NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2987 8.2549 117.2910 55.9932 30.8752 175.0305 3 H 4.0151 8.1965 114.7387 56.8164 29.5905 173.7413 4 L 3.8728 9.1255 122.7087 55.3263 42.8127 172.9469 5 K 4.1526 8.7003 119.3927 56.4467 30.6776 177.1490 6 S 3.9330 8.1717 114.1366 57.8691 61.9739 173.4882 7 G 3.4511 9.9975 100.1893 44.0445 0.0000 173.8569 8 R 4.3392 8.6652 125.0798 55.8851 27.8929 175.3287 9 K 4.1956 8.2453 121.3931 56.9563 33.3864 177.3152 10 L 4.2130 7.8631 117.0381 54.4663 45.0751 174.4501 11 N 4.8255 9.7813 122.7424 52.1777 39.7689 174.5003 12 R 4.3772 7.0832 123.3100 55.7359 35.0078 173.7975 13 H 5.0806 7.2618 116.1985 55.6981 32.7582 174.3864 14 S 3.5331 8.3195 111.9616 59.8182 63.9927 176.5356 15 S 4.0370 8.1690 117.6387 62.0329 63.1190 175.8154 16 H 3.9521 8.4847 119.9196 58.7372 29.3873 177.1306 17 R 3.3943 8.4895 120.0599 59.3619 30.3250 178.1133 18 L 3.8218 8.3243 120.1140 58.2826 42.1578 178.7217 19 A 4.0212 8.2800 120.7345 54.8784 18.2419 179.3919 20 L 3.7064 7.8925 119.4840 58.4319 42.1017 178.3214 21 Y 4.1795 6.8691 116.0866 61.3342 37.7155 178.9156 22 R 4.0606 7.5336 118.0132 59.8238 29.8278 178.9601 23 N 4.3735 8.1566 115.4861 55.9409 38.3267 177.6204 24 Q 4.0185 7.8702 119.1211 58.6208 29.0250 177.6176 25 A 4.2014 8.2232 122.0349 55.5197 18.1839 179.4703 26 K 3.8130 8.0454 115.2819 59.9967 32.5156 179.3760 27 S 4.2386 7.6957 114.0943 61.4708 62.8408 176.2403 28 L 4.0408 8.6768 123.7098 58.2763 41.5681 179.3257 29 L 4.5975 8.2887 116.1862 55.3934 42.0318 177.9256 30 T 4.6556 7.9804 114.6884 63.2644 71.0131 174.5417 31 H 4.8713 7.9485 114.5650 53.9969 31.3087 173.7397 32 G 4.4081 9.2001 111.1199 44.8660 0.0000 173.5969 33 R 5.2340 7.6598 116.5538 54.2817 33.1126 175.7786 34 I 4.7225 8.8542 123.0582 60.1384 42.0704 173.9430 35 T 5.0942 8.6158 122.9229 62.1981 70.9307 173.5007 36 T 4.7829 8.5426 115.8793 60.4549 72.9398 173.1172 37 T 4.3740 8.0412 111.0085 61.4889 69.6612 175.2002 38 V 3.5540 8.1225 123.8925 66.1281 31.4660 176.5537 39 P 4.2320 0.0000 0.0000 65.6635 31.2664 178.3497 40 K 3.8865 7.8781 116.4331 59.6914 31.9278 178.9353 41 A 3.9954 8.3128 120.8524 55.4144 18.1589 179.6242 42 K 3.7862 8.1776 115.8524 59.7010 31.0135 178.9159 43 E 4.0238 8.1290 118.9157 59.0695 29.6028 178.0977 44 L 4.0337 7.9499 120.4568 58.5518 42.0933 178.5626 45 R 3.6719 8.4431 112.3692 59.7261 30.0039 179.4405 46 G 3.9892 8.1240 107.7606 47.9688 0.0000 174.7669 47 F 3.9106 7.3182 122.8348 60.9429 39.5878 177.2603 48 V 3.8197 8.3057 118.7845 65.1074 31.0441 177.5889 49 D 4.3064 8.3441 119.6228 57.2340 40.8954 178.0033 50 H 4.0734 8.1297 118.4457 59.0791 29.8251 176.8096 51 L 4.1041 7.3607 120.2149 57.5970 41.7763 178.3318 52 I 3.3780 7.9889 120.1920 64.1842 36.5849 177.5017 53 H 3.6627 7.6264 118.3446 59.5084 29.3835 177.1718 54 L 3.9029 7.0282 119.6548 58.0017 42.2694 178.5936 55 A 2.7668 7.6037 120.5338 54.0582 17.7987 179.5248 56 K 3.6934 7.4075 117.1742 59.4392 32.5476 180.0024 57 R 4.4467 7.8232 114.7823 58.1480 30.0247 177.1532 58 G 4.3657 7.7408 107.2867 47.8253 0.0000 176.9352 59 D 4.7865 10.2591 124.2136 53.0393 41.1051 175.5557 60 L 4.1062 8.4169 116.1416 57.9512 43.1222 178.2146 61 H 4.0306 8.3686 117.4272 59.5595 29.4922 176.5028 62 A 4.0012 9.6448 123.3376 55.3431 17.8979 179.4198 63 R 3.5745 7.5827 116.7104 59.7291 29.8122 178.6679 64 R 4.1024 8.5758 116.3763 57.9282 30.2964 178.3543 65 L 4.2911 7.5697 118.8708 57.1335 42.0500 