NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2747 8.3144 121.7895 55.4366 33.1798 176.5030 2 E 4.4348 8.7535 112.8945 52.0762 33.5677 173.0426 3 T 4.2134 8.8036 118.5168 61.2525 72.1089 174.9091 4 A 4.0290 8.4621 122.6245 55.2128 18.4061 179.7990 5 A 4.1624 7.9936 118.7471 55.1412 18.5893 179.5654 6 A 4.1795 7.8737 119.6240 55.1832 18.4501 179.8248 7 K 4.0688 8.1759 118.3150 59.4315 32.2348 178.9317 8 F 4.1265 8.1982 120.6599 61.2715 39.3586 176.9667 9 E 4.0219 8.3909 118.1889 59.5438 29.0967 179.3751 10 R 3.8989 7.9047 117.3858 59.5347 30.2275 178.2039 11 Q 3.9844 7.8528 116.5968 57.8458 29.0679 176.2057 12 H 4.6599 7.8478 114.0761 54.0922 31.4437 173.2367 13 M 4.6343 8.0458 118.9456 53.9617 33.2330 176.6781 14 D 4.8212 8.8933 122.8779 53.2800 40.2469 175.6090 15 S 4.5479 8.3583 116.4930 59.1225 63.9314 176.5776 16 S 4.3501 7.8203 113.7235 60.1988 63.1021 174.4491 17 T 4.6942 7.0858 114.7318 61.5421 70.9004 174.3192 18 S 4.2660 8.4718 118.0583 60.2827 63.8553 173.9172 19 A 3.9713 6.9756 119.9446 50.8974 21.2532 175.4048 20 A 3.5868 8.6055 124.3910 52.0879 18.6415 178.2478 21 S 4.5355 8.5750 117.1491 58.4801 64.6838 173.8909 22 S 4.7904 7.5969 114.6453 56.1247 65.9006 174.4196 23 S 4.4771 8.6111 113.7012 59.6437 63.1999 174.4493 24 N 4.6886 7.9495 118.9022 54.1194 39.3074 176.2412 25 Y 3.9485 8.0293 119.8960 61.1697 38.6989 177.5801 26 C 4.2452 8.2118 116.9174 60.1010 38.5441 175.9309 27 N 4.3727 8.1490 117.6273 56.2493 38.1502 177.4503 28 Q 3.9518 7.8982 119.3159 59.2991 28.9610 178.5933 29 M 3.7100 7.5372 119.6462 58.4986 31.7249 178.7558 30 M 4.0826 8.0135 118.9462 58.1462 31.9753 179.1302 31 K 3.9906 7.6179 117.4676 59.4230 32.2468 179.2602 32 S 4.3771 8.2178 111.7801 59.7886 63.0537 175.2076 33 R 4.4077 7.4735 120.3299 54.9339 30.6435 175.3458 34 N 4.1833 7.8360 114.9359 54.6866 36.5481 174.7394 35 L 4.5401 8.1798 115.6313 54.9148 42.1983 178.0584 36 T 5.4883 7.5522 106.2076 60.1398 69.1094 174.8885 37 K 4.0316 7.8826 122.9070 59.8202 32.4718 177.4514 38 D 4.4158 7.6866 119.0103 55.8858 41.7276 176.0910 39 R 3.1847 6.8883 113.4997 55.3800 31.6386 173.6877 40 C 4.8650 8.4463 115.8855 55.2589 40.6699 173.9115 41 K 4.1964 8.3772 127.8432 55.6093 32.3450 174.8830 42 P 4.7065 0.0000 0.0000 65.5867 32.4438 176.4955 43 V 4.9924 7.6019 118.1544 61.1714 34.8293 174.0577 44 N 4.7851 9.2287 125.3147 52.6012 42.4227 172.8114 45 T 4.7803 7.9647 121.9412 61.7003 71.4475 172.9725 46 F 4.9532 8.9230 124.9425 55.7834 41.6872 174.7407 47 V 4.3928 9.0640 123.6487 61.0135 33.2971 175.7905 48 H 6.0207 8.4598 128.4824 54.0304 26.3049 173.0940 49 E 4.8044 7.6634 117.6724 53.4543 34.5485 176.5094 50 S 4.4319 8.3172 114.7220 57.9307 65.1512 174.7962 51 L 3.9650 8.5466 124.4048 58.5863 41.8707 179.2107 52 A 4.0145 8.0216 120.0120 55.3791 18.1032 179.2108 53 D 4.3427 7.7573 116.1168 57.3609 41.1473 178.8770 54 V 3.7980 7.8990 118.9327 66.0627 31.7120 178.1451 55 Q 3.9056 8.5178 118.0239 58.8312 28.6677 178.5833 56 A 4.0522 8.0100 121.4159 54.6203 18.2459 179.7033 57 V 3.4958 7.6036 117.0631 65.8700 31.3358 176.8922 58 C 3.7830 7.7353 114.5269 57.8937 39.8666 174.1003 59 S 4.6293 7.3333 113.9738 57.9104 63.7889 174.7117 60 Q 4.2449 7.4082 121.6192 55.9483 30.5076 177.0627 61 K 4.1975 7.9524 129.4634 57.1391 33.1679 175.9155 62 N 4.4371 8.8552 127.6512 53.5125 39.1262 174.2784 63 V 4.6013 8.3934 118.6933 59.0537 36.5515 175.0897 64 A 4.3506 8.3631 124.6614 52.1507 19.1092 178.5168 65 C 4.6131 9.3916 120.2855 56.0324 41.1423 175.3572 66 K 3.7638 8.6882 121.1074 59.4358 31.5979 178.4393 67 N 4.4550 7.9942 114.1856 53.4011 37.7571 175.7659 68 G 4.0195 8.0059 