NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.3408 8.3144 121.7907 55.7015 33.3369 175.2162 2 E 3.8375 8.7680 127.3497 54.4656 30.2200 175.6786 3 S 4.3994 9.2957 122.1410 58.0723 66.1542 175.0502 4 R 3.8991 8.5471 122.1786 59.4784 30.0015 179.0665 5 A 4.1752 7.9905 119.8820 55.4220 18.3665 179.7723 6 K 4.0534 8.3141 116.9478 59.2771 32.0216 179.5665 7 K 4.0691 8.5328 120.5926 59.3981 32.0872 178.5695 8 F 4.1050 8.6140 121.2479 61.3681 39.3253 177.0728 9 Q 3.9890 8.2048 117.3838 59.0738 28.3433 178.9028 10 R 3.9037 7.9699 118.4329 59.4808 30.2514 178.1242 11 Q 4.0820 8.1909 116.3707 57.8671 29.2115 176.1834 12 H 4.7435 7.8478 113.1624 53.9570 32.4311 172.6787 13 M 4.8304 8.0242 118.5909 53.7185 33.9028 176.2825 14 D 4.7566 9.1542 122.6679 53.1018 41.8570 175.6263 15 S 4.4426 8.6396 117.4037 59.5627 63.7695 174.8209 16 D 4.6841 8.0829 118.9623 55.6155 42.0411 177.2140 17 S 4.3570 8.1970 113.8029 57.5526 63.4881 173.8926 18 S 4.0609 8.4276 116.7223 58.0628 62.3325 172.8484 19 P 3.9160 0.0000 0.0000 65.2918 31.2523 176.7189 20 S 4.3166 7.4876 113.8193 56.5018 60.7559 172.0626 21 S 3.8801 7.8093 120.7773 57.5501 63.5447 174.8164 22 S 4.4680 8.4220 119.8065 57.5026 63.7652 175.2298 23 S 4.2269 8.5712 115.3352 61.0935 62.9910 175.2666 24 T 4.2833 7.5445 109.6678 62.2693 69.5562 175.8101 25 Y 4.0676 8.0809 124.1512 61.5307 38.6201 177.5722 26 C 4.1430 8.4926 116.9627 59.9221 39.6194 175.7571 27 N 4.3832 8.2358 117.6144 56.6264 38.1592 177.3098 28 Q 3.9584 7.8009 118.6891 59.1777 28.7336 178.7080 29 M 3.6895 7.8432 120.0361 58.4810 31.7852 178.8017 30 M 3.9914 8.2000 119.2138 57.9722 31.8792 178.5688 31 L 3.9243 7.5069 119.5693 58.1964 42.1872 178.8700 32 L 3.9525 8.0622 118.4000 57.4168 41.5752 178.8501 33 R 4.3601 7.8558 115.5927 54.7866 30.7865 176.0204 34 N 4.1752 8.0318 114.9075 55.2152 36.6579 174.6459 35 M 4.5879 8.3345 114.1764 55.3863 32.6745 177.5193 36 T 5.3822 7.6346 106.3183 60.3210 69.8443 173.3247 37 Q 4.2734 8.2165 122.2131 56.8587 29.2045 177.3561 38 G 3.9204 10.4557 112.0765 45.8670 0.0000 173.2239 39 R 4.1163 7.3733 113.3003 55.2536 32.1818 173.8154 40 C 4.7783 8.7096 118.0376 55.4787 39.7781 173.6129 41 K 4.1849 8.0725 125.0838 55.5987 32.3647 174.8866 42 P 4.5745 0.0000 0.0000 65.7940 32.2241 176.7142 43 V 5.1551 7.6201 111.0533 59.6136 35.7951 174.3578 44 N 4.8541 9.2009 122.2921 52.4479 42.8192 172.9061 45 T 4.8266 8.0212 121.4409 61.6459 71.6583 172.9337 46 F 4.8872 8.8523 124.4269 55.6312 42.1619 174.5242 47 V 4.3625 8.8030 123.5201 61.4613 33.0009 175.5553 48 H 5.3806 8.7180 128.2334 53.6481 26.3799 173.7499 49 E 4.8187 7.7801 117.8656 52.6976 34.5798 174.5516 50 P 4.3623 0.0000 0.0000 62.6110 33.1099 177.0855 51 L 4.0319 7.9826 121.1618 58.6991 41.9951 180.0681 52 V 3.9137 7.8425 118.1742 65.0832 31.0247 177.9111 53 D 4.3930 8.0184 118.2112 57.0286 41.0141 178.4562 54 V 3.8060 7.8275 118.4281 66.1063 31.6157 178.0171 55 Q 3.9513 8.5893 118.2297 59.1856 28.5873 178.6961 56 N 4.6521 8.4307 116.8403 55.6371 38.5063 177.4364 57 V 3.6773 7.7131 120.1082 65.8676 31.3160 176.9875 58 C 3.5058 7.7236 115.1431 58.1461 39.7856 174.1093 59 F 4.9486 7.5374 118.8207 57.2650 40.2576 176.0949 60 Q 4.6476 7.6044 121.2138 56.2136 28.2710 177.2712 61 E 4.4365 8.8355 129.1263 55.8933 30.5747 175.0853 62 K 4.0169 8.7591 129.4741 56.5063 32.7283 176.2176 63 V 4.5577 8.0807 119.8497 59.2518 35.8388 175.7359 64 T 3.8526 8.3654 118.9585 63.6542 68.8216 175.3704 65 C 4.4339 8.5629 123.6796 57.2905 40.6684 174.0188 66 K 3.9987 9.4962 123.7354 57.6582 32.5867 176.5949 67 N 5.0024 8.6432 117.7356 51.6111 39.5470 172.8695 68 G 3.6629 7.1621 106.3567 44.6138 0.0000 171.3495 69 Q 4.4675 8.4530 123.6168 53.9881 32.8179 172.9460 70 G 3.6781 8.1263 