NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 M 4.4001 8.3049 120.3498 55.2188 33.4233 174.4934 1 D 4.4538 8.3542 119.2689 53.5436 41.8197 174.3549 2 I 4.3201 9.4023 123.7596 60.3234 39.6414 174.9043 3 I 4.8820 8.3617 127.3720 59.5994 39.9379 174.7777 4 L 4.9224 9.2480 127.3168 52.9716 45.6353 176.1312 5 G 4.5358 8.4479 107.1857 45.1317 0.0000 171.9825 6 I 4.6545 8.8078 122.4615 59.3743 41.9906 173.3120 7 R 4.8517 8.6864 129.9003 55.2183 30.8249 175.5572 8 V 4.4319 8.2321 124.3189 60.6215 32.9284 175.6450 9 Q 4.1244 8.9030 122.2502 60.1546 29.0331 178.4117 10 D 5.1360 7.7165 114.2524 53.3702 42.1340 175.2174 11 S 4.6946 7.6029 112.5606 57.7226 65.2917 173.3173 12 V 4.8099 8.3198 120.2948 61.1637 33.7817 174.3347 13 I 4.5670 9.0092 128.6351 59.5028 39.6677 174.3984 14 L 5.1928 8.5993 125.8946 52.7910 44.3538 175.5666 15 A 4.7902 9.1041 125.4360 50.1973 21.8880 175.1055 16 S 5.1817 8.4936 117.8552 56.3013 66.5679 174.4005 17 S 4.2982 8.7990 119.6860 58.9968 63.2367 174.5268 18 K 4.8571 8.9586 118.8367 56.0904 33.3175 176.2870 19 A 4.7201 7.8946 121.9737 51.5654 19.9476 177.4582 20 V 4.2778 8.5652 119.5579 61.6816 34.5352 174.2455 21 T 5.0330 8.6219 124.6992 61.7776 70.8590 174.4485 22 R 4.4340 8.7844 125.5610 54.8608 33.1010 178.2286 23 G 3.8727 9.0467 117.1917 46.7834 0.0000 173.3674 24 I 4.1920 8.9765 123.7544 60.8148 39.3496 174.1652 25 S 4.6526 7.7769 115.9334 57.1598 65.5390 173.6947 26 V 4.3182 8.1663 124.2150 61.6023 30.3928 175.6328 27 L 4.1869 8.3897 128.8626 57.0528 42.0780 177.9271 28 K 4.6566 7.6685 117.8825 55.2288 34.9572 175.0161 29 D 4.9672 8.6197 123.3768 52.9653 39.8638 175.8000 30 S 4.7381 7.8701 112.3526 58.7259 63.6004 173.0193 31 D 4.4600 8.6012 121.4321 55.2184 42.2806 174.3726 32 D 4.7753 8.7065 126.2022 52.1351 41.7157 177.0840 33 K 4.0284 7.8072 131.9032 54.8107 31.3532 175.9824 34 T 4.9557 7.0218 108.8073 61.1177 71.5470 173.8759 35 R 4.7794 9.0123 124.2171 54.5184 34.8206 174.0837 36 Q 4.3473 8.7794 125.1313 55.8377 29.0467 175.5135 37 L 4.2552 8.7842 127.7133 57.0386 42.4903 176.9351 38 S 4.6061 7.6446 110.6946 56.1461 65.4269 173.1255 39 P 4.2695 0.0000 0.0000 65.9405 30.7379 176.5337 40 H 5.0015 9.1835 114.8636 55.3779 30.8921 173.2863 41 T 5.0112 8.3735 115.8142 61.8688 72.2816 172.6863 42 L 5.0829 9.5218 128.7908 53.3179 45.7130 174.6380 43 M 5.4185 8.8468 124.4572 53.8734 35.4625 174.2506 44 S 5.2182 9.0664 120.9226 56.8853 66.1825 172.9174 45 F 5.6430 7.3892 114.2884 56.1030 40.9206 173.2430 46 A 4.7018 9.0706 120.9451 50.3208 22.6251 175.9709 47 G 4.0125 8.7162 106.9157 44.8185 0.0000 172.8116 48 E 3.8868 8.9937 125.1056 56.9525 29.6598 178.1688 49 A 3.7200 7.8491 128.1899 54.8280 19.7217 179.0215 50 G 3.8229 8.0397 100.8864 47.2415 0.0000 175.3129 51 D 4.5876 8.1981 120.6491 57.7575 40.9048 178.3417 52 T 3.8342 7.8705 115.6798 67.2718 68.4898 176.5645 53 V 3.2311 7.5606 118.9211 65.9697 31.9081 178.0221 54 Q 4.0692 7.8149 117.7706 58.9434 28.4836 178.9081 55 F 3.7236 8.4169 121.4891 60.9384 39.3525 176.9601 56 A 3.6926 7.4390 120.0321 55.3753 18.1025 179.5320 57 E 3.8372 8.3881 117.2895 59.4920 29.5554 179.0388 58 Y 4.0778 7.8158 119.3552 60.7712 38.8879 178.2333 59 I 3.4121 7.5087 120.7768 64.1007 37.0507 178.0296 60 Q 3.8394 8.1170 120.3825 59.1713 28.8762 178.2298 61 A 3.9172 7.8949 121.5277 55.5047 18.4212 179.3983 62 N 4.1539 7.7123 114.4867 56.4066 38.4160 177.8291 63 I 3.6015 7.6310 121.2525 64.3019 37.2229 178.4552 64 Q 3.9580 8.2655 119.1888 58.6707 28.4707 178.6632 65 L 3.8882 7.9900 121.4887 58.2817 42.1708 178.3366 66 Y 3.8223 7.9638 119.4785 60.7606 38.6600 178.2362 67 S 4.7821 8.3715 117.6173 61.2447 62.7200 176.8695 68 I 3.7143 7.5007 121.3011 64.3867 36.9692 178.1406 69 R 3.9359 7.8697 118.3226 58.7279 29.9703 177.4295 70 E 4.3047 7.8666 115.5476 54.7806 30.8815 175.1008 71 D 4.4869 8.2412 117.5712 54.6862 40.4784 171.9350 72 Y 4.8733 7.6400 115.5414 56.0959 42.2608 172.2613 73 E 