107.2391 45.4760 0.0000 174.2685 69 Q 4.2494 10.2208 119.2948 56.2116 29.2334 176.2070 70 T 4.6807 8.2283 108.5761 61.7547 69.3376 174.1007 71 N 5.0123 8.0257 117.3156 54.0524 38.6653 174.2140 72 C 5.2459 7.3797 116.1828 56.6336 44.2516 172.6333 73 Y 5.1180 8.9182 119.4384 56.2611 41.4514 173.9350 74 Q 5.0839 9.1823 125.4438 54.0202 31.3568 174.8711 75 S 4.3721 8.4941 121.8756 58.6132 63.1509 174.3322 76 Y 4.4538 9.3493 122.0752 60.2389 37.8389 176.0555 77 S 4.9218 7.8255 112.0939 55.9722 65.9661 173.2218 78 T 4.2528 8.0703 110.6130 61.9441 69.6912 173.6356 79 M 5.0302 9.0235 121.3446 53.4584 37.1539 174.5108 80 S 4.8366 9.3941 117.1099 58.2990 63.6444 173.1519 81 I 5.2548 8.9684 120.0152 59.6231 41.9183 174.1920 82 T 4.9768 8.7535 118.2824 61.9713 72.2674 172.6196 83 D 4.9739 9.2693 127.3112 53.1563 43.2264 174.2500 84 C 5.5766 8.9196 123.1843 55.2321 39.0986 172.9312 85 R 5.2012 8.8392 123.6426 54.1089 32.9852 174.0810 86 E 4.0968 9.2264 128.3365 56.5086 30.4645 176.7503 87 T 4.3236 8.3511 116.5967 60.4583 70.1469 176.0063 88 G 3.6445 8.4685 110.5452 48.0466 0.0000 174.8499 89 S 4.3591 7.3775 112.0771 59.0727 63.7569 174.7576 90 S 4.1579 7.3737 116.6223 58.2528 62.7162 173.5273 91 K 4.5210 8.8582 125.7863 55.2431 35.2704 174.9692 92 Y 4.3910 8.7760 125.2575 57.5852 39.0910 173.5903 93 P 3.8228 0.0000 0.0000 62.4376 31.7134 176.2826 94 N 4.6785 8.4558 120.4918 52.4717 37.1609 172.3557 95 C 4.6633 8.2134 118.2355 56.0694 39.9208 173.1226 96 A 4.9241 8.4071 125.0247 50.3807 21.8716 174.5283 97 Y 5.0971 8.6476 118.1206 56.0209 42.4957 174.5964 98 K 4.5855 9.3840 123.4550 55.4337 34.3234 175.1016 99 T 5.0589 8.5576 123.8460 62.5862 70.2634 174.2659 100 T 4.5200 8.8796 122.6539 61.7670 71.8887 172.8860 101 Q 4.7555 8.7250 128.0227 55.6976 30.3122 174.3899 102 A 4.5252 8.5004 125.8715 51.5551 23.7609 174.5886 103 N 5.4281 8.6037 116.1750 51.8881 41.0493 174.3285 104 K 4.5160 8.8231 122.3599 55.8945 36.8529 174.7617 105 H 4.9620 8.7544 117.3383 55.8434 30.0130 174.8737 106 I 4.9147 8.5078 114.6556 59.2333 41.0278 174.2488 107 I 4.9626 8.1439 123.9861 59.6892 40.1622 175.1787 108 V 4.7411 8.6388 118.8268 59.4303 36.3487 174.1620 109 A 5.0807 8.5839 124.6648 50.9075 20.6818 175.7343 110 C 5.2308 8.4583 119.7100 55.2106 41.8650 172.8526 111 E 4.6070 8.6269 117.5891 57.2549 32.8835 176.2253 112 G 3.9464 10.2395 106.5984 44.8702 0.0000 172.7769 113 N 4.7682 8.2740 120.3450 51.6566 40.1785 173.4796 114 P 4.3719 0.0000 0.0000 62.4192 32.1407 175.9192 115 Y 4.5291 8.4377 121.3101 58.0579 38.6884 174.7685 116 V 4.4510 8.2848 119.5154 58.2450 36.6903 173.5190 117 P 4.3392 0.0000 0.0000 63.1578 30.9826 176.9106 118 V 4.4572 8.6118 115.7154 61.0057 34.0693 175.2278 119 H 5.0731 7.8699 119.9445 54.7338 33.5635 171.6464 120 F 4.6739 8.7990 127.8641 57.4808 39.4556 174.4899 121 D 4.5408 8.4171 126.7258 55.9898 41.5255 175.8476 122 A 4.7781 7.0003 117.2682 51.2945 22.8060 174.1283 123 S 5.2988 8.7654 113.4263 56.6161 65.9258 174.7071 124 V 4.1527 8.7436 121.3358 62.1035 31.0211 175.0226 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 4.27 0.00 1.74 1.64 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.44 7.81 2 E 8.75 4.43 0.00 2.00 1.76 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 2.21 2.37 0.00 3 T 8.80 4.21 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 1.22 0.00 0.00 4 A 8.46 4.03 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 5 A 7.99 4.16 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 A 7.87 4.18 1.38 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 0.00 0.00 0.00 7 K 8.18 4.07 0.00 1.99 2.04 0.00 1.66 0.00 0.00 