NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4131 8.3049 120.3494 54.7540 33.4283 175.0727 1 I 3.6365 8.1109 124.4052 61.6020 37.6291 174.5186 2 Q 4.9162 9.2720 124.2745 55.0540 32.9010 173.8184 3 R 4.8353 9.2235 123.4426 54.5804 33.6829 175.2978 4 T 4.9988 8.3504 118.5106 61.6385 69.6099 173.0927 5 P 4.7597 0.0000 0.0000 62.7298 32.4470 175.7792 6 K 4.5572 9.5169 124.0881 55.2837 33.9488 175.5609 7 I 5.0939 8.4256 125.0224 59.5921 39.9087 174.8610 8 Q 4.8328 9.4146 125.6430 54.0625 32.1013 174.4921 9 V 5.0670 8.5280 123.6311 61.4655 33.8230 173.8811 10 Y 5.3171 8.1487 124.2324 56.7834 41.7097 173.0538 11 S 5.0344 8.9303 114.1357 56.6198 65.1397 174.3802 12 R 4.0915 8.8016 122.4949 59.5520 30.1466 176.1815 13 H 5.0493 8.3928 113.0101 52.6380 31.6686 172.0873 14 P 4.3459 0.0000 0.0000 62.8677 31.5113 176.4465 15 A 4.3572 8.7054 125.3029 52.0858 18.8900 176.8778 16 E 4.6529 8.5906 122.1338 54.2813 32.7245 175.2110 17 N 4.6517 8.9350 121.4228 55.1414 38.9824 175.3546 18 G 3.9095 8.9080 110.0997 45.6066 0.0000 173.1887 19 K 4.5269 7.6607 118.5169 53.9460 34.4588 176.1903 20 S 4.2039 8.2959 117.4903 58.3890 63.4698 172.1699 21 N 4.8011 8.1656 122.1710 53.3988 43.3714 172.3904 22 F 5.2945 8.8583 117.6556 55.5260 42.7507 174.3138 23 L 3.9068 8.8260 126.0394 53.6745 42.6061 175.1619 24 N 5.2581 8.3549 124.1830 51.9512 41.7158 173.8723 25 C 5.1382 9.5177 121.0785 55.5448 46.5445 171.9412 26 Y 5.3682 9.4000 129.3808 56.6841 40.0121 174.1351 27 V 4.9931 8.8264 127.4671 61.1646 34.2914 174.4649 28 S 5.0256 8.8895 121.1332 57.8772 66.8908 174.6853 29 G 4.1752 8.7440 107.7493 46.6695 0.0000 173.2240 30 F 5.2227 7.4454 113.9371 54.9069 40.8305 174.1438 31 H 5.1152 8.6085 117.7335 54.8935 33.2525 172.1191 32 P 5.1680 0.0000 0.0000 62.7238 31.7523 175.8082 33 S 4.2450 8.6223 113.1881 59.9765 63.4669 173.8244 34 D 4.4316 7.9902 120.9820 54.4820 40.2376 175.1629 35 I 4.7091 7.9815 123.8706 59.2040 41.5499 173.9168 36 E 4.4920 8.9145 128.5631 54.7160 31.4362 175.0467 37 V 4.4891 7.9710 124.7776 60.8954 33.8052 174.2201 38 D 4.9186 8.9335 128.0294 52.4105 44.1002 174.9967 39 L 4.9561 8.3733 122.5076 53.4145 44.0714 175.4039 40 L 5.2094 9.0521 123.0947 52.8070 45.3155 175.6848 41 K 3.9235 8.5768 123.4908 54.6701 34.1667 175.3358 42 N 3.9772 9.5403 125.0738 54.5149 36.4825 175.9554 43 G 4.0352 8.5411 105.7595 45.1371 0.0000 173.9884 44 E 4.4800 7.7064 120.0396 53.9370 31.2162 175.0806 45 R 4.1448 8.5073 123.4480 56.3229 29.9863 176.1712 46 I 3.8661 8.2542 127.5521 61.6607 37.7709 176.5615 47 E 4.0447 8.8164 125.0259 59.4012 30.1537 178.2674 48 K 4.1910 7.7025 118.6126 55.5909 31.5064 177.0643 49 V 4.2554 7.3986 119.0774 61.8960 32.8052 175.6527 50 E 4.6365 8.1662 127.3333 54.9591 32.2637 174.4884 51 H 6.0039 8.1001 115.7275 52.5260 32.1210 172.7689 52 S 4.6567 8.5962 114.0858 57.5198 64.6466 173.2177 53 D 4.5636 8.4457 119.9169 53.2287 41.3535 176.3174 54 L 3.9800 8.5849 125.3893 56.2089 42.6444 175.7510 55 S 4.9181 8.1828 119.3357 56.6040 66.5928 171.7224 56 F 5.3416 7.5703 114.6728 55.8087 41.1678 173.9606 57 S 4.7417 8.8019 116.0678 56.5706 64.8830 175.1912 58 K 3.5567 8.4855 121.5312 59.6659 31.7466 177.0074 59 D 4.5056 7.8499 115.4054 52.9123 39.4667 177.0472 60 W 3.8684 8.0330 119.5117 56.7852 27.8329 174.6447 61 S 4.2759 8.0467 114.2115 58.1185 64.1220 173.8005 62 F 4.8566 8.5025 121.4154 57.1925 40.5266 174.2630 63 Y 5.5452 8.5473 119.0305 55.6268 41.6317 174.2259 64 L 5.1219 9.7434 119.9151 53.4164 47.1862 174.5664 65 L 5.3983 8.9711 124.5442 53.8448 44.4503 174.4958 66 Y 5.2962 9.3206 124.8617 56.7791 40.4756 174.4548 67 Y 5.7778 8.5047 120.2079 