NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1871 8.1685 122.0521 56.3779 34.0695 174.3919 2 A 4.9401 8.4385 129.4910 49.7898 19.1313 175.7173 3 F 4.1326 9.9609 121.5732 58.5058 40.3835 173.8938 4 E 4.2850 9.0302 121.4329 55.6874 30.9621 177.1033 5 R 3.2583 8.9236 121.8149 60.5004 30.0049 179.6405 6 C 4.3496 8.0189 115.2910 59.5696 37.0531 175.7027 7 E 3.9102 8.0871 120.8006 59.2078 29.2673 178.4575 8 L 3.5994 8.0850 120.1606 57.8566 42.0658 178.5738 9 A 3.9414 7.8249 120.7238 55.4802 18.3443 179.9197 10 R 3.9021 8.0684 116.3766 59.5293 30.1489 179.5119 11 T 3.8640 7.7985 115.6215 66.6858 68.5615 176.7870 12 L 3.8868 8.1233 121.2643 57.4129 41.5454 179.4839 13 K 3.8907 7.9732 119.7161 59.5964 31.9606 178.9220 14 R 3.9553 7.8251 117.6121 58.9386 30.0305 177.4649 15 L 4.3595 7.4040 115.9496 54.0384 41.8139 176.7759 16 G 3.8378 7.7681 106.9182 47.0061 0.0000 175.1756 17 M 3.8878 7.7555 121.2643 56.4829 32.4415 175.8290 18 D 4.6256 8.0082 117.8451 55.9043 41.2050 175.8525 19 G 3.9526 9.3987 115.6115 45.4804 0.0000 171.4891 20 Y 4.2093 8.3632 122.1363 58.6565 38.9575 176.3261 21 R 3.5642 8.9315 126.8812 57.2957 27.7432 177.2902 22 G 3.8110 8.0669 103.5045 45.7341 0.0000 174.1167 23 I 4.0786 7.6770 122.3072 59.2332 37.9635 175.8678 24 S 4.6171 8.3593 120.4337 57.7029 63.9555 174.8086 25 L 4.1881 9.0410 123.7996 58.7691 41.6791 179.4584 26 A 4.1463 8.2052 119.8839 55.2925 18.2089 179.2648 27 N 4.4516 8.2596 114.9930 56.3370 38.6504 177.7044 28 W 4.1849 8.0810 119.9259 59.9061 29.1844 178.3857 29 M 4.1949 8.5397 118.9816 58.5539 31.4988 177.9054 30 C 3.1772 8.2320 118.7389 59.0995 44.5541 175.2325 31 L 3.9580 8.2107 121.7498 58.3606 41.7453 178.8250 32 A 4.1555 8.2901 120.5739 54.9262 18.3364 179.4164 33 K 2.7246 7.9880 118.0183 59.3534 32.0263 179.1560 34 W 4.2292 7.5026 117.1796 59.2298 29.0535 178.3016 35 E 4.3449 8.3290 118.6832 58.6343 29.5043 177.7392 36 S 4.4955 7.9713 109.2245 56.6762 64.9742 174.6743 37 G 3.4770 8.0288 108.8557 46.7762 0.0000 173.1413 38 Y 3.6455 7.6489 113.8220 58.8670 35.3180 168.4856 39 N 5.4184 7.5890 117.9053 51.8462 40.8686 175.3924 40 T 4.0884 8.8798 116.7453 63.8650 69.1993 175.8911 41 R 4.4776 7.9969 116.5686 55.5685 30.0345 176.1331 42 A 4.3135 7.6043 121.4118 52.8209 19.2018 177.1224 43 T 5.5064 8.3252 111.2363 59.1253 72.5533 173.2203 44 N 4.8407 8.2945 121.3631 52.5630 41.8105 172.2975 45 Y 4.6608 8.7596 128.0075 57.1655 40.9554 173.9506 46 N 4.6074 8.3608 124.4619 51.0960 38.7567 175.1078 47 A 3.6923 8.3739 127.3996 54.9131 18.8740 179.1751 48 G 3.7704 8.1114 103.8647 48.0975 0.0000 173.7830 49 D 4.7269 7.6254 116.1135 52.0254 40.1251 176.3796 50 R 3.7804 8.1911 116.5546 56.9947 28.1272 175.7900 51 S 4.9529 7.2090 109.3452 57.0385 66.3762 172.7649 52 T 5.0769 8.8577 116.1226 61.9370 72.7214 172.8158 53 D 5.3236 8.9318 125.4788 53.3313 43.0234 175.0370 54 Y 4.8887 9.1447 121.2873 57.4513 41.4562 177.2529 55 G 4.3911 9.1572 112.2687 46.1642 0.0000 173.3825 56 I 3.8770 8.1408 116.7593 62.9318 37.8217 177.1551 57 F 4.7104 7.8523 115.5085 56.5071 39.9918 175.1967 58 Q 3.6272 7.8637 119.2266 57.0960 26.3841 173.7886 59 I 4.4706 8.1775 119.2109 60.8622 39.3869 176.8839 60 N 5.2925 9.2778 126.3841 53.5431 39.7942 175.5709 61 S 4.7173 9.1136 120.3673 59.8663 63.2932 175.3024 62 R 3.7357 8.7346 122.7206 58.6282 30.4067 177.6088 63 Y 4.3307 7.3617 114.6469 57.8013 40.6838 177.2998 64 W 4.8110 7.9395 118.7415 57.8327 29.9194 173.7643 65 C 5.5981 7.9064 110.6533 53.3985 45.6598 171.9115 66 N 5.0946 8.8497 120.0062 52.4084 39.3030 174.9641 67 D 4.8016 8.5912 123.2719 52.3738 40.3819 177.9954 68 G 4.0600 8.4792 109.4284 45.8747 0.0000 174.8671 69 K 4.4546 7.8976 116.5828 56.6243 32.8044 175.6395 70 T 4.4859 7.7433 116.4637 61.3500 69.4851 172.8070 71 P 4.2363 0.0000 0.0000 63.8922 31.8439 176.2817 