1.61 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.44 7.81 8 F 8.20 4.13 0.00 3.15 3.23 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 9 E 8.39 4.02 0.00 2.33 2.06 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 2.51 2.71 0.00 10 R 7.90 3.90 0.00 1.81 1.94 0.00 3.37 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 1.62 1.67 0.00 11 Q 7.85 3.98 0.00 1.50 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.47 0.00 0.00 0.00 0.00 0.00 2.24 2.50 0.00 12 H 7.85 4.66 0.00 2.16 2.74 0.00 5.61 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 8.05 4.63 0.00 1.97 2.16 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.68 0.00 14 D 8.89 4.82 0.00 2.77 2.55 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 0.00 0.00 0.00 15 S 8.36 4.55 0.00 3.96 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 16 S 7.82 4.35 0.00 4.03 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 17 T 7.09 4.69 4.10 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 0.00 0.00 0.00 1.25 0.00 0.00 18 S 8.47 4.27 0.00 3.94 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 19 A 6.98 3.97 1.12 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 0.00 0.00 20 A 8.61 3.59 0.74 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 0.00 0.00 21 S 8.58 4.54 0.00 3.97 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 22 S 7.60 4.79 0.00 3.99 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 23 S 8.61 4.48 0.00 4.04 4.05 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 0.00 0.00 0.00 24 N 7.95 4.69 0.00 2.74 2.89 0.00 0.00 6.54 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 25 Y 8.03 3.95 0.00 2.99 2.95 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 26 C 8.21 4.25 0.00 3.11 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 8.15 4.37 0.00 2.80 2.92 0.00 0.00 7.15 7.68 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 28 Q 7.90 3.95 0.00 2.15 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 29 M 7.54 3.71 0.00 0.85 1.21 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.67 0.00 30 M 8.01 4.08 0.00 1.73 1.91 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.51 0.00 31 K 7.62 3.99 0.00 2.11 1.82 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.47 7.81 32 S 8.22 4.38 0.00 3.92 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 33 R 7.47 4.41 0.00 1.94 2.00 0.00 3.63 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 2.01 0.00 34 N 7.84 4.18 0.00 2.87 2.89 0.00 0.00 6.83 7.99 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 35 L 8.18 4.54 0.00 1.77 1.62 0.82 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.55 5.49 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 1.42 0.00 0.00 37 K 7.88 4.03 0.00 1.92 1.82 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.46 1.49 7.81 38 D 7.69 4.42 0.00 2.59 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 39 R 6.89 3.18 0.00 1.80 1.71 0.00 2.93 0.00 0.00 3.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.46 0.00 40 C 8.45 4.86 0.00 3.10 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 41 K 8.38 4.20 0.00 1.84 1.75 0.00 1.73 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.37 7.81 42 P 0.00 4.71 0.00 2.19 2.31 0.00 3.73 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.98 0.00 43 V 7.60 4.99 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 0.78 0.00 0.00 0.97 0.00 0.00 44 N 9.23 4.79 0.00 2.62 2.25 0.00 0.00 6.79 7.44 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 45 T 7.96 4.78 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 0.87 0.00 0.00 46 F 8.92 4.95 0.00 2.99 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 