56.8157 42.2522 173.3927 68 T 4.7854 8.2592 112.5529 60.9266 71.0303 171.8237 69 E 3.9400 8.7194 129.5030 55.8229 30.2231 175.6132 70 F 4.9610 9.4282 121.5219 55.6210 42.4735 173.5794 71 T 4.2658 8.0749 116.1365 60.8959 70.6092 172.1653 72 P 4.5912 0.0000 0.0000 63.1678 32.5948 176.2787 73 T 5.0301 8.3480 112.6724 60.7938 71.4874 172.1218 74 E 4.2878 9.0438 119.9124 58.8913 30.2195 178.0777 75 K 4.4289 7.9890 114.7371 56.2043 32.2016 175.6439 76 D 4.7118 7.3516 119.3952 52.7523 41.6702 176.2405 77 E 4.5882 8.3244 123.9739 56.3111 31.4541 175.3892 78 Y 5.4768 8.5803 118.0087 56.9554 42.9803 173.8530 79 A 5.0440 8.8550 122.8220 51.3684 23.9510 173.9248 80 C 5.2479 9.4696 119.0756 54.9162 45.2197 172.5427 81 R 4.9106 9.2546 127.4482 54.8811 31.5114 174.7173 82 V 4.7251 8.4007 126.8304 60.9882 34.4357 173.6537 83 N 5.3150 9.1375 126.1701 52.1221 41.7651 172.4639 84 H 5.2416 8.5325 124.0299 54.5259 33.3954 174.3660 85 V 3.7033 8.1537 121.8814 64.1896 31.5215 176.3503 86 T 4.5746 7.7480 110.8695 61.0915 69.2118 174.0548 87 L 4.7959 7.6693 121.5541 54.5849 46.0249 177.2114 88 S 4.1915 8.7963 120.2048 61.3015 63.0959 174.0734 89 Q 4.5413 7.2775 115.3387 53.3966 32.0788 172.0446 90 P 4.4344 0.0000 0.0000 63.0198 32.0865 175.7097 91 K 4.2672 8.7999 126.6634 55.5238 33.5314 175.4518 92 I 4.4668 8.3951 129.2526 60.1652 38.1106 175.3656 93 V 4.2095 8.5357 129.1129 61.2221 32.7485 176.0459 94 K 4.7964 8.7341 127.7542 56.0429 33.5803 175.6344 95 W 4.9491 8.7423 131.3136 56.0242 32.3502 175.2150 96 D 4.4867 8.6270 126.8769 52.3542 40.6784 174.9523 97 R 3.9594 6.8438 125.1391 55.8871 30.2216 177.9880 98 D 4.1776 7.1723 118.8862 56.3451 40.9361 175.5032 99 M 4.1882 8.2016 121.8845 56.1186 32.0373 173.9708 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 4.41 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.59 0.00 1 I 8.11 3.64 1.80 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.72 0.88 0.00 0.00 2 Q 9.27 4.92 0.00 1.93 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.59 0.00 3 R 9.22 4.84 0.00 1.98 1.88 0.00 3.16 0.00 0.00 3.21 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 4 T 8.35 5.00 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 1.25 0.00 0.00 5 P 0.00 4.76 0.00 1.88 1.86 0.00 3.68 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 1.91 1.88 0.00 6 K 9.52 4.56 0.00 1.71 1.77 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.44 1.46 7.81 7 I 8.43 5.09 1.91 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 1.33 0.60 0.97 0.00 0.00 8 Q 9.41 4.83 0.00 2.27 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 9 V 8.53 5.07 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 0.90 0.00 0.00 1.08 0.00 0.00 10 Y 8.15 5.32 0.00 3.29 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 11 S 8.93 5.03 0.00 4.12 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 12 R 8.80 4.09 0.00 1.85 2.22 0.00 3.25 0.00 0.00 3.08 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.47 0.00 13 H 8.39 5.05 0.00 3.25 3.27 0.00 5.73 0.00 0.00 0.00 0.00 6.79 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 4.35 0.00 2.11 2.07 0.00 3.79 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 2.09 2.17 0.00 15 A 8.71 4.36 1.60 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 0.00 0.00 16 E 8.59 4.65 0.00 1.99 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 2.30 2.33 0.00 17 N 8.93 4.65 0.00 2.70 2.80 0.00 0.00 7.18 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 8.91 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 19 K 7.66 4.53 0.00 1.88 1.66 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.30 7.81 20 S 8.30 