103.5954 43.9715 0.0000 172.2030 71 N 4.8141 8.8613 118.1718 52.0123 40.5287 174.9203 72 C 5.3496 8.3359 121.1618 55.5000 42.9310 172.6347 73 Y 5.0377 8.6820 118.0632 56.2748 41.9794 174.0766 74 K 5.0931 9.2416 125.9031 54.5512 33.7476 175.6983 75 S 4.5364 9.1745 123.2563 58.6287 63.3175 175.4183 76 N 4.5493 9.6130 122.2717 55.4391 38.6592 175.2653 77 S 4.8989 7.0302 109.8731 56.1361 65.4191 174.4852 78 S 4.0252 8.4600 117.2290 58.9907 63.0010 173.1880 79 M 5.0474 9.0570 124.6728 53.5465 36.6740 174.3827 80 H 4.9922 9.7452 119.8841 55.9678 29.8400 174.7402 81 I 5.0881 9.0909 116.7054 59.3544 41.8038 174.2645 82 T 5.0497 8.9793 119.1318 61.9546 71.7205 172.9866 83 D 4.9147 9.0796 126.9832 53.6266 42.8910 174.7490 84 C 5.6161 9.3134 121.6265 55.1865 39.7986 172.9022 85 R 5.2564 8.9107 120.9252 53.7778 31.7091 175.0204 86 L 3.8565 8.9463 127.0896 55.2993 42.6486 177.0124 87 T 4.1195 8.5647 116.7126 61.5739 69.5901 175.4101 88 N 4.3428 8.9297 120.0713 55.8482 38.7470 176.3275 89 G 3.9063 7.9407 104.7307 45.1573 0.0000 172.9776 90 S 4.6430 7.6440 115.1307 56.5957 63.7358 173.4294 91 R 4.6852 7.9902 121.6397 54.3453 32.1798 173.5938 92 Y 4.1821 8.6405 120.4265 57.9579 39.0302 174.2492 93 P 3.5218 0.0000 0.0000 62.5650 31.6656 176.5767 94 N 4.4306 7.7991 120.1716 52.7139 37.0081 172.2291 95 C 4.4387 8.0779 116.3151 55.2445 40.1642 172.7529 96 A 5.1395 8.6084 127.3409 50.1961 21.5530 174.7261 97 Y 5.0431 9.5249 117.6403 56.2321 41.8455 175.5382 98 R 4.5474 9.2397 122.0261 55.7347 32.2471 175.4367 99 T 5.0583 8.5265 119.2894 62.1821 70.6273 174.3504 100 S 4.6770 9.0674 122.4931 55.7659 65.9042 171.3830 101 P 4.8944 0.0000 0.0000 62.6922 31.9818 175.8806 102 K 4.7519 9.3545 121.8148 54.8924 37.4007 175.1687 103 E 5.0616 8.7856 120.5695 55.0555 31.4975 175.5955 104 R 4.8646 8.8381 122.7633 54.6345 35.7898 174.2198 105 H 4.8601 9.2660 118.9174 55.6184 29.9736 175.2792 106 I 4.6416 8.5220 117.1513 60.1836 40.0478 174.6568 107 I 5.5281 8.2488 124.1994 58.7797 40.0942 175.0946 108 V 4.7290 8.2304 118.7295 59.3307 36.0713 174.2085 109 A 4.9482 8.6158 125.1139 51.0830 20.5563 175.7127 110 C 5.1874 8.5678 119.3554 55.2019 37.6562 173.1658 111 E 4.5638 8.5918 118.3046 56.4073 33.1659 175.2823 112 G 4.1778 9.5046 106.8937 44.7720 0.0000 171.9597 113 S 4.7791 8.0967 112.1329 55.3936 64.2611 171.9846 114 P 4.4068 0.0000 0.0000 62.7903 31.6454 175.7663 115 Y 4.7378 8.4770 121.2227 57.0047 38.6517 174.6077 116 V 4.4216 7.9948 119.1001 58.2951 36.5881 173.5113 117 P 4.3792 0.0000 0.0000 62.8834 30.9311 176.9038 118 V 4.3739 8.6796 115.9695 61.2106 34.2311 175.5898 119 H 5.1965 7.7793 116.3476 53.9671 33.4486 171.9840 120 F 4.6702 8.9656 124.2430 57.6023 39.6620 174.3574 121 D 4.5677 8.1962 126.6656 55.3415 41.5705 175.9071 122 A 4.6764 6.5328 116.9829 51.4568 22.6768 173.9482 123 S 5.2390 8.7304 112.4747 56.8832 66.5510 173.9478 124 V 4.5322 8.8636 114.0224 59.0934 34.8697 174.9693 125 E 4.2501 8.9397 125.8033 56.5235 30.1342 175.9571 126 D 4.6350 8.6842 125.9025 54.2364 42.1362 175.1174 127 S 4.6485 8.2203 118.5808 56.7217 65.6453 173.7775 128 T 4.0712 8.6309 119.7041 64.2850 68.1643 174.1203 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 4.34 0.00 1.74 1.80 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.39 7.81 2 E 8.77 3.84 0.00 2.06 1.86 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 2.32 2.38 0.00 3 S 9.30 4.40 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 R 8.55 3.90 0.00 1.86 1.99 0.00 3.33 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.71 0.00 5 A 7.99 4.18 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 6 K 8.31 4.05 0.00 1.81 1.90 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.61 7.81 7 K 8.53 4.07 0.00 