4.7715 7.5075 123.7586 53.7346 31.1858 175.7480 74 L 4.0885 8.3045 126.6910 54.4546 42.5305 177.8738 75 S 4.2854 8.3439 117.0966 57.6260 65.0045 173.5455 76 P 4.1982 0.0000 0.0000 66.0785 31.1062 178.7407 77 Q 3.9342 8.0607 117.4432 59.0077 28.9799 178.0908 78 A 3.9580 7.7512 121.4302 55.1142 18.3686 179.7872 79 V 3.5584 7.9036 117.1122 66.1405 31.5238 178.4220 80 S 4.1688 8.4782 114.4394 61.6165 62.7975 176.7153 81 S 4.1319 8.2058 118.8535 61.1583 62.6492 176.3987 82 F 4.1216 8.2802 123.5549 61.3097 39.2015 177.4455 83 V 3.5689 8.2369 118.1828 65.8419 31.2200 178.0125 84 R 3.8932 8.2284 118.8612 59.3888 29.9589 178.2791 85 Q 3.9342 8.0401 119.4305 59.1749 29.1037 178.0673 86 E 3.9791 7.8604 119.3075 59.4891 29.5745 179.4155 87 L 3.9919 8.0365 118.7507 57.6447 41.4533 179.4010 88 A 4.0577 8.2046 120.3187 54.8363 18.3053 179.6051 89 K 4.0897 8.1671 117.4143 59.6110 32.1824 179.4539 90 S 4.0861 8.0679 113.3288 61.4022 62.1013 176.0483 90A I 3.7859 7.6550 120.0889 63.1019 37.6368 176.5164 90B R 4.4575 7.3456 116.9439 55.7401 30.1400 175.9630 91 S 4.6080 7.4690 114.3352 56.4477 65.1908 174.0636 92 R 3.8596 8.5803 119.7363 58.9081 29.5627 176.5852 93 R 4.3364 7.4146 119.3518 53.4184 31.2618 172.5013 94 P 4.3549 0.0000 0.0000 62.3058 32.0017 176.2592 95 Y 4.2083 8.9947 121.0537 58.3180 38.1438 176.8270 96 Q 4.4703 8.3207 126.0192 54.3098 27.6361 173.8542 97 V 4.7911 7.4927 119.5058 60.9091 35.1604 173.8586 98 N 5.1611 9.2583 124.8658 51.7808 41.3017 174.1728 99 V 5.1850 8.2773 113.9205 59.8773 36.4722 174.5048 100 L 4.8746 8.8497 121.4080 53.0674 45.3078 175.7475 101 I 4.8302 8.6282 123.7361 59.5485 39.7835 174.9437 102 G 4.1650 9.3084 115.7384 44.3828 0.0000 172.2550 103 G 4.6469 8.6332 111.2103 44.8664 0.0000 170.9548 104 Y 4.5117 8.7928 122.5173 55.3645 40.4712 175.2454 105 D 4.4002 8.1303 125.2966 54.4722 41.3988 175.6795 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 M 8.30 4.40 0.00 2.00 2.09 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.59 0.00 1 D 8.35 4.45 0.00 2.80 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 I 9.40 4.32 1.85 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 1.22 0.91 0.90 0.00 0.00 3 I 8.36 4.88 1.86 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.85 0.89 0.00 0.00 4 L 9.25 4.92 0.00 1.49 1.50 0.91 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 5 G 8.45 4.54 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 0.00 6 I 8.81 4.65 1.87 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 1.12 0.92 0.96 0.00 0.00 7 R 8.69 4.85 0.00 1.85 1.82 0.00 3.25 0.00 0.00 3.21 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 8 V 8.23 4.43 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 0.72 0.00 0.00 1.01 0.00 0.00 9 Q 8.90 4.12 0.00 2.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 7.41 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 10 D 7.72 5.14 0.00 2.71 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 11 S 7.60 4.69 0.00 3.99 3.96 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 0.00 0.00 0.00 12 V 8.32 4.81 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 0.86 0.00 0.00 1.01 0.00 0.00 13 I 9.01 4.57 1.87 0.00 0.00 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 1.23 0.40 0.91 0.00 0.00 14 L 8.60 5.19 0.00 1.47 1.52 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 15 A 9.10 4.79 1.18 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 16 S 8.49 5.18 0.00 3.60 3.60 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 17 S 8.80 4.30 0.00 3.86 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 18 K 8.96 4.86 0.00 1.72 1.89 0.00 1.93 0.00 0.00 1.77 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.25 7.81 19 A 7.89 4.72 1.22 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 0.00 0.00 20 V 8.57 4.28 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 1.00 0.00 0.00 0.96 0.00 0.00 21 T 8.62 5.03 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 