4.20 0.00 3.79 3.68 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 21 N 8.17 4.80 0.00 2.62 2.47 0.00 0.00 7.12 7.86 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 22 F 8.86 5.29 0.00 2.95 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 23 L 8.83 3.91 0.00 0.27 0.63 -0.45 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.35 5.26 0.00 1.52 2.22 0.00 0.00 5.94 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 25 C 9.52 5.14 0.00 2.89 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 9.40 5.37 0.00 3.42 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 27 V 8.83 4.99 2.12 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 0.81 0.00 0.00 0.94 0.00 0.00 28 S 8.89 5.03 0.00 3.91 3.42 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 29 G 8.74 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 0.00 0.00 0.00 0.00 30 F 7.45 5.22 0.00 2.89 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 31 H 8.61 5.12 0.00 3.25 3.21 0.00 5.68 0.00 0.00 0.00 0.00 6.72 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 5.17 0.00 2.15 2.10 0.00 3.82 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.20 0.00 33 S 8.62 4.24 0.00 3.21 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 7.99 4.43 0.00 2.68 2.68 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 35 I 7.98 4.71 1.39 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.69 0.76 0.00 0.00 36 E 8.91 4.49 0.00 1.90 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 2.18 2.21 0.00 37 V 7.97 4.49 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 0.24 0.00 0.00 0.56 0.00 0.00 38 D 8.93 4.92 0.00 2.48 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 39 L 8.37 4.96 0.00 1.55 1.51 0.91 0.51 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 40 L 9.05 5.21 0.00 1.53 1.52 0.91 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.58 3.92 0.00 1.90 1.65 0.00 1.93 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.15 0.92 7.81 42 N 9.54 3.98 0.00 2.86 2.84 0.00 0.00 7.26 7.20 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 43 G 8.54 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 0.00 0.00 0.00 44 E 7.71 4.48 0.00 2.12 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 2.22 2.19 0.00 45 R 8.51 4.14 0.00 1.75 1.87 0.00 3.32 0.00 0.00 3.20 7.29 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 8.25 3.87 1.92 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.93 0.92 0.00 0.00 47 E 8.82 4.04 0.00 1.96 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 2.31 2.29 0.00 48 K 7.70 4.19 0.00 1.71 1.75 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.41 7.81 49 V 7.40 4.26 2.12 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 0.98 0.00 0.00 0.98 0.00 0.00 50 E 8.17 4.64 0.00 1.16 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 2.11 2.01 0.00 51 H 8.10 6.00 0.00 2.53 1.75 0.00 5.32 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.60 4.66 0.00 3.97 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 53 D 8.45 4.56 0.00 2.70 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 54 L 8.58 3.98 0.00 1.64 1.63 0.81 0.41 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 55 S 8.18 4.92 0.00 3.78 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 56 F 7.57 5.34 0.00 2.97 2.53 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 57 S 8.80 4.74 0.00 4.09 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 58 K 8.49 3.56 0.00 1.59 1.73 0.00 1.69 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.22 1.26 7.81 59 D 7.85 4.51 0.00 2.82 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 60 W 8.03 3.87 0.00 