47 V 9.06 4.39 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 1.06 0.00 0.00 1.04 0.00 0.00 48 H 8.46 6.02 0.00 3.06 3.48 0.00 5.61 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.66 4.80 0.00 1.94 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 2.26 2.27 0.00 50 S 8.32 4.43 0.00 4.07 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 51 L 8.55 3.97 0.00 1.83 1.75 1.02 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.02 4.01 1.34 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 0.00 0.00 53 D 7.76 4.34 0.00 2.86 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 54 V 7.90 3.80 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 1.25 0.00 0.00 1.06 0.00 0.00 55 Q 8.52 3.91 0.00 2.28 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.32 2.53 0.00 56 A 8.01 4.05 1.40 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 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.60 3.50 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 1.06 0.00 0.00 0.93 0.00 0.00 58 C 7.74 3.78 0.00 2.90 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 59 S 7.33 4.63 0.00 3.93 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 60 Q 7.41 4.24 0.00 1.65 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.95 0.00 0.00 0.00 0.00 0.00 1.85 2.17 0.00 61 K 7.95 4.20 0.00 2.06 1.86 0.00 1.57 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.51 1.45 7.81 62 N 8.86 4.44 0.00 2.87 2.72 0.00 0.00 7.01 7.71 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 63 V 8.39 4.60 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 0.68 0.00 0.00 0.82 0.00 0.00 64 A 8.36 4.35 1.19 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 0.00 0.00 65 C 9.39 4.61 0.00 3.10 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 66 K 8.69 3.76 0.00 1.78 1.89 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.38 7.81 67 N 7.99 4.46 0.00 2.79 2.92 0.00 0.00 6.29 7.00 0.00 0.00 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 8.01 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 0.00 0.00 0.00 69 Q 10.22 4.25 0.00 2.14 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.85 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 70 T 8.23 4.68 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 1.16 0.00 0.00 71 N 8.03 5.01 0.00 3.05 3.12 0.00 0.00 6.03 7.68 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 72 C 7.38 5.25 0.00 2.96 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 73 Y 8.92 5.12 0.00 2.83 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 0.00 74 Q 9.18 5.08 0.00 2.02 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 75 S 8.49 4.37 0.00 3.95 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 76 Y 9.35 4.45 0.00 2.99 2.95 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 77 S 7.83 4.92 0.00 3.99 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 78 T 8.07 4.25 4.27 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 1.02 0.00 0.00 79 M 9.02 5.03 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.50 0.00 80 S 9.39 4.84 0.00 3.91 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 81 I 8.97 5.25 1.87 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 1.27 0.66 1.05 0.00 0.00 82 T 8.75 4.98 4.34 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 1.18 0.00 0.00 83 D 9.27 4.97 0.00 2.77 2.55 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 0.00 0.00 0.00 84 C 8.92 5.58 0.00 3.00 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 85 R 8.84 5.20 0.00 2.11 1.79 0.00 3.14 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 86 E 9.23 4.10 0.00 2.08 