NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 Q 4.2739 8.3293 121.7119 55.9523 30.3084 174.9794 17 S 4.4849 8.1920 119.4114 56.9147 65.7832 173.8463 18 R 3.7066 9.4021 123.9963 59.7076 30.4166 180.2908 19 S 4.2987 8.1429 114.0558 61.6052 62.8229 176.4415 20 A 4.0130 7.6943 122.6700 55.1630 18.0380 179.6170 21 K 4.1577 8.7098 113.3683 57.7980 32.1312 177.3503 22 A 4.5245 8.0287 120.3177 50.7994 20.5363 177.5270 23 G 3.9192 8.3980 103.1128 45.4045 0.0000 173.2759 24 L 4.7989 7.8428 118.8949 53.6358 43.1595 176.7788 25 T 4.4841 9.7283 117.8449 63.7773 69.6876 175.3251 26 F 4.4133 8.3799 120.6192 55.7376 40.0358 174.5491 27 P 4.4505 0.0000 0.0000 63.1741 29.7480 176.9845 28 V 3.9859 7.9735 127.3186 65.8872 31.6872 177.2531 29 G 3.7200 8.1825 104.9477 48.4991 0.0000 174.6332 30 R 3.7795 8.1980 120.3415 59.2872 29.8354 177.9785 31 V 3.5750 8.2123 117.1042 66.5876 31.3997 177.9168 32 H 4.1253 8.1255 116.5174 59.4379 29.9818 176.7644 33 R 3.9531 8.0220 120.1479 59.4062 29.4353 178.1448 34 L 3.9651 8.1970 118.7885 58.1692 41.5418 179.7868 35 L 4.3284 7.9464 117.2107 58.1043 41.4000 179.5979 36 R 4.0704 8.3306 118.4083 58.9601 30.5256 178.8972 37 R 4.2122 7.8336 117.1444 56.4151 29.9173 177.3929 38 G 3.9040 7.1811 103.3721 42.5191 0.0000 171.4898 39 N 4.0311 7.5139 116.7122 53.8203 35.4816 172.7780 40 Y 4.6444 7.8938 115.1239 58.6767 41.3012 175.6060 41 A 4.7240 7.6606 118.8833 50.4689 22.5366 175.8261 42 Q 4.0735 8.8758 120.4225 58.8706 29.1995 176.5830 43 R 4.6801 7.7005 113.3893 54.2265 33.1927 175.4763 44 I 4.4505 8.0137 119.0098 59.1939 39.5455 175.7810 45 G 3.9623 8.7746 114.6329 45.7699 0.0000 173.5517 46 S 4.2070 8.8095 117.3390 60.8843 63.3899 176.4022 47 G 3.7665 8.0624 106.8037 46.5046 0.0000 175.1552 48 A 4.0320 7.5934 122.2019 55.0774 18.3614 177.7795 49 P 4.2202 0.0000 0.0000 66.3388 31.0212 178.2999 50 V 3.5873 7.7632 117.6688 65.7225 31.7306 176.8087 51 Y 3.9820 8.4036 119.1805 60.9099 38.5408 178.6296 52 L 4.0260 8.4076 121.0274 58.5829 42.2608 178.8937 53 T 3.9463 7.9902 115.4381 66.5514 68.2063 176.5117 54 A 3.8545 8.0450 122.6788 55.1232 18.4158 179.7338 55 V 3.4718 7.3975 116.2906 66.2605 31.6306 178.2682 56 L 3.9549 8.5698 119.0191 57.4367 41.3765 179.1241 57 E 2.5400 7.8900 119.2389 59.2609 29.5877 177.6264 58 Y 4.1629 7.9372 119.2128 61.2343 38.6316 178.0615 59 L 3.3825 7.7703 118.4562 57.8562 41.9321 179.4909 60 A 3.8833 7.6152 119.8356 55.1851 18.2290 179.6583 61 A 3.8411 7.8395 119.0560 55.0734 18.6434 179.0610 62 E 3.6393 8.0481 118.3827 59.6333 29.5145 179.1226 63 I 3.5955 7.7446 118.2467 64.1363 38.0533 177.5697 64 L 3.9828 7.8644 119.8411 57.8966 41.3730 179.2623 65 E 3.8754 8.6797 119.2798 59.4833 29.8465 179.0406 66 L 4.0293 7.8640 118.3499 57.3131 41.6286 179.5607 67 A 4.0437 8.6884 121.5157 55.0353 18.1887 179.6139 68 G 3.6138 8.1768 104.2575 48.2594 0.0000 175.0960 69 N 4.3261 8.0736 119.2976 56.1924 38.3780 177.2579 70 A 3.9760 7.5905 119.8802 54.8944 18.7207 179.2926 71 A 3.5119 7.6628 119.0698 55.3142 18.4080 179.5464 72 R 3.8104 8.7780 117.4239 60.1088 30.0143 178.7238 73 D 4.4088 8.4419 117.5138 57.2802 41.1621 177.7745 74 N 4.7708 8.0875 115.7513 52.6576 38.6802 176.2583 75 K 3.7880 8.0282 117.6156 56.9461 30.4523 175.6680 76 K 4.6230 7.3554 117.1197 55.3169 34.0426 176.2541 77 T 4.3554 8.3250 115.1119 63.2720 70.3593 174.4439 78 R 4.4170 7.7539 121.3702 53.9352 30.7688 175.4792 79 I 3.9134 8.4808 127.3678 61.7151 37.6336 175.4688 80 I 4.5869 7.9867 117.6945 57.6126 40.7904 174.4192 81 P 4.2100 0.0000 0.0000 65.9415 30.8955 178.6163 82 R 4.1080 7.8870 118.0302 59.0652 29.7623 177.9705 83 H 4.2040 7.9047 115.3170 58.9123 28.7858 177.4223 84 L 4.0195 7.9690 120.0661 58.2223 41.5351 179.3943 85 Q 4.0061 8.7497 119.2959 59.0524 28.5502 178.4454 86 L 4.0525 8.3519 120.3822 57.3390 41.5866 178.8551 87 A 4.0737 8.5259 120.3580 55.3059 18.5917 179.5684 88 I 3.7909 7.8523 118.0539 64.6858 37.1448 178.7954 89 R 4.3483 7.7429 116.3941 57.9177 29.8810 177.6808 90 N 5.1452 7.4375 113.9575 51.6950 39.3673 173.7662 