q 8.42 4.13 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.60 0.00 0.00 0.00 0.00 0.00 2.22 2.33 0.00