178.8820 66 V 3.7385 8.1971 117.4250 64.6031 31.2374 176.5243 67 L 4.4502 7.3924 116.9296 56.3225 42.2074 177.8543 68 R 4.1504 8.3418 117.7930 59.9688 30.3329 177.9661 69 D 4.6500 7.9197 116.7130 57.5091 41.6630 177.6787 70 L 4.4507 7.4498 116.2005 55.1574 42.7827 175.9687 71 Q 4.4776 8.2062 115.2071 56.0770 34.1292 174.4994 72 D 4.5492 8.0732 117.4721 53.1927 41.5516 176.0965 73 V 3.5503 8.3872 127.3712 66.1182 31.3397 177.1647 74 K 3.7848 8.2541 118.5463 59.8656 31.3838 178.1416 75 L 4.0115 7.9776 119.9373 58.0020 42.1485 179.0432 76 V 3.8062 8.5807 119.7528 64.5747 31.2297 178.8169 77 R 3.8708 8.0771 119.0139 59.1430 29.8877 178.5551 78 K 4.0022 7.8269 119.5296 59.7372 31.8175 178.0158 79 L 4.0928 7.6910 120.0604 57.9978 41.9962 178.7316 80 F 3.9961 8.7502 117.6179 59.6653 38.9393 176.4096 81 D 4.8392 8.1649 117.2492 54.9140 42.3425 177.3506 82 E 4.5434 7.9662 116.6943 56.4623 31.4752 177.7319 83 I 4.1735 7.5437 118.8439 63.3314 38.1030 177.2061 84 A 3.9435 8.0274 121.7542 55.6812 18.2000 177.0767 85 P 3.9129 0.0000 0.0000 65.9709 32.1029 179.8206 86 R 3.4466 7.1529 118.8303 59.1444 29.9026 176.7631 87 Y 4.1019 7.3768 116.1541 55.2039 38.6733 177.5581 88 R 3.6489 8.2425 122.3489 58.3743 31.6925 177.0962 89 D 4.6824 10.6100 113.9610 55.8002 42.0871 177.0265 90 R 3.8393 8.0670 116.8411 57.4149 30.1579 176.4622 91 Q 4.3640 8.5369 125.0093 53.1054 27.8697 175.3290 92 G 3.4386 7.7010 108.1534 44.5944 0.0000 171.1287 93 G 3.7799 7.7321 105.1051 46.7915 0.0000 173.0324 94 Y 4.3625 7.5426 111.5148 58.1111 39.6542 176.6746 95 T 4.9963 7.7404 114.7218 60.1411 69.7770 172.9198 96 R 4.8890 9.2515 129.3965 54.4973 33.3537 174.7964 97 V 5.5926 8.1584 123.5053 59.4237 34.2620 174.3296 98 L 4.9068 8.4832 124.2633 52.5295 45.3714 176.0138 99 K 4.4863 8.6936 121.6943 56.4439 33.1446 176.4887 100 L 4.7098 8.3876 123.3326 53.3499 44.2555 175.3836 101 A 4.6272 8.3169 121.8864 51.4881 21.1199 172.4816 102 E 3.9628 8.6804 127.5596 56.0623 30.1343 175.0476 103 R 4.6411 8.2611 124.0719 55.6245 32.0309 175.0279 104 R 4.5357 7.6696 117.9525 55.8533 31.9703 177.1180 105 R 4.7435 8.3901 123.6410 53.8545 28.5869 174.6503 106 G 4.2089 7.6355 108.7276 46.4526 0.0000 172.6941 107 D 4.5527 8.2283 113.8894 52.8061 41.7330 174.9187 108 G 3.9245 8.2432 107.2464 46.5683 0.0000 173.5212 109 A 4.3562 8.3169 122.1069 50.2667 19.1526 176.4586 110 P 4.4443 0.0000 0.0000 63.0849 32.8406 175.7293 111 L 4.7723 8.3159 121.4647 53.5634 45.3032 174.7266 112 A 5.0506 8.4566 120.0010 51.1697 23.0540 175.3789 113 L 5.2540 9.0212 120.1400 53.9745 44.1619 175.5637 114 V 4.9202 9.2323 119.8857 61.4668 34.7954 174.2342 115 E 5.9691 9.4028 126.0804 53.7476 34.5405 174.8575 116 L 4.9240 8.8629 120.7120 54.3303 41.9228 176.5046 117 V 3.2886 7.7725 122.5608 61.1685 31.8644 175.3519 118 E 4.4957 8.6272 127.7139 57.0739 29.4815 175.0952 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 2 R 8.25 4.30 0.00 1.95 2.10 0.00 3.01 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.67 0.00 3 H 8.20 4.02 0.00 3.17 3.32 0.00 5.98 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 9.13 3.87 0.00 1.79 1.72 0.93 0.66 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 5 K 8.70 4.15 0.00 1.86 2.16 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.26 1.25 7.81 6 S 8.17 3.93 0.00 3.98 3.73 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 7 G 10.00 3.45 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 0.00 0.00 