91 D 4.7307 7.7227 121.0423 52.2063 43.0332 175.9677 92 D 4.4442 8.8547 127.7751 57.8865 40.9848 178.9382 93 E 4.0433 8.1659 118.3216 59.3387 29.4951 179.1776 94 L 3.9452 8.7637 118.9593 58.0265 41.6841 179.2433 95 N 4.2208 8.3421 115.7178 56.1901 38.7488 176.2434 96 K 4.1417 7.3678 119.3995 59.0401 32.6312 178.2181 97 L 4.1395 7.7739 118.8554 56.6171 42.7625 176.7120 98 L 4.8561 8.0027 118.6379 53.9946 42.2382 177.6345 99 G 3.7509 8.1694 109.2489 48.1172 0.0000 174.6262 100 N 5.0016 7.9056 116.4531 52.8137 39.3460 174.6259 101 V 4.4609 7.7162 116.1838 61.2019 34.4858 174.2044 102 T 4.4937 8.3790 122.0970 61.7569 70.7753 173.7841 103 I 4.1140 8.1609 127.0363 59.3477 37.4911 175.1046 104 A 4.1535 8.3940 129.4397 53.7064 18.4743 176.8887 105 Q 3.7935 8.9616 121.0810 56.7197 26.1550 174.8943 106 G 3.5944 8.1900 110.3771 45.9568 0.0000 175.8987 107 G 3.8692 8.0819 107.2843 44.4937 0.0000 172.4492 108 V 4.5021 7.7964 110.0754 58.7988 35.0762 175.8100 109 L 3.9907 8.5485 122.7108 54.4724 41.9365 175.6825 110 P 4.2655 0.0000 0.0000 62.8870 31.7518 175.5874 111 N 4.3911 8.2442 117.9571 52.9908 41.4757 173.3802 112 I 4.4153 8.2879 126.6781 59.2556 39.4729 174.8653 113 H 4.0603 8.8471 125.3063 56.4875 30.5110 175.7030 114 Q 4.0362 8.7755 125.1180 59.3371 28.6900 178.6932 115 N 4.6024 8.5693 113.2030 55.6849 38.5813 175.4580 116 L 4.4276 7.7681 116.1572 54.6070 42.2694 176.7212 117 L 4.3675 7.9777 119.4900 53.3325 42.5298 174.7108 118 P 4.5020 0.0000 0.0000 62.7356 32.5356 176.9391 119 K 3.9430 9.6805 117.9438 56.3678 29.8348 175.7411 120 K 4.0107 8.7366 117.7715 58.1112 35.2174 177.4223 121 S 3.5578 7.8276 115.1860 59.0827 59.9498 172.2593 122 A 4.7067 7.9547 135.0000 51.0873 18.9268 174.3199 123 K 4.4900 7.7420 121.0551 54.9080 35.2277 176.2171 124 A 4.6638 8.1335 121.8899 51.9145 20.3754 177.4904 125 T 4.1502 8.0859 109.2058 62.2437 68.3825 173.6293 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 16 Q 8.33 4.27 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.85 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 17 S 8.19 4.48 0.00 4.17 3.97 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 18 R 9.40 3.71 0.00 1.81 2.07 0.00 3.21 0.00 0.00 3.20 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 19 S 8.14 4.30 0.00 3.88 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 20 A 7.69 4.01 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 21 K 8.71 4.16 0.00 1.76 1.88 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.68 1.65 7.81 22 A 8.03 4.52 1.33 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 0.00 0.00 0.00 23 G 8.40 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 24 L 7.84 4.80 0.00 1.69 1.78 0.97 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 25 T 9.73 4.48 4.52 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 1.29 0.00 0.00 26 F 8.38 4.41 0.00 3.03 3.03 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 27 P 0.00 4.45 0.00 2.25 2.19 0.00 3.42 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.89 0.00 28 V 7.97 3.99 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 1.37 0.00 0.00 0.99 0.00 0.00 29 G 8.18 3.72 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 0.00 30 R 8.20 3.78 0.00 1.93 2.09 0.00 3.26 0.00 0.00 3.25 7.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.80 0.00 31 V 8.21 3.57 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 1.12 0.00 0.00 1.05 0.00 0.00 32 H 8.13 4.13 0.00 3.29 3.56 0.00 6.01 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.02 3.95 0.00 1.98 2.06 0.00 3.20 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 34 L 8.20 3.97 0.00 1.92 1.83 0.96 0.90 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 35 L 7.95 4.33 0.00 1.92 1.80 0.92 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 36 R 8.33 4.07 0.00 1.94 1.94 0.00 3.10 0.00 0.00 3.09 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.75 0.00 37 R 7.83 4.21 0.00 1.80 1.92 0.00 3.15 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 38 G 7.18 