22 R 8.78 4.43 0.00 1.81 1.84 0.00 3.40 0.00 0.00 3.19 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 23 G 9.05 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 0.00 0.00 0.00 24 I 8.98 4.19 1.87 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 1.42 0.92 0.91 0.00 0.00 25 S 7.78 4.65 0.00 3.84 3.70 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 26 V 8.17 4.32 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 0.84 0.00 0.00 0.93 0.00 0.00 27 L 8.39 4.19 0.00 1.71 1.73 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 28 K 7.67 4.66 0.00 1.75 1.59 0.00 1.67 0.00 0.00 1.89 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.43 7.81 29 D 8.62 4.97 0.00 2.77 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 30 S 7.87 4.74 0.00 3.83 3.90 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 31 D 8.60 4.46 0.00 2.77 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 32 D 8.71 4.78 0.00 2.72 2.60 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 33 K 7.81 4.03 0.00 1.56 1.32 0.00 1.81 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.48 1.41 7.81 34 T 7.02 4.96 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 1.31 0.00 0.00 35 R 9.01 4.78 0.00 1.85 1.79 0.00 3.38 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.74 0.00 36 Q 8.78 4.35 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 7.04 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 37 L 8.78 4.26 0.00 1.67 1.66 0.93 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 38 S 7.64 4.61 0.00 3.97 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 39 P 0.00 4.27 0.00 2.10 2.22 0.00 3.69 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.02 0.00 40 H 9.18 5.00 0.00 3.19 3.50 0.00 5.75 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 41 T 8.37 5.01 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 1.22 0.00 0.00 42 L 9.52 5.08 0.00 1.70 1.58 0.97 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 43 M 8.85 5.42 0.00 2.23 1.91 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.68 0.00 44 S 9.07 5.22 0.00 3.73 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 45 F 7.39 5.64 0.00 3.08 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 46 A 9.07 4.70 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 47 G 8.72 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 0.00 0.00 0.00 48 E 8.99 3.89 0.00 2.06 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 2.39 2.37 0.00 49 A 7.85 3.72 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 50 G 8.04 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 51 D 8.20 4.59 0.00 2.78 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.87 3.83 4.49 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 0.00 0.00 1.41 0.00 0.00 53 V 7.56 3.23 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 1.07 0.00 0.00 1.02 0.00 0.00 54 Q 7.81 4.07 0.00 2.37 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.60 0.00 0.00 0.00 0.00 0.00 2.49 2.59 0.00 55 F 8.42 3.72 0.00 2.49 2.96 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 0.00 0.00 0.00 56 A 7.44 3.69 0.72 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 57 E 8.39 3.84 0.00 2.05 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 0.00 2.32 2.37 0.00 58 Y 7.82 4.08 0.00 3.09 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 59 I 7.51 3.41 1.69 0.00 0.00 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 0.51 0.09 0.87 0.00 0.00 60 Q 8.12 3.84 0.00 2.14 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.50 0.00 61 A 7.89 3.92 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 62 N 7.71 4.15 0.00 2.71 2.49 0.00 0.00 7.11 7.19 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 63 I 7.63 3.60 1.76 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.93 0.88 0.00 0.00 64 Q 8.27 3.96 0.00 2.18 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 65 L 7.99 3.89 0.00 1.81 1.80 