72 G 3.9391 8.6069 109.6511 46.3814 0.0000 173.0359 73 A 4.4922 7.8526 119.1812 51.0845 19.8248 178.0794 74 V 4.3064 8.5467 113.5025 59.3516 35.2725 175.6952 75 N 4.9183 8.0692 118.7809 51.6606 37.7908 174.3617 76 A 4.0258 9.1412 125.5147 55.0579 19.0944 178.6001 77 C 4.5871 8.5626 110.7790 57.4799 40.9452 173.0477 78 H 4.0175 7.8461 116.4325 56.7526 26.4863 174.3742 79 L 4.8570 8.2304 117.0761 52.8180 46.2520 176.7313 80 S 4.6310 8.3504 115.5825 57.9654 63.3236 176.0169 81 C 4.1441 8.6320 124.1024 59.5503 39.4369 176.3488 82 S 3.9034 7.7218 114.6607 61.3563 61.9097 175.9004 83 A 4.0028 7.9411 123.2572 54.8169 17.4787 178.5807 84 L 4.4905 7.7106 115.6150 55.3179 41.7347 177.7530 85 L 4.9808 7.9065 117.7450 54.4906 42.4015 176.7886 86 Q 4.3345 7.4849 116.8750 55.4782 29.3584 176.1660 87 D 4.4031 8.5351 119.8889 57.0139 41.1516 176.6210 88 N 4.6151 8.0088 118.1889 52.9553 39.0945 174.6328 89 I 4.1844 8.4407 119.0110 61.1442 37.9371 177.0045 90 A 3.9375 8.1178 124.8180 55.9874 18.1590 180.1171 91 D 4.2894 8.0679 116.4503 57.3704 40.9426 178.6033 92 A 4.0943 7.9903 120.8703 55.2807 18.4435 179.7437 93 V 3.4326 8.2177 116.8231 65.9299 31.5191 178.1140 94 A 3.8674 7.9631 120.6498 55.2520 18.1154 178.8570 95 C 4.2448 8.4223 116.8276 59.7055 38.0528 175.6190 96 A 3.9070 8.1900 122.5390 55.0515 17.6033 179.7769 97 K 3.8343 7.6207 116.3822 59.3517 32.2848 179.2661 98 R 4.0677 7.6622 118.7311 59.3221 29.9595 178.4800 99 V 2.3658 7.5133 118.1953 65.8700 31.0912 177.9689 100 V 3.8986 7.6597 109.3648 62.5175 31.2790 177.5806 101 R 4.2053 7.7191 118.2570 56.9975 30.5810 175.9210 102 D 4.7122 7.4138 118.7449 53.2197 41.9172 175.3372 103 P 4.1831 0.0000 0.0000 66.3546 31.3699 177.7697 104 Q 4.0066 8.1981 117.4989 56.3531 30.0034 177.3369 105 G 3.6533 8.0957 107.2375 46.9302 0.0000 176.3388 106 I 3.5259 7.7585 120.6289 63.4503 37.9098 177.8124 107 R 4.2724 7.3210 117.3374 57.8599 29.9229 177.5478 108 A 3.8971 7.6910 120.8950 53.8512 18.6674 177.3908 109 W 4.7371 8.0558 116.7228 55.1303 30.0431 177.3800 110 V 3.7544 8.6917 123.8063 65.9487 30.8702 177.6191 111 A 4.0620 8.2924 120.2462 54.6322 18.1173 179.2218 112 W 3.9563 8.4330 127.0809 60.7671 30.6091 178.4400 113 R 3.6159 8.1558 116.2194 59.1781 29.6162 178.4497 114 N 4.3687 7.9214 115.5164 55.5136 38.7608 176.8239 115 R 4.1210 7.5761 113.3798 55.8728 30.5674 175.3679 116 C 4.5759 7.6620 116.5634 58.2838 42.4451 174.2887 117 Q 3.4019 6.5068 118.6455 57.4294 28.6554 175.5171 118 N 4.1903 8.7289 119.8201 54.0156 36.2522 173.7007 119 R 4.5063 7.4352 116.2397 53.9554 32.9749 175.7023 120 D 4.5304 8.4399 118.8430 54.3053 40.3006 175.9884 121 V 4.5539 8.1836 119.0010 61.3829 32.5572 178.4651 122 R 4.0309 8.1020 121.1209 59.3634 29.7209 178.2875 123 Q 3.8876 8.1855 116.8795 59.8478 27.8794 178.6053 124 Y 4.2215 7.7214 116.7628 59.7033 38.2137 176.7029 125 V 4.4177 7.8789 111.3717 60.6217 33.1620 175.4850 126 Q 4.1367 7.5592 120.1921 57.2389 28.8007 176.9110 127 G 3.9272 8.8717 109.9141 46.2389 0.0000 174.6154 128 C 4.4352 8.0298 115.6938 56.6479 40.6280 174.2613 129 G 3.8619 8.1869 107.2572 46.5054 0.0000 174.1020 130 V 4.0002 7.8441 118.0774 61.0795 32.0038 175.8139 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 8.17 4.19 0.00 1.89 1.68 0.00 1.33 0.00 0.00 1.18 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.94 1.17 7.81 2 A 8.44 4.94 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 3 F 9.96 4.13 0.00 3.06 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 4 E 9.03 4.28 0.00 1.92 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 2.28 2.38 0.00 5 R 8.92 3.26 0.00 1.89 1.90 0.00 3.44 0.00 0.00 3.47 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 6 C 8.02 4.35 0.00 3.00 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 7 E 8.09 3.91 0.00 2.06 