1.91 2.02 0.00 1.66 0.00 0.00 1.61 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.59 1.46 7.81 8 F 8.61 4.10 0.00 3.21 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 9 Q 8.20 3.99 0.00 2.42 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.50 2.54 0.00 10 R 7.97 3.90 0.00 1.80 2.09 0.00 3.35 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 11 Q 8.19 4.08 0.00 1.79 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.48 0.00 0.00 0.00 0.00 0.00 2.27 2.48 0.00 12 H 7.85 4.74 0.00 1.89 2.64 0.00 5.59 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 8.02 4.83 0.00 1.96 2.14 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.62 0.00 14 D 9.15 4.76 0.00 2.61 2.61 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 15 S 8.64 4.44 0.00 3.94 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 16 D 8.08 4.68 0.00 2.65 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 17 S 8.20 4.36 0.00 3.99 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 18 S 8.43 4.06 0.00 3.76 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 19 P 0.00 3.92 0.00 2.02 2.02 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 1.85 1.81 0.00 20 S 7.49 4.32 0.00 3.78 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 21 S 7.81 3.88 0.00 3.66 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 22 S 8.42 4.47 0.00 4.02 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 23 S 8.57 4.23 0.00 4.03 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 T 7.54 4.28 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 1.23 0.00 0.00 25 Y 8.08 4.07 0.00 3.09 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 26 C 8.49 4.14 0.00 3.17 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 N 8.24 4.38 0.00 2.91 2.91 0.00 0.00 7.15 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 28 Q 7.80 3.96 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.52 0.00 29 M 7.84 3.69 0.00 0.88 1.33 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.56 0.00 30 M 8.20 3.99 0.00 1.72 1.90 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 2.40 0.00 31 L 7.51 3.92 0.00 1.87 1.80 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 32 L 8.06 3.95 0.00 1.52 1.63 0.79 0.84 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 33 R 7.86 4.36 0.00 1.90 2.10 0.00 3.59 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.89 0.00 34 N 8.03 4.18 0.00 2.83 2.87 0.00 0.00 6.76 7.79 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 35 M 8.33 4.59 0.00 1.99 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 2.47 2.39 0.00 36 T 7.63 5.38 4.38 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 1.38 0.00 0.00 37 Q 8.22 4.27 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.74 0.00 0.00 0.00 0.00 0.00 2.46 2.32 0.00 38 G 10.46 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 39 R 7.37 4.12 0.00 1.90 1.80 0.00 2.74 0.00 0.00 3.11 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.57 0.00 40 C 8.71 4.78 0.00 3.05 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 41 K 8.07 4.18 0.00 1.83 1.81 0.00 1.79 0.00 0.00 1.68 0.00 0.00 3.26 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.63 1.41 7.81 42 P 0.00 4.57 0.00 2.19 2.32 0.00 3.76 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.03 0.00 43 V 7.62 5.16 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 0.73 0.00 0.00 0.97 0.00 0.00 44 N 9.20 4.85 0.00 2.60 2.25 0.00 0.00 6.85 6.82 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 45 T 8.02 4.83 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 0.88 0.00 0.00 46 F 8.85 4.89 0.00 2.95 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 47 V 8.80 4.36 2.18 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 1.16 