0.89 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 7.96 3.82 0.00 3.11 2.94 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 67 S 8.37 4.78 0.00 4.08 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 68 I 7.50 3.71 1.85 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 1.55 0.72 0.89 0.00 0.00 69 R 7.87 3.94 0.00 1.76 1.71 0.00 2.98 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 70 E 7.87 4.30 0.00 1.86 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 0.00 2.04 2.21 0.00 71 D 8.24 4.49 0.00 2.78 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 72 Y 7.64 4.87 0.00 3.12 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 73 E 7.51 4.77 0.00 1.81 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.23 0.00 74 L 8.30 4.09 0.00 1.43 1.38 -0.10 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 75 S 8.34 4.29 0.00 4.01 3.98 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 76 P 0.00 4.20 0.00 2.14 2.14 0.00 3.55 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 2.07 2.14 0.00 77 Q 8.06 3.93 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.92 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 78 A 7.75 3.96 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 79 V 7.90 3.56 2.20 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 1.13 0.00 0.00 0.82 0.00 0.00 80 S 8.48 4.17 0.00 4.10 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 81 S 8.21 4.13 0.00 4.11 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 82 F 8.28 4.12 0.00 3.04 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 83 V 8.24 3.57 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 1.14 0.00 0.00 1.06 0.00 0.00 84 R 8.23 3.89 0.00 2.05 2.01 0.00 3.16 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 85 Q 8.04 3.93 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 86 E 7.86 3.98 0.00 2.24 2.19 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 1.69 2.13 0.00 87 L 8.04 3.99 0.00 1.82 1.64 0.88 0.33 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 88 A 8.20 4.06 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 89 K 8.17 4.09 0.00 2.04 1.89 0.00 1.70 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.67 7.81 90 S 8.07 4.09 0.00 4.17 4.12 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 90A I 7.66 3.79 1.85 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 1.50 1.18 0.93 0.00 0.00 90B R 7.35 4.46 0.00 1.80 1.89 0.00 3.20 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.52 0.00 91 S 7.47 4.61 0.00 3.93 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 92 R 8.58 3.86 0.00 1.75 1.95 0.00 3.15 0.00 0.00 3.12 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 93 R 7.41 4.34 0.00 1.66 1.65 0.00 3.24 0.00 0.00 3.16 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.55 0.00 94 P 0.00 4.35 0.00 2.03 2.00 0.00 3.66 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.16 0.00 95 Y 8.99 4.21 0.00 2.69 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 96 Q 8.32 4.47 0.00 2.13 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.77 0.00 0.00 0.00 0.00 0.00 2.29 2.43 0.00 97 V 7.49 4.79 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 0.86 0.00 0.00 0.90 0.00 0.00 98 N 9.26 5.16 0.00 2.67 2.69 0.00 0.00 6.46 7.50 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 99 V 8.28 5.18 2.31 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 0.96 0.00 0.00 1.05 0.00 0.00 100 L 8.85 4.87 0.00 1.58 1.53 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 101 I 8.63 4.83 1.90 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.68 0.94 0.00 0.00 102 G 9.31 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 0.00 103 G 8.63 4.65 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 0.00 104 Y 8.79 4.51 0.00 3.01 2.91 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 0.00 105 D 8.13 4.40 0.00 2.55 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 0.00 0.00 0.00 0.00