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 0.00 0.00 0.00 39 N 7.51 4.03 0.00 2.64 2.71 0.00 0.00 6.74 7.34 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 40 Y 7.89 4.64 0.00 2.92 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 41 A 7.66 4.72 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 42 Q 8.88 4.07 0.00 2.03 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 43 R 7.70 4.68 0.00 1.81 1.82 0.00 3.21 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 44 I 8.01 4.45 1.89 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.65 0.96 0.00 0.00 45 G 8.77 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 0.00 0.00 0.00 46 S 8.81 4.21 0.00 3.97 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 47 G 8.06 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 48 A 7.59 4.03 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 49 P 0.00 4.22 0.00 2.36 2.49 0.00 3.73 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.17 0.00 50 V 7.76 3.59 2.33 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 1.05 0.00 0.00 0.96 0.00 0.00 51 Y 8.40 3.98 0.00 3.14 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 52 L 8.41 4.03 0.00 1.87 1.70 0.94 0.99 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 53 T 7.99 3.95 4.40 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 1.42 0.00 0.00 54 A 8.05 3.85 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 55 V 7.40 3.47 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 1.05 0.00 0.00 0.80 0.00 0.00 56 L 8.57 3.95 0.00 1.80 1.69 1.01 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 57 E 7.89 2.54 0.00 1.69 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 2.13 1.89 0.00 58 Y 7.94 4.16 0.00 2.93 3.10 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 59 L 7.77 3.38 0.00 1.57 1.58 0.91 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 60 A 7.62 3.88 1.30 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 0.00 0.00 61 A 7.84 3.84 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 62 E 8.05 3.64 0.00 1.29 1.74 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 2.05 2.22 0.00 63 I 7.74 3.60 1.80 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 1.15 0.93 0.00 0.00 64 L 7.86 3.98 0.00 1.96 1.71 0.98 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 65 E 8.68 3.88 0.00 2.16 1.93 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 2.29 2.48 0.00 66 L 7.86 4.03 0.00 1.74 1.68 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 67 A 8.69 4.04 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 68 G 8.18 3.61 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 0.00 0.00 0.00 69 N 8.07 4.33 0.00 2.93 2.90 0.00 0.00 6.99 7.28 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 70 A 7.59 3.98 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 71 A 7.66 3.51 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 72 R 8.78 3.81 0.00 1.88 2.00 0.00 3.13 0.00 0.00 3.32 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 73 D 8.44 4.41 0.00 2.75 2.74 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 74 N 8.09 4.77 0.00 2.84 2.83 0.00 0.00 6.94 7.25 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 75 K 8.03 3.79 0.00 1.88 1.92 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.43 7.81 76 K 7.36 4.62 0.00 1.87 1.75 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.56 7.81 77 T 8.33 4.36 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 78 R 7.75 4.42 0.00 1.76 1.85 0.00 3.25 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 79 I 8.48 3.91 1.90 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 1.49 0.67 0.95 0.00 0.00 80 I 7.99 4.59 1.81 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.64 0.95 0.00 0.00 81 P 0.00 4.21 0.00 2.29 2.23 0.00 3.57 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.15 0.00 82 R 7.89 4.11 0.00 1.84 1.87 0.00 3.22 0.00 0.00 3.31 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.61 0.00 83 H 7.90 4.20 0.00 3.41 3.48 0.00 5.71 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.97 