0.00 0.00 1.07 0.00 0.00 48 H 8.72 5.38 0.00 3.06 3.20 0.00 5.62 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.78 4.82 0.00 1.96 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 2.32 0.00 50 P 0.00 4.36 0.00 2.19 2.01 0.00 3.80 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.18 0.00 51 L 7.98 4.03 0.00 1.82 1.74 1.03 0.88 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 52 V 7.84 3.91 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 0.87 0.00 0.00 0.96 0.00 0.00 53 D 8.02 4.39 0.00 2.88 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 54 V 7.83 3.81 2.32 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 1.23 0.00 0.00 1.06 0.00 0.00 55 Q 8.59 3.95 0.00 2.27 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.54 0.00 56 N 8.43 4.65 0.00 2.96 2.94 0.00 0.00 6.61 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 57 V 7.71 3.68 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 1.03 0.00 0.00 58 C 7.72 3.51 0.00 2.33 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 0.00 0.00 0.00 59 F 7.54 4.95 0.00 3.00 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 60 Q 7.60 4.65 0.00 2.24 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 61 E 8.84 4.44 0.00 2.14 1.87 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 2.26 2.27 0.00 62 K 8.76 4.02 0.00 1.72 1.61 0.00 1.73 0.00 0.00 1.62 0.00 0.00 2.79 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.14 0.88 7.81 63 V 8.08 4.56 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 0.69 0.00 0.00 0.82 0.00 0.00 64 T 8.37 3.85 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 8.56 4.43 0.00 3.02 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 66 K 9.50 4.00 0.00 1.77 1.83 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.40 1.31 7.81 67 N 8.64 5.00 0.00 2.62 2.86 0.00 0.00 7.20 8.14 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 68 G 7.16 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 Q 8.45 4.47 0.00 1.92 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.34 0.00 0.00 0.00 0.00 0.00 2.20 2.36 0.00 70 G 8.13 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 0.00 0.00 0.00 71 N 8.86 4.81 0.00 2.80 2.90 0.00 0.00 6.75 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 72 C 8.34 5.35 0.00 2.88 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 73 Y 8.68 5.04 0.00 2.74 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 74 K 9.24 5.09 0.00 1.75 1.66 0.00 1.60 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.39 1.49 7.81 75 S 9.17 4.54 0.00 3.92 4.03 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 0.00 0.00 0.00 76 N 9.61 4.55 0.00 2.77 2.97 0.00 0.00 6.91 8.41 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 77 S 7.03 4.90 0.00 3.76 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 78 S 8.46 4.03 0.00 3.78 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 79 M 9.06 5.05 0.00 1.95 1.92 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.51 0.00 80 H 9.75 4.99 0.00 3.36 3.29 0.00 5.75 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 81 I 9.09 5.09 1.93 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.35 1.00 0.00 0.00 82 T 8.98 5.05 4.45 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 1.32 0.00 0.00 83 D 9.08 4.91 0.00 2.64 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 84 C 9.31 5.62 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 85 R 8.91 5.26 0.00 1.91 2.08 0.00 2.82 0.00 0.00 3.13 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.59 0.00 86 L 8.95 3.86 0.00 1.61 1.54 0.41 0.83 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 87 T 8.56 4.12 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 1.22 0.00 0.00 88 N 8.93 4.34 0.00 2.72 2.91 