NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3188 8.3001 120.3499 54.0784 32.4953 173.5185 2 A 4.2352 7.5653 123.6555 51.4752 22.1476 172.3087 3 E 4.7123 8.3251 118.5276 56.1101 34.2173 174.1739 4 A 4.6125 7.8416 118.1338 50.7873 20.0579 174.2208 5 L 4.2671 7.3740 114.3378 52.3868 45.3987 175.5462 6 F 3.9957 8.8219 126.9549 61.1457 38.7046 176.1313 7 K 3.6931 7.7120 116.4904 60.1937 31.5588 178.1839 8 Q 3.8889 7.7974 118.4682 59.8056 28.6897 178.4584 9 L 3.7787 7.4615 119.8982 57.3257 41.6576 178.6969 10 D 3.8417 7.6354 116.6826 55.7024 41.3612 176.5797 11 A 4.0666 8.7590 126.9568 53.0086 18.0848 179.7589 12 N 3.9464 7.7659 112.4034 54.8908 38.7052 176.4782 13 G 4.2251 7.6964 104.0999 46.2625 0.0000 174.1441 14 D 4.3849 7.5549 119.0434 53.4917 39.7839 177.1795 15 G 4.3666 8.5935 113.2671 46.4005 0.0000 173.8234 16 S 4.7311 7.4183 113.1533 56.5188 64.9004 173.3981 17 V 4.0100 8.6232 120.8677 60.7432 34.5517 171.2235 18 S 4.6263 8.1390 115.4096 57.7548 62.5794 173.8331 19 Y 3.6032 8.3318 127.5148 61.3072 37.6706 177.9146 20 E 3.8231 8.4587 120.1388 59.6542 29.5217 178.8169 21 E 4.0915 9.2065 118.7197 59.2265 29.7235 179.3521 22 V 3.8735 7.4626 119.4563 64.0633 31.6680 178.4478 23 K 3.7914 8.7940 120.3620 59.0776 31.8194 179.1656 24 A 4.1066 7.9693 120.9526 55.0211 18.2518 179.1260 25 F 4.1251 8.0335 118.0100 61.7975 39.6413 177.2761 26 V 2.7476 7.3807 117.3511 65.3773 31.1671 177.8181 27 S 4.0480 7.9020 112.8637 60.5307 62.0817 174.3408 28 S 4.9669 7.8291 115.4268 56.7779 63.3237 174.5615 29 K 4.5123 8.1449 116.3323 57.2248 33.5640 178.6168 30 R 4.0716 9.0576 122.5862 59.0745 31.5784 175.8375 31 P 4.5965 0.0000 0.0000 63.5769 33.1644 173.0804 32 I 4.7262 7.8220 115.7582 62.6475 44.6245 175.6233 33 K 4.5964 8.9741 118.6256 53.6624 34.7618 176.1732 34 N 5.3707 8.8446 134.0952 54.1753 38.2285 176.3974 35 E 4.0659 7.8215 117.3720 60.0587 28.9930 178.1445 36 Q 4.0941 8.1372 120.7596 57.9022 29.1389 177.1897 37 L 3.9978 7.8700 118.9190 58.7955 41.9026 179.0846 38 L 4.0440 8.5947 119.0308 57.0835 41.3906 179.1268 39 Q 4.0456 8.6803 119.0457 60.3424 29.2537 179.2643 40 L 4.0879 8.9865 120.4445 56.9570 41.4430 178.8794 41 I 3.6017 8.4841 118.5188 64.6422 38.0987 177.9216 42 F 4.3248 8.9657 118.8559 60.8238 38.5938 177.5318 43 K 3.8310 8.6398 116.9241 59.9480 32.0122 178.6720 44 A 4.2019 7.9793 119.4711 54.5676 18.6276 178.9827 45 I 3.8370 8.3673 116.7054 62.3816 38.3656 176.0929 46 D 4.2328 8.5762 118.8640 52.6080 40.8753 175.8841 47 I 3.6120 6.0829 115.2936 62.1969 36.3322 175.1384 48 D 4.6021 7.8810 118.0352 54.6283 41.0911 175.3713 49 G 3.9289 6.9966 106.6785 46.3366 0.0000 174.3141 50 N 3.9526 7.4843 124.9045 49.8633 40.7200 173.2871 51 G 3.3466 8.0909 117.6652 44.3152 0.0000 172.5405 52 E 4.3791 7.3689 121.4102 55.5077 30.2117 176.2799 53 I 4.0899 8.1892 126.2367 59.7051 40.1835 173.9429 54 D 5.4011 7.9023 121.3936 51.2803 43.7467 176.5916 55 L 3.9899 9.2192 124.9768 58.1828 41.4766 179.6472 56 A 4.0505 9.3005 120.9250 55.3002 18.4248 179.1302 57 E 3.9611 8.4973 116.8149 59.8048 29.5298 179.7995 58 F 4.2976 8.7601 120.2187 61.6812 39.5146 177.1070 59 T 3.5016 8.7322 115.8161 66.3961 68.3074 176.3082 60 K 3.8919 9.0192 121.6906 60.5233 32.2935 178.7267 61 F 4.0152 8.6136 119.0238 60.0117 38.7313 177.5848 62 A 3.8742 8.0860 120.1659 55.1244 18.3359 179.5157 63 A 3.9526 8.3825 118.9317 54.5132 18.1973 179.5819 64 A 4.0807 8.0429 119.8098 54.8008 18.6823 179.7001 65 V 3.7227 7.8181 117.1841 64.1535 31.8031 178.1940 66 K 3.9671 