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.59 0.00 87 T 8.35 4.32 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 1.19 0.00 0.00 88 G 8.47 3.64 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 0.00 0.00 0.00 89 S 7.38 4.36 0.00 4.07 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 90 S 7.37 4.16 0.00 3.80 3.83 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 91 K 8.86 4.52 0.00 1.89 1.84 0.00 1.53 0.00 0.00 1.69 0.00 0.00 2.81 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.29 1.50 7.81 92 Y 8.78 4.39 0.00 2.90 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 93 P 0.00 3.82 0.00 1.75 0.94 0.00 3.58 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 94 N 8.46 4.68 0.00 2.75 2.76 0.00 0.00 7.04 5.37 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 95 C 8.21 4.66 0.00 3.12 3.02 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 96 A 8.41 4.92 1.14 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 0.00 0.00 97 Y 8.65 5.10 0.00 2.89 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 98 K 9.38 4.59 0.00 1.82 1.82 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.44 7.81 99 T 8.56 5.06 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 1.27 0.00 0.00 100 T 8.88 4.52 4.27 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 1.23 0.00 0.00 101 Q 8.73 4.76 0.00 1.96 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.75 0.00 0.00 0.00 0.00 0.00 2.24 2.38 0.00 102 A 8.50 4.53 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 0.00 103 N 8.60 5.43 0.00 2.57 2.73 0.00 0.00 6.68 7.61 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 0.00 104 K 8.82 4.52 0.00 1.83 1.89 0.00 1.34 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.48 7.81 105 H 8.75 4.96 0.00 3.20 3.28 0.00 5.76 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.51 4.91 1.79 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.76 1.10 0.00 0.00 107 I 8.14 4.96 1.75 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 1.14 0.61 0.84 0.00 0.00 108 V 8.64 4.74 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 0.65 0.00 0.00 0.81 0.00 0.00 109 A 8.58 5.08 1.27 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 0.00 0.00 110 C 8.46 5.23 0.00 1.87 1.70 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 0.00 111 E 8.63 4.61 0.00 2.03 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 2.04 2.13 0.00 112 G 10.24 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 0.00 113 N 8.27 4.77 0.00 2.64 2.71 0.00 0.00 6.85 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 0.00 114 P 0.00 4.37 0.00 2.23 2.05 0.00 3.83 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 115 Y 8.44 4.53 0.00 2.79 2.93 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 0.00 116 V 8.28 4.45 1.94 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 0.68 0.00 0.00 0.90 0.00 0.00 117 P 0.00 4.34 0.00 0.49 1.25 0.00 3.35 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 1.71 1.82 0.00 118 V 8.61 4.46 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 0.63 0.00 0.00 0.94 0.00 0.00 119 H 7.87 5.07 0.00 3.27 3.11 0.00 5.85 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.80 4.67 0.00 2.62 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 0.00 121 D 8.42 4.54 0.00 2.60 2.50 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 0.00 122 A 7.00 4.78 1.20 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 0.00 0.00 123 S 8.77 5.30 0.00 4.05 4.10 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 0.00 0.00 0.00 0.00 124 V 8.74 4.15 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 0.70 0.00 0.00 0.96 0.00 0.00