0.00 0.00 6.84 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 89 G 7.94 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 90 S 7.64 4.64 0.00 3.75 3.75 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 91 R 7.99 4.69 0.00 2.01 1.96 0.00 3.05 0.00 0.00 3.27 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 92 Y 8.64 4.18 0.00 2.95 2.97 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 93 P 0.00 3.52 0.00 1.76 1.00 0.00 3.63 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.66 0.00 94 N 7.80 4.43 0.00 2.62 2.82 0.00 0.00 7.05 7.59 0.00 0.00 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 8.08 4.44 0.00 3.17 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 96 A 8.61 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 97 Y 9.52 5.04 0.00 2.96 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 98 R 9.24 4.55 0.00 1.78 1.88 0.00 3.11 0.00 0.00 3.19 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 99 T 8.53 5.06 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 0.00 100 S 9.07 4.68 0.00 3.77 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 0.00 101 P 0.00 4.89 0.00 2.06 2.00 0.00 3.72 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 102 K 9.35 4.75 0.00 1.68 1.70 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.84 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.37 1.63 7.81 103 E 8.79 5.06 0.00 1.79 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 2.14 2.31 0.00 104 R 8.84 4.86 0.00 1.78 1.96 0.00 3.16 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 105 H 9.27 4.86 0.00 3.07 3.35 0.00 5.60 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 0.00 106 I 8.52 4.64 1.96 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.01 1.17 0.00 0.00 107 I 8.25 5.53 1.75 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.36 0.84 0.00 0.00 108 V 8.23 4.73 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 0.79 0.00 0.00 0.80 0.00 0.00 109 A 8.62 4.95 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 0.00 110 C 8.57 5.19 0.00 1.93 1.71 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 0.00 111 E 8.59 4.56 0.00 2.04 1.95 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 2.10 2.21 0.00 112 G 9.50 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 0.00 113 S 8.10 4.78 0.00 3.83 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 0.00 114 P 0.00 4.41 0.00 2.30 2.11 0.00 3.84 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 115 Y 8.48 4.74 0.00 2.93 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 0.00 116 V 7.99 4.42 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 0.75 0.00 0.00 0.90 0.00 0.00 117 P 0.00 4.38 0.00 0.49 1.09 0.00 3.36 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.77 0.00 118 V 8.68 4.37 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 0.61 0.00 0.00 0.84 0.00 0.00 119 H 7.78 5.20 0.00 3.03 3.16 0.00 5.60 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 8.97 4.67 0.00 2.76 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 0.00 121 D 8.20 4.57 0.00 2.57 2.48 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 0.00 122 A 6.53 4.68 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 8.73 5.24 0.00 4.05 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 0.00 124 V 8.86 4.53 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 0.71 0.00 0.00 0.96 0.00 0.00 125 E 8.94 4.25 0.00 2.00 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 2.32 2.34 0.00 126 D 8.68 4.64 0.00 2.73 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 0.00 127 S 8.22 4.65 0.00 3.82 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 0.00 128 T 8.63 4.07 4.25 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 1.22 0.00 0.00