7.9682 120.0115 58.4117 32.4432 177.1648 67 E 3.8724 7.0245 115.8383 57.3424 30.3467 177.8660 68 Q 4.3884 8.0735 125.0300 52.9808 28.3290 175.0436 69 D 4.9334 7.0188 120.8157 52.9512 43.3560 173.6333 70 L 4.2641 6.6341 132.2370 55.0292 47.8911 175.5815 71 S 4.1337 7.8458 112.2565 61.6126 62.4014 175.5665 72 D 4.8031 8.1594 120.9644 57.7475 40.3817 178.5864 73 E 3.9138 8.2393 117.5805 59.6702 29.7468 178.8628 74 K 4.2318 7.7890 116.6194 59.2895 32.1836 179.2847 75 V 3.7301 8.7933 119.8780 66.4872 31.2936 177.8170 76 G 4.1213 8.4456 105.3372 48.0646 0.0000 175.4371 77 L 4.1911 8.0069 122.4253 58.0405 40.4450 178.8907 78 K 4.2758 8.5795 121.3157 59.4577 32.2183 178.5294 79 I 3.7524 8.9999 121.2144 64.8262 37.1298 178.4591 80 L 4.2077 8.4596 119.6825 57.9610 41.3494 178.7405 81 Y 3.6022 8.3631 119.2015 60.1528 38.6965 178.0414 82 K 4.2608 8.1016 118.7071 60.3188 33.4625 178.2002 83 L 4.0087 8.4540 122.3802 56.9533 41.7479 178.2442 84 M 4.0688 8.8485 121.0135 58.1070 33.2458 177.4677 85 D 4.3857 7.4397 117.2349 54.2124 39.5347 174.5397 86 A 4.4205 8.0404 126.9748 52.4067 20.8149 177.7541 87 D 4.5492 8.0110 113.9159 56.1041 42.2787 177.5359 88 G 4.1579 8.1011 107.1833 48.2303 0.0000 174.6302 89 D 4.6645 7.9013 116.2800 53.0454 38.7337 174.5269 90 G 4.2708 6.1841 119.5227 45.4378 0.0000 173.2269 91 K 4.7155 7.2799 119.9398 54.6468 34.7567 175.2623 92 L 4.8964 8.9044 124.9059 53.5202 43.1435 176.4355 93 T 3.4493 9.0884 114.9887 61.8103 70.0850 174.9410 94 K 3.8348 8.7970 118.6245 58.7074 33.7212 177.9934 95 E 4.3569 8.3666 118.8356 59.7973 29.8788 178.8689 96 E 3.9239 7.6649 117.6877 60.2138 29.5401 179.2858 97 V 3.7610 8.9703 118.2481 66.2579 31.6559 178.8106 98 T 3.8552 8.8132 109.2527 64.9510 68.8606 175.7435 99 T 3.8390 8.3494 117.2387 65.0712 67.4172 175.2435 100 F 4.4220 9.1277 123.5702 61.3231 39.1848 176.5526 101 F 4.1407 9.5431 117.3245 60.8668 38.8577 178.0889 102 K 4.0085 8.2892 118.7875 59.5309 31.8917 179.1908 103 K 3.9673 8.7209 118.4531 59.0120 31.9155 178.8051 104 F 3.8996 8.0803 117.9800 58.9307 39.5247 175.1414 105 G 3.5264 6.5197 107.2511 46.1891 0.0000 173.6173 106 Y 4.9016 8.2495 113.3027 56.1336 39.1514 177.3340 107 E 4.0214 8.1394 122.8100 59.2204 29.9591 177.1871 108 K 4.1044 8.0805 118.7537 58.7780 32.0523 178.7055 109 V 3.4536 7.6857 119.0405 65.7411 31.3976 177.7912 110 V 3.3689 7.5922 118.2977 66.2652 31.1898 177.5614 111 D 4.3018 7.7560 117.2355 57.6404 41.1953 178.3902 112 Q 4.1522 8.0293 117.8452 58.6103 28.8391 178.8181 113 I 3.5769 8.6471 122.2669 64.6772 37.0059 178.1463 114 M 4.0518 8.1469 117.8480 57.9858 32.1466 177.2856 115 K 4.2376 7.9131 117.3966 57.1796 32.6430 178.1093 116 A 4.0839 7.7491 120.7386 54.6089 19.2229 176.9567 117 D 4.5446 7.6649 116.6200 52.6647 42.3741 176.5557 118 A 5.9400 7.2986 135.0000 53.7556 21.3282 176.9612 119 N 4.7920 7.9930 117.6097 54.1183 39.2142 176.5033 120 G 4.6777 6.9070 109.0359 45.5892 0.0000 173.3622 121 D 4.2192 7.2049 118.7958 54.6902 43.6963 178.0841 122 G 4.2081 8.1770 104.6204 45.5633 0.0000 171.7568 123 Y 5.1191 6.8134 115.4801 55.2138 41.8643 174.4860 124 I 5.6499 10.4646 118.8441 59.2111 41.3133 175.7944 125 T 4.7304 9.0024 116.9381 60.4413 71.2518 175.5670 126 L 2.6484 7.8480 120.4298 58.1082 41.4398 179.1558 127 E 3.6111 8.2502 117.8796 60.3000 29.3925 178.2856 128 E 3.7886 7.9347 115.9945 59.2492 29.6152 178.8181 129 F 4.1668 8.2195 115.9337 60.4747 37.7046 177.4643 130 L 3.0691 6.5792 120.5956 56.5148 41.3585 178.8064 131 A 3.9338 8.1449 121.5047 