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 0.00 2.61 2.42 0.00 8 L 8.08 3.60 0.00 1.42 1.43 -0.11 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.82 3.94 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 10 R 8.07 3.90 0.00 1.88 1.99 0.00 3.13 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.86 0.00 11 T 7.80 3.86 4.26 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 0.00 0.00 0.00 1.20 0.00 0.00 12 L 8.12 3.89 0.00 1.59 1.57 0.95 0.39 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 13 K 7.97 3.89 0.00 1.93 1.96 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.45 7.81 14 R 7.83 3.96 0.00 2.02 2.06 0.00 3.30 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.40 4.36 0.00 1.68 1.54 0.84 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.77 3.84 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 0.00 0.00 0.00 17 M 7.76 3.89 0.00 1.30 1.94 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.20 0.00 18 D 8.01 4.63 0.00 2.67 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 19 G 9.40 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 20 Y 8.36 4.21 0.00 3.32 3.19 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 21 R 8.93 3.56 0.00 1.88 1.83 0.00 3.23 0.00 0.00 2.96 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.39 0.00 22 G 8.07 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 23 I 7.68 4.08 1.86 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.59 -0.16 0.00 0.00 24 S 8.36 4.62 0.00 4.07 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 25 L 9.04 4.19 0.00 2.07 1.82 0.97 1.18 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 26 A 8.21 4.15 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 27 N 8.26 4.45 0.00 2.86 2.77 0.00 0.00 6.92 7.40 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 28 W 8.08 4.18 0.00 3.54 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 29 M 8.54 4.19 0.00 2.17 2.39 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.92 0.00 30 C 8.23 3.18 0.00 2.74 3.21 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 31 L 8.21 3.96 0.00 1.81 1.85 0.57 -0.31 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 32 A 8.29 4.16 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.99 2.72 0.00 1.44 1.62 0.00 0.70 0.00 0.00 1.14 0.00 0.00 2.61 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.05 0.21 7.81 34 W 7.50 4.23 0.00 3.35 3.27 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 35 E 8.33 4.34 0.00 2.00 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 0.00 2.57 2.37 0.00 36 S 7.97 4.50 0.00 4.06 4.11 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 37 G 8.03 3.48 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 7.65 3.65 0.00 3.26 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 39 N 7.59 5.42 0.00 2.92 2.82 0.00 0.00 7.02 7.10 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 40 T 8.88 4.09 4.43 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 1.45 0.00 0.00 41 R 8.00 4.48 0.00 2.01 2.09 0.00 3.09 0.00 0.00 3.25 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 42 A 7.60 4.31 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 43 T 8.33 5.51 4.08 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 1.29 0.00 0.00 44 N 8.29 4.84 0.00 2.89 2.73 0.00 0.00 6.67 7.56 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 45 Y 8.76 4.66 0.00 2.97 2.81 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 46 N 8.36 4.61 0.00 2.62 2.58 0.00 0.00 6.68 6.68 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 47 A 8.37 3.69 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 48 G 8.11 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 0.00 0.00 0.00 49 D 7.63 4.73 0.00 2.74 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 50 R 8.19 3.78 0.00 2.02 2.20 0.00 3.11 0.00 0.00 3.18 