4.02 0.00 1.86 1.73 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 85 Q 8.75 4.01 0.00 2.11 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.83 0.00 0.00 0.00 0.00 0.00 2.58 2.45 0.00 86 L 8.35 4.05 0.00 1.87 1.70 0.95 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 87 A 8.53 4.07 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 88 I 7.85 3.79 2.00 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 1.51 0.95 0.91 0.00 0.00 89 R 7.74 4.35 0.00 1.77 1.99 0.00 3.29 0.00 0.00 3.32 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.81 0.00 90 N 7.44 5.15 0.00 2.89 2.80 0.00 0.00 6.65 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 91 D 7.72 4.73 0.00 2.83 2.49 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 0.00 92 D 8.85 4.44 0.00 2.73 2.73 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 0.00 0.00 0.00 93 E 8.17 4.04 0.00 2.31 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 0.00 2.42 2.47 0.00 94 L 8.76 3.95 0.00 1.64 1.69 0.87 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.34 4.22 0.00 2.91 2.95 0.00 0.00 7.23 6.39 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 96 K 7.37 4.14 0.00 2.02 1.97 0.00 1.86 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.44 7.81 97 L 7.77 4.14 0.00 1.70 1.68 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 98 L 8.00 4.86 0.00 1.68 1.59 0.91 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 99 G 8.17 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 0.00 0.00 0.00 100 N 7.91 5.00 0.00 2.70 2.82 0.00 0.00 6.59 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 0.00 101 V 7.72 4.46 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 0.85 0.00 0.00 0.94 0.00 0.00 102 T 8.38 4.49 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 1.21 0.00 0.00 103 I 8.16 4.11 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 1.36 1.00 0.91 0.00 0.00 104 A 8.39 4.15 1.24 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 0.00 0.00 0.00 105 Q 8.96 3.79 0.00 2.23 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.00 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 106 G 8.19 3.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.08 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 0.00 108 V 7.80 4.50 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 0.78 0.00 0.00 0.93 0.00 0.00 109 L 8.55 3.99 0.00 1.63 1.63 1.02 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 110 P 0.00 4.27 0.00 2.04 2.00 0.00 3.71 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 111 N 8.24 4.39 0.00 2.60 2.65 0.00 0.00 6.94 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 0.00 112 I 8.29 4.42 1.88 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 1.31 0.80 0.93 0.00 0.00 113 H 8.85 4.06 0.00 3.17 3.17 0.00 5.68 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 0.00 114 Q 8.78 4.04 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.63 0.00 0.00 0.00 0.00 0.00 2.45 2.38 0.00 115 N 8.57 4.60 0.00 2.61 2.87 0.00 0.00 6.85 7.85 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 0.00 116 L 7.77 4.43 0.00 1.80 1.70 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 117 L 7.98 4.37 0.00 1.71 1.60 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 118 P 0.00 4.50 0.00 2.04 1.99 0.00 3.73 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 2.01 2.10 0.00 119 K 9.68 3.94 0.00 1.94 1.96 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.31 1.44 7.81 120 K 8.74 4.01 0.00 1.70 1.69 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.77 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.42 7.81 121 S 7.83 3.56 0.00 3.89 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 0.00 122 A 7.95 4.71 1.21 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 0.00 0.00 123 K 7.74 4.49 0.00 1.72 1.78 0.00 1.63 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.47 7.81 124 A 8.13 4.66 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 0.00 125 T 8.09 4.15 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 1.21 0.00 0.00