0.00 0.00 8 R 8.67 4.34 0.00 1.90 2.32 0.00 3.38 0.00 0.00 3.28 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.43 0.00 9 K 8.25 4.20 0.00 1.88 1.84 0.00 1.65 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.86 1.51 7.81 10 L 7.86 4.21 0.00 1.62 1.59 0.97 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 11 N 9.78 4.83 0.00 2.60 2.65 0.00 0.00 7.20 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 12 R 7.08 4.38 0.00 1.74 1.69 0.00 2.86 0.00 0.00 2.51 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 1.12 0.00 13 H 7.26 5.08 0.00 3.33 3.38 0.00 5.68 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.32 3.53 0.00 4.12 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.17 4.04 0.00 4.09 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 16 H 8.48 3.95 0.00 2.71 3.03 0.00 5.71 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 8.49 3.39 0.00 1.79 1.96 0.00 3.21 0.00 0.00 2.94 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.18 0.00 18 L 8.32 3.82 0.00 1.74 1.93 0.96 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 19 A 8.28 4.02 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 20 L 7.89 3.71 0.00 1.50 1.34 0.84 0.54 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 21 Y 6.87 4.18 0.00 2.42 1.43 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 0.00 22 R 7.53 4.06 0.00 2.01 2.07 0.00 3.19 0.00 0.00 3.40 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.91 0.00 23 N 8.16 4.37 0.00 2.96 2.88 0.00 0.00 7.15 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 24 Q 7.87 4.02 0.00 2.31 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 25 A 8.22 4.20 1.58 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 0.00 0.00 26 K 8.05 3.81 0.00 1.76 1.95 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.10 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.54 1.80 7.81 27 S 7.70 4.24 0.00 4.10 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 28 L 8.68 4.04 0.00 1.86 1.81 0.97 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 29 L 8.29 4.60 0.00 1.76 1.69 0.94 1.05 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 30 T 7.98 4.66 4.29 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 0.97 0.00 0.00 31 H 7.95 4.87 0.00 3.24 3.26 0.00 5.76 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 9.20 4.41 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 0.00 33 R 7.66 5.23 0.00 1.67 1.84 0.00 3.45 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.79 0.00 34 I 8.85 4.72 1.91 0.00 0.00 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 1.29 1.26 0.94 0.00 0.00 35 T 8.62 5.09 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 1.28 0.00 0.00 36 T 8.54 4.78 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 1.23 0.00 0.00 37 T 8.04 4.37 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 38 V 8.12 3.55 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 1.10 0.00 0.00 0.99 0.00 0.00 39 P 0.00 4.23 0.00 2.20 2.10 0.00 3.62 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 40 K 7.88 3.89 0.00 1.92 1.91 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.48 7.81 41 A 8.31 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 42 K 8.18 3.79 0.00 1.88 1.92 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.63 7.81 43 E 8.13 4.02 0.00 2.28 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.16 0.00 44 L 7.95 4.03 0.00 1.94 1.91 0.98 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.44 3.67 0.00 1.84 1.80 0.00 3.21 0.00 0.00 3.17 8.