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.52 0.00 51 S 7.21 4.95 0.00 3.81 3.87 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 52 T 8.86 5.08 4.08 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 0.69 0.00 0.00 53 D 8.93 5.32 0.00 2.72 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 54 Y 9.14 4.89 0.00 2.94 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 55 G 9.16 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 0.00 0.00 0.00 0.00 56 I 8.14 3.88 1.65 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 1.01 1.82 0.00 0.00 0.00 57 F 7.85 4.71 0.00 3.20 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 58 Q 7.86 3.63 0.00 2.54 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.82 0.00 0.00 0.00 0.00 0.00 2.51 2.69 0.00 59 I 8.18 4.47 2.16 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.17 1.18 0.00 0.00 60 N 9.28 5.29 0.00 3.09 3.04 0.00 0.00 6.97 7.14 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 61 S 9.11 4.72 0.00 4.05 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 62 R 8.73 3.74 0.00 1.49 0.87 0.00 2.62 0.00 0.00 2.94 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.16 0.00 63 Y 7.36 4.33 0.00 1.43 1.83 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 64 W 7.94 4.81 0.00 3.67 3.29 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 65 C 7.91 5.60 0.00 3.18 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 66 N 8.85 5.09 0.00 2.79 2.70 0.00 0.00 7.03 8.51 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 67 D 8.59 4.80 0.00 2.97 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 68 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 69 K 7.90 4.45 0.00 1.83 1.90 0.00 1.59 0.00 0.00 1.71 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.45 7.81 70 T 7.74 4.49 4.23 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 1.15 0.00 0.00 71 P 0.00 4.24 0.00 2.01 1.98 0.00 3.82 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 72 G 8.61 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 73 A 7.85 4.49 1.26 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 0.00 0.00 0.00 0.00 0.00 0.00 74 V 8.55 4.31 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 0.63 0.00 0.00 0.86 0.00 0.00 75 N 8.07 4.92 0.00 2.74 2.55 0.00 0.00 6.76 8.53 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 76 A 9.14 4.03 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 77 C 8.56 4.59 0.00 3.31 3.26 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 0.00 0.00 0.00 0.00 78 H 7.85 4.02 0.00 3.31 3.39 0.00 5.79 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 79 L 8.23 4.86 0.00 1.70 1.50 0.97 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.35 4.63 0.00 3.83 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 0.00 81 C 8.63 4.14 0.00 2.29 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 82 S 7.72 3.90 0.00 3.84 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 83 A 7.94 4.00 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 84 L 7.71 4.49 0.00 1.94 1.81 1.08 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.91 4.98 0.00 1.75 1.72 1.08 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.48 4.33 0.00 2.27 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 7.00 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 87 D 8.54 4.40 0.00 2.63 2.69 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 0.00 88 N 8.01 4.62 0.00 2.69 2.75 0.00 0.00 6.98 7.94 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 89 I 8.44 4.18 1.75 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.72 0.94 0.00 0.00 90 A 8.12 3.94 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 91 D 8.07 4.29 0.00 2.75 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 92 A 7.99 4.09 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 93 V 