NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4509 8.3049 120.3262 54.6146 33.4369 175.0522 1 I 3.6505 8.1087 122.0039 61.5726 37.6427 174.4258 2 Q 4.8616 9.2827 123.9441 54.6853 33.4952 173.9648 3 R 4.8039 9.1909 123.5302 54.4982 33.4084 175.5422 4 T 4.9823 8.8465 120.0240 62.0849 69.4588 172.6735 5 P 4.8464 0.0000 0.0000 62.8224 32.4589 175.9633 6 K 4.5264 9.2122 122.7765 55.9706 33.8823 175.8620 7 I 5.2052 8.2639 122.9225 59.7963 40.8353 174.8242 8 Q 4.9306 9.4671 124.8139 54.0744 32.9977 174.4164 9 V 5.0822 8.5656 122.6059 60.2666 33.8729 174.1669 10 Y 5.2382 8.4027 121.7788 56.6134 41.7544 172.9812 11 S 5.0608 9.0045 114.2040 56.7943 64.6982 174.2639 12 R 4.1611 9.0219 123.3312 59.3807 30.1385 176.3810 13 H 5.1046 8.4985 113.3457 52.7679 31.8203 172.0546 14 P 4.4350 0.0000 0.0000 62.4454 31.7325 176.4678 15 A 4.2994 8.7338 125.8333 52.1614 19.1668 176.7372 16 E 4.6675 8.5519 121.6912 54.0231 32.7897 175.1446 17 N 4.6906 8.8448 121.5168 55.1734 38.9370 175.4821 18 G 3.9509 8.9784 111.8491 44.9289 0.0000 173.1826 19 K 4.5098 7.5114 119.3706 54.0511 33.9024 176.6172 20 S 4.2634 8.2610 117.3146 58.3843 63.9931 173.1578 21 N 4.8567 8.1230 118.4972 53.4668 42.7292 172.3279 22 F 5.2478 8.8828 115.1970 55.8764 43.5237 173.6503 23 L 4.0360 8.6545 125.7455 53.6221 43.2462 174.8835 24 N 5.3497 9.1056 124.5339 51.5124 42.0412 173.1868 25 C 5.3034 9.2434 121.7992 55.2360 47.9899 171.8011 26 Y 5.5360 9.2591 128.8798 56.4617 40.4333 174.5135 27 V 5.4754 8.8284 119.8095 58.7913 34.9497 174.9441 28 S 4.9495 8.5489 118.1923 57.7855 66.7302 174.4990 29 G 4.4354 8.5131 107.5325 46.9767 0.0000 173.3491 30 F 5.3331 7.2827 114.0576 55.6028 41.2378 173.8824 31 H 5.2012 8.9571 117.1305 54.7284 33.7702 171.9010 32 P 4.9421 0.0000 0.0000 62.6172 32.1963 176.0211 33 S 4.2350 8.4534 112.6321 59.3778 63.3967 174.2625 34 D 4.4532 7.8955 122.1762 54.5345 41.0527 175.1163 35 I 4.5208 7.8989 122.2321 59.8525 41.4064 172.9097 36 E 4.5197 9.0406 128.9694 54.3559 31.7776 174.6642 37 V 4.5618 7.9437 126.4713 60.9851 33.8834 174.1495 38 D 4.9975 8.8713 127.2439 52.4448 44.6389 174.8074 39 L 5.0127 8.3324 121.1396 53.2797 44.1967 175.2663 40 L 5.2362 8.9927 122.9692 52.7729 45.0885 175.2923 41 K 4.2257 8.8845 124.4183 54.7329 34.6209 175.7786 42 N 4.1616 9.9318 126.8932 54.2132 36.6947 175.6445 43 G 3.9367 8.5194 106.2476 44.9935 0.0000 173.6077 44 E 4.5624 7.7652 120.6072 53.7761 31.4568 174.9705 45 R 4.3150 8.3356 124.9220 56.4211 30.6621 176.0004 46 I 4.1309 8.5408 127.2882 60.8922 37.8249 176.1273 47 E 4.0627 8.7974 124.9118 58.2020 29.7490 176.8026 48 K 4.2901 7.7584 119.8784 54.6019 30.9948 174.1867 49 V 4.4170 7.8453 122.9023 60.6488 34.5339 173.9914 50 E 4.6739 8.4391 126.4697 54.8746 32.8810 174.1420 51 H 5.1629 7.7415 114.7081 53.8399 31.4668 173.2781 52 S 4.5271 8.9247 115.7064 58.2696 64.0312 173.3370 53 D 4.5725 8.4656 120.1735 53.3009 41.3756 176.4269 54 L 3.9969 8.4893 125.3226 56.2145 42.7207 175.8324 55 S 4.7136 8.1809 119.3047 57.0731 66.6708 171.7629 56 F 5.2725 7.5245 114.6707 55.5826 40.9648 174.4424 57 S 4.6695 9.4313 117.0771 57.1170 64.2403 175.3440 58 K 3.6463 8.5043 121.8364 59.5763 31.7975 176.8296 59 D 4.5009 7.8518 115.7728 52.8815 39.3378 177.2001 60 W 3.7351 7.7867 119.2965 56.8746 28.1494 174.7919 61 S 4.2155 8.2393 114.1326 58.1874 63.7833 173.9479 62 F 5.1042 8.3762 121.1090 57.1775 40.4711 174.2359 63 Y 5.2497 8.2986 117.7814 55.9038 41.8390 173.9261 64 L 5.0819 9.3310 120.1361 53.3518 46.9774 174.6062 65 L 5.4722 9.3009 125.3796 53.8515 44.2823 174.5666 66 Y 5.0909 9.2491 124.7038 56.9215 40.4702 174.3020 67 Y 5.3399 8.2443 119.1859 