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.88 0.00 46 G 8.12 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 0.00 0.00 0.00 47 F 7.32 3.91 0.00 2.84 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 48 V 8.31 3.82 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 0.95 0.00 0.00 0.96 0.00 0.00 49 D 8.34 4.31 0.00 3.01 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 50 H 8.13 4.07 0.00 3.16 3.30 0.00 5.77 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.36 4.10 0.00 1.84 1.57 0.56 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.99 3.38 1.36 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.50 -0.47 0.00 0.00 53 H 7.63 3.66 0.00 3.19 3.19 0.00 5.67 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 54 L 7.03 3.90 0.00 1.81 1.59 0.78 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 55 A 7.60 2.77 0.52 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 56 K 7.41 3.69 0.00 1.67 1.77 0.00 1.45 0.00 0.00 1.59 0.00 0.00 3.27 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.18 7.81 57 R 7.82 4.45 0.00 2.06 2.07 0.00 2.81 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.64 0.00 58 G 7.74 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 0.00 0.00 0.00 59 D 10.26 4.79 0.00 3.01 2.79 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 60 L 8.42 4.11 0.00 1.77 1.69 0.87 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 61 H 8.37 4.03 0.00 3.22 3.46 0.00 5.75 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 9.64 4.00 1.57 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 0.00 0.00 63 R 7.58 3.57 0.00 1.86 1.74 0.00 2.77 0.00 0.00 2.91 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.50 0.00 64 R 8.58 4.10 0.00 1.99 1.97 0.00 3.22 0.00 0.00 3.23 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 65 L 7.57 4.29 0.00 1.99 1.67 0.88 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 66 V 8.20 3.74 2.35 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 1.09 0.00 0.00 0.97 0.00 0.00 67 L 7.39 4.45 0.00 1.99 1.65 0.90 0.91 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 68 R 8.34 4.15 0.00 1.92 1.99 0.00 3.22 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.89 0.00 69 D 7.92 4.65 0.00 2.72 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 70 L 7.45 4.45 0.00 1.88 1.70 0.98 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.21 4.48 0.00 1.97 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 7.10 0.00 0.00 0.00 0.00 0.00 2.26 2.41 0.00 72 D 8.07 4.55 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 73 V 8.39 3.55 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 0.93 0.00 0.00 0.91 0.00 0.00 74 K 8.25 3.78 0.00 1.90 1.98 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.59 7.81 75 L 7.98 4.01 0.00 1.89 1.87 0.96 0.96 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 76 V 8.58 3.81 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 0.68 0.00 0.00 1.01 0.00 0.00 77 R 8.08 3.87 0.00 2.10 2.02 0.00 3.13 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.75 0.00 78 K 7.83 4.00 0.00 1.79 2.11 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.50 7.81 79 L 7.69 4.09 0.00 2.14 1.98 0.86 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 80 F 8.75 4.00 0.00 2.99 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 81 D 8.16 4.84 0.00 2.68 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 