8.22 3.43 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 0.71 0.00 0.00 0.92 0.00 0.00 94 A 7.96 3.87 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 95 C 8.42 4.24 0.00 3.16 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 96 A 8.19 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.62 3.83 0.00 1.68 1.52 0.00 1.29 0.00 0.00 0.71 0.00 0.00 2.24 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.30 0.92 7.81 98 R 7.66 4.07 0.00 1.95 2.16 0.00 3.29 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.92 0.00 99 V 7.51 2.37 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 -0.20 0.00 0.00 -0.46 0.00 0.00 100 V 7.66 3.90 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 1.09 0.00 0.00 1.45 0.00 0.00 101 R 7.72 4.21 0.00 2.18 2.01 0.00 3.33 0.00 0.00 3.29 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 102 D 7.41 4.71 0.00 2.98 2.58 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 0.00 0.00 0.00 0.00 103 P 0.00 4.18 0.00 2.14 2.21 0.00 3.78 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.02 0.00 104 Q 8.20 4.01 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.90 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 8.10 3.65 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 0.00 0.00 0.00 106 I 7.76 3.53 0.98 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.30 -0.64 0.00 0.00 107 R 7.32 4.27 0.00 2.08 2.04 0.00 3.22 0.00 0.00 3.28 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.62 0.00 108 A 7.69 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.06 4.74 0.00 3.51 3.26 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 0.00 0.00 0.00 0.00 110 V 8.69 3.75 2.17 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 1.09 0.00 0.00 1.00 0.00 0.00 111 A 8.29 4.06 1.52 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 0.00 0.00 112 W 8.43 3.96 0.00 3.50 3.51 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 0.00 0.00 0.00 0.00 113 R 8.16 3.62 0.00 2.01 1.97 0.00 3.68 0.00 0.00 3.62 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.16 0.00 114 N 7.92 4.37 0.00 2.55 2.70 0.00 0.00 6.90 7.69 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 0.00 115 R 7.58 4.12 0.00 0.85 0.93 0.00 2.73 0.00 0.00 2.83 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.59 0.00 116 C 7.66 4.58 0.00 1.87 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 0.00 117 Q 6.51 3.40 0.00 0.93 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.72 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 118 N 8.73 4.19 0.00 2.80 2.83 0.00 0.00 6.87 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 0.00 119 R 7.44 4.51 0.00 1.88 1.81 0.00 3.22 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.56 0.00 120 D 8.44 4.53 0.00 2.62 2.62 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 0.00 121 V 8.18 4.55 2.40 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 1.06 0.00 0.00 1.06 0.00 0.00 122 R 8.10 4.03 0.00 1.87 2.01 0.00 3.17 0.00 0.00 3.41 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.74 0.00 123 Q 8.19 3.89 0.00 2.06 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.92 0.00 0.00 0.00 0.00 0.00 2.23 1.48 0.00 124 Y 7.72 4.22 0.00 3.23 3.15 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 0.00 125 V 7.88 4.42 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 1.03 0.00 0.00 1.06 0.00 0.00 126 Q 7.56 4.14 0.00 2.16 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.98 0.00 0.00 0.00 0.00 0.00 2.49 2.45 0.00 127 G 8.87 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 0.00 0.00 0.00 128 C 8.03 4.44 0.00 3.06 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 0.00 129 G 8.19 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 0.00 130 V 7.84 4.00 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 0.79 0.00 0.00 0.96 0.00 0.00