3.32 3.11 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 0.00 0.00 0.00 61 S 8.05 4.28 0.00 3.86 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 62 F 8.50 4.86 0.00 1.51 2.36 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 63 Y 8.55 5.55 0.00 3.03 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 64 L 9.74 5.12 0.00 1.88 1.78 1.17 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 65 L 8.97 5.40 0.00 2.08 1.69 1.13 0.84 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 66 Y 9.32 5.30 0.00 3.04 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 67 Y 8.50 5.78 0.00 3.15 3.08 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 68 T 8.26 4.79 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 1.06 0.00 0.00 69 E 8.72 3.94 0.00 1.61 1.63 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 1.94 1.47 0.00 70 F 9.43 4.96 0.00 2.93 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 71 T 8.07 4.27 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 1.08 0.00 0.00 72 P 0.00 4.59 0.00 2.08 2.23 0.00 3.38 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.20 0.00 73 T 8.35 5.03 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 1.25 0.00 0.00 74 E 9.04 4.29 0.00 1.98 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 2.25 2.34 0.00 75 K 7.99 4.43 0.00 1.80 1.81 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.46 7.81 76 D 7.35 4.71 0.00 2.87 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 8.32 4.59 0.00 1.88 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 2.41 2.34 0.00 78 Y 8.58 5.48 0.00 3.14 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 79 A 8.85 5.04 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 80 C 9.47 5.25 0.00 2.93 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 9.25 4.91 0.00 1.84 1.72 0.00 3.06 0.00 0.00 3.07 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 82 V 8.40 4.73 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 0.72 0.00 0.00 0.81 0.00 0.00 83 N 9.14 5.32 0.00 2.65 2.72 0.00 0.00 6.31 7.82 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 84 H 8.53 5.24 0.00 3.06 3.03 0.00 5.73 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.15 3.70 1.97 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 0.69 0.00 0.00 0.91 0.00 0.00 86 T 7.75 4.57 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 1.40 0.00 0.00 87 L 7.67 4.80 0.00 1.73 1.68 0.94 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 88 S 8.80 4.19 0.00 3.86 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 89 Q 7.28 4.54 0.00 2.01 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.78 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 90 P 0.00 4.43 0.00 1.95 1.96 0.00 3.70 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 91 K 8.80 4.27 0.00 1.85 1.67 0.00 1.62 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.42 7.81 92 I 8.40 4.47 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.58 0.93 0.00 0.00 93 V 8.54 4.21 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 1.04 0.00 0.00 0.96 0.00 0.00 94 K 8.73 4.80 0.00 1.75 1.86 0.00 1.80 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.52 1.49 7.81 95 W 8.74 4.95 0.00 3.30 3.37 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 96 D 8.63 4.49 0.00 2.59 2.47 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 97 R 6.84 3.96 0.00 1.62 0.66 0.00 2.83 0.00 0.00 3.07 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 1.28 0.00 98 D 7.17 4.18 0.00 2.91 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 99 M 8.20 4.19 0.00 1.96 1.85 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.49 0.00