82 E 7.97 4.54 0.00 2.04 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 2.25 2.36 0.00 83 I 7.54 4.17 2.00 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 1.89 1.21 1.06 0.00 0.00 84 A 8.03 3.94 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 85 P 0.00 3.91 0.00 2.15 1.97 0.00 3.52 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.15 0.00 86 R 7.15 3.45 0.00 1.41 1.57 0.00 3.02 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.80 0.00 87 Y 7.38 4.10 0.00 3.26 3.17 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 88 R 8.24 3.65 0.00 2.19 1.99 0.00 3.41 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.72 0.00 89 D 10.61 4.68 0.00 2.74 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 90 R 8.07 3.84 0.00 1.95 2.17 0.00 3.24 0.00 0.00 3.31 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 91 Q 8.54 4.36 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.31 0.00 0.00 0.00 0.00 0.00 2.30 2.52 0.00 92 G 7.70 3.44 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 G 7.73 3.78 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 0.00 0.00 0.00 94 Y 7.54 4.36 0.00 2.51 1.58 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 95 T 7.74 5.00 4.50 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 1.25 0.00 0.00 96 R 9.25 4.89 0.00 1.88 1.75 0.00 3.11 0.00 0.00 3.23 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.54 0.00 97 V 8.16 5.59 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 0.95 0.00 0.00 0.99 0.00 0.00 98 L 8.48 4.91 0.00 1.58 1.56 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.69 4.49 0.00 1.65 1.74 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.47 7.81 100 L 8.39 4.71 0.00 1.51 1.61 0.92 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 101 A 8.32 4.63 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 0.00 102 E 8.68 3.96 0.00 2.15 2.03 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 2.19 2.32 0.00 103 R 8.26 4.64 0.00 1.79 1.99 0.00 3.19 0.00 0.00 3.22 7.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 104 R 7.67 4.54 0.00 2.11 1.83 0.00 3.11 0.00 0.00 3.42 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.74 0.00 105 R 8.39 4.74 0.00 1.80 1.90 0.00 3.24 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 106 G 7.64 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 0.00 0.00 0.00 107 D 8.23 4.55 0.00 2.74 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 0.00 108 G 8.24 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 0.00 109 A 8.32 4.36 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 0.00 110 P 0.00 4.44 0.00 2.13 2.19 0.00 3.66 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 2.07 2.00 0.00 111 L 8.32 4.77 0.00 1.60 1.60 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.46 5.05 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 0.00 113 L 9.02 5.25 0.00 1.67 1.77 0.93 0.84 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 0.00 114 V 9.23 4.92 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 1.08 0.00 0.00 0.95 0.00 0.00 115 E 9.40 5.97 0.00 1.90 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 2.24 2.12 0.00 116 L 8.86 4.92 0.00 1.66 1.88 1.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 117 V 7.77 3.29 2.36 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 0.78 0.00 0.00 1.03 0.00 0.00 118 E 8.63 4.50 0.00 2.13 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 2.06 2.22 0.00