56.6581 41.8761 173.2296 68 T 5.0429 8.9380 115.1350 60.3522 71.3953 172.8699 69 E 4.0567 8.7344 127.3520 56.6611 30.3185 175.9824 70 F 4.8057 8.8028 116.8963 56.3451 42.0612 173.1606 71 T 4.4297 8.0944 116.1275 60.7013 70.9467 172.0816 72 P 4.6487 0.0000 0.0000 62.9276 32.8818 175.4799 73 T 4.9554 8.3915 110.3337 59.3912 71.9257 173.5214 74 E 4.1093 8.8788 121.8122 58.4261 29.6811 177.3184 75 K 4.4146 7.8606 115.6195 57.2759 33.9732 176.4283 76 D 4.6235 8.2304 120.4100 54.2482 41.5133 175.1148 77 E 4.9044 8.9560 122.9494 55.0477 31.8221 174.7691 78 Y 5.3149 8.8789 120.0268 56.6560 42.5740 173.9828 79 A 5.0545 8.5417 121.2610 51.5092 23.7087 174.1879 80 C 5.3332 9.2452 119.2981 54.7617 47.3364 172.6675 81 R 5.0653 9.0082 126.0639 54.5410 32.6567 174.0504 82 V 4.8161 8.8316 126.2980 61.1261 34.8510 173.8865 83 N 5.3543 8.6622 123.3166 52.0275 42.5997 172.8468 84 H 4.8897 8.4562 120.0257 55.1455 32.9676 174.6359 85 V 3.5818 8.1647 116.0552 64.5962 31.7544 177.5901 86 T 4.2277 8.0065 107.7267 62.1358 69.7439 173.5374 87 L 5.0169 7.9660 124.1773 52.8183 43.8051 177.6974 88 S 4.0208 8.7758 118.6778 60.8124 63.3954 174.3138 89 Q 4.6022 7.2833 116.3660 52.7734 32.6597 172.7142 90 P 4.5737 0.0000 0.0000 63.2198 32.1346 175.2078 91 K 4.5291 8.8010 123.7234 55.0018 34.1871 174.8135 92 I 4.9101 8.3833 127.7151 59.5618 39.5605 174.8159 93 V 4.4174 8.6097 127.5717 61.0042 33.4805 175.0727 94 K 4.7804 8.7126 127.1949 55.6656 33.3627 176.2071 95 W 4.6932 9.5240 134.6886 57.0992 31.6483 175.1710 96 D 4.4677 8.4441 126.3367 52.3926 41.5661 176.6902 97 R 3.0411 7.2275 126.7165 58.5566 30.3111 177.0246 98 D 4.8607 8.6503 117.2351 53.9912 41.0480 176.4106 99 M 4.3658 7.7879 124.8662 55.8555 33.0640 174.6468 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 M 8.30 4.45 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.56 0.00 1 I 8.11 3.65 1.80 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 1.40 0.55 0.87 0.00 0.00 2 Q 9.28 4.86 0.00 1.93 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.68 0.00 0.00 0.00 0.00 0.00 2.32 2.59 0.00 3 R 9.19 4.80 0.00 1.95 1.96 0.00 3.16 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 4 T 8.85 4.98 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 5 P 0.00 4.85 0.00 1.93 1.64 0.00 3.73 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.73 0.00 6 K 9.21 4.53 0.00 1.76 1.82 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.48 7.81 7 I 8.26 5.21 1.92 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 0.61 0.96 0.00 0.00 8 Q 9.47 4.93 0.00 2.33 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 9 V 8.57 5.08 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 1.03 0.00 0.00 0.99 0.00 0.00 10 Y 8.40 5.24 0.00 3.18 3.34 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 11 S 9.00 5.06 0.00 4.31 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 12 R 9.02 4.16 0.00 1.86 2.30 0.00 3.27 0.00 0.00 3.09 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.49 0.00 13 H 8.50 5.10 0.00 3.34 3.22 0.00 5.72 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 14 P 0.00 4.43 0.00 2.11 2.06 0.00 3.78 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 15 A 8.73 4.30 1.62 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 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.55 4.67 0.00 1.98 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.49 0.00 17 N 8.84 4.69 0.00 2.72 2.80 0.00 0.00 7.32 7.65 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 18 G 8.98 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 K 7.51 4.51 0.00 1.82 1.68 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.32 7.81 20 S 8.26 4.26 0.00 3.85 3.77 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 21 N 8.12 4.86 0.00 2.56 2.51 0.00 0.00 7.15 7.30 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 22 F 8.88 5.25 0.00 3.01 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 23 L 8.65 4.04 0.00 0.27 0.66 -0.28 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 24 N 9.11 5.35 0.00 1.44 2.04 0.00 0.00 5.95 5.12 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 25 C 9.24 5.30 0.00 2.92 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Y 9.26 5.54 0.00 3.36 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 27 V 8.83 5.48 1.89 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 0.49 0.00 0.00 1.07 0.00 0.00 28 S 8.55 4.95 0.00 3.80 3.20 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 29 G 8.51 4.44 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 0.00 30 F 7.28 5.33 0.00 3.06 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 31 H 8.96 5.20 0.00 3.28 3.22 0.00 5.59 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.94 0.00 2.15 2.18 0.00 3.93 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 33 S 8.45 4.23 0.00 3.22 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 D 7.90 4.45 0.00 2.64 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 I 7.90 4.52 1.57 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.47 0.85 0.00 0.00 36 E 9.04 4.52 0.00 1.96 1.67 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 2.08 2.13 0.00 37 V 7.94 4.56 0.67 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 0.44 0.00 0.00 0.38 0.00 0.00 38 D 8.87 5.00 0.00 2.50 2.44 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 39 L 8.33 5.01 0.00 1.55 1.50 0.89 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 40 L 8.99 5.24 0.00 1.53 1.51 0.91 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.88 4.23 0.00 1.79 1.60 0.00 1.97 0.00 0.00 1.69 0.00 0.00 2.85 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.18 0.93 7.81 42 N 9.93 4.16 0.00 2.74 2.80 0.00 0.00 7.27 7.65 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 43 G 8.52 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 44 E 7.77 4.56 0.00 1.98 1.89 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 2.20 2.20 0.00 45 R 8.34 4.32 0.00 1.79 1.81 0.00 3.54 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 46 I 8.54 4.13 1.94 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.78 0.92 0.00 0.00 47 E 8.80 4.06 0.00 1.96 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 2.31 2.23 0.00 48 K 7.76 4.29 0.00 1.70 1.74 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.40 7.81 49 V 7.85 4.42 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 0.97 0.00 0.00 0.95 0.00 0.00 50 E 8.44 4.67 0.00 1.16 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 2.10 2.07 0.00 51 H 7.74 5.16 0.00 2.13 2.04 0.00 5.73 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 52 S 8.92 4.53 0.00 3.97 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 53 D 8.47 4.57 0.00 2.70 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 54 L 8.49 4.00 0.00 1.62 1.61 0.77 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 55 S 8.18 4.71 0.00 3.69 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 7.52 5.27 0.00 2.90 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 57 S 9.43 4.67 0.00 4.09 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 58 K 8.50 3.65 0.00 1.62 1.73 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.28 1.23 7.81 59 D 7.85 4.50 0.00 2.81 2.70 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 0.00 0.00 0.00 60 W 7.79 3.74 0.00 3.28 3.01 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 61 S 8.24 4.22 0.00 3.78 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 62 F 8.38 5.10 0.00 1.70 2.39 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 0.00 63 Y 8.30 5.25 0.00 2.96 2.99 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 64 L 9.33 5.08 0.00 1.95 1.63 1.18 0.39 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 65 L 9.30 5.47 0.00 2.01 1.72 1.12 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 9.25 5.09 0.00 3.17 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 67 Y 8.24 5.34 0.00 3.10 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 68 T 8.94 5.04 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 69 E 8.73 4.06 0.00 1.70 1.49 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 1.47 1.61 0.00 70 F 8.80 4.81 0.00 2.92 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 71 T 8.09 4.43 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 1.12 0.00 0.00 72 P 0.00 4.65 0.00 2.30 2.24 0.00 3.42 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.77 0.00 73 T 8.39 4.96 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 1.32 0.00 0.00 74 E 8.88 4.11 0.00 1.98 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 2.31 2.31 0.00 75 K 7.86 4.41 0.00 1.91 1.94 0.00 1.64 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.46 7.81 76 D 8.23 4.62 0.00 2.95 2.46 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 77 E 8.96 4.90 0.00 1.88 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 2.29 2.27 0.00 78 Y 8.88 5.31 0.00 3.03 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 79 A 8.54 5.05 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 80 C 9.25 5.33 0.00 2.97 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 81 R 9.01 5.07 0.00 1.84 1.67 0.00 3.05 0.00 0.00 3.07 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.50 0.00 82 V 8.83 4.82 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 0.75 0.00 0.00 0.81 0.00 0.00 83 N 8.66 5.35 0.00 2.57 2.58 0.00 0.00 6.31 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 84 H 8.46 4.89 0.00 3.01 3.03 0.00 5.69 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.16 3.58 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 0.71 0.00 0.00 0.83 0.00 0.00 86 T 8.01 4.23 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 87 L 7.97 5.02 0.00 1.79 1.77 0.92 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 88 S 8.78 4.02 0.00 3.97 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 89 Q 7.28 4.60 0.00 2.04 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.87 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 90 P 0.00 4.57 0.00 2.04 2.18 0.00 3.73 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 91 K 8.80 4.53 0.00 1.89 1.68 0.00 1.47 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.44 7.81 92 I 8.38 4.91 1.88 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 1.22 0.77 0.93 0.00 0.00 93 V 8.61 4.42 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 1.15 0.00 0.00 0.97 0.00 0.00 94 K 8.71 4.78 0.00 1.75 1.82 0.00 1.83 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.48 1.48 7.81 95 W 9.52 4.69 0.00 3.20 3.52 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 96 D 8.44 4.47 0.00 2.62 2.45 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 0.00 0.00 0.00 0.00 97 R 7.23 3.04 0.00 1.56 1.82 0.00 3.10 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 1.01 0.00 98 D 8.65 4.86 0.00 2.87 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 99 M 7.79 4.37 0.00 1.98 1.95 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 2.50 2.54 0.00