54.9824 18.4205 178.9922 132 F 4.2396 8.2347 118.1359 60.2889 40.7409 175.1520 133 N 4.9384 7.7084 113.5106 51.0900 38.8999 174.2098 134 L 4.2046 7.6788 121.1202 55.6161 40.7779 177.3355 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 4.32 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.61 0.00 2 A 7.57 4.24 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 3 E 8.33 4.71 0.00 1.96 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 2.47 2.30 0.00 4 A 7.84 4.61 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 5 L 7.37 4.27 0.00 1.67 1.54 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 6 F 8.82 4.00 0.00 2.85 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 7 K 7.71 3.69 0.00 1.76 1.72 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.62 7.81 8 Q 7.80 3.89 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.13 0.00 0.00 0.00 0.00 0.00 2.46 2.34 0.00 9 L 7.46 3.78 0.00 1.21 1.45 0.80 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 10 D 7.64 3.84 0.00 1.60 2.29 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 0.00 11 A 8.76 4.07 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 12 N 7.77 3.95 0.00 2.93 2.88 0.00 0.00 6.91 8.26 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 13 G 7.70 4.23 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 0.00 14 D 7.55 4.38 0.00 2.62 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 15 G 8.59 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 16 S 7.42 4.73 0.00 3.97 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 17 V 8.62 4.01 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 1.36 0.00 0.00 1.08 0.00 0.00 18 S 8.14 4.63 0.00 4.07 4.09 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 19 Y 8.33 3.60 0.00 2.67 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 20 E 8.46 3.82 0.00 2.01 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 0.00 2.40 2.37 0.00 21 E 9.21 4.09 0.00 2.25 2.27 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 2.62 2.65 0.00 22 V 7.46 3.87 1.02 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 0.20 0.00 0.00 -0.72 0.00 0.00 23 K 8.79 3.79 0.00 1.82 1.86 0.00 1.76 0.00 0.00 1.59 0.00 0.00 2.53 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.19 1.68 7.81 24 A 7.97 4.11 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 25 F 8.03 4.13 0.00 3.00 3.34 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 26 V 7.38 2.75 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.16 0.00 0.00 27 S 7.90 4.05 0.00 4.04 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 28 S 7.83 4.97 0.00 3.97 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 29 K 8.14 4.51 0.00 1.70 1.34 0.00 1.72 0.00 0.00 1.66 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.28 1.35 7.81 30 R 9.06 4.07 0.00 1.73 1.93 0.00 3.35 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.52 0.00 31 P 0.00 4.60 0.00 2.12 2.06 0.00 3.88 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.86 0.00 32 I 7.82 4.73 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.85 0.90 0.00 0.00 33 K 8.97 4.60 0.00 1.72 1.66 0.00 1.95 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.41 7.81 34 N 8.84 5.37 0.00 2.93 2.94 0.00 0.00 6.85 7.67 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 35 E 7.82 4.07 0.00 2.17 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 2.37 2.39 0.00 36 Q 8.14 4.09 0.00 2.20 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.85 0.00 0.00 0.00 0.00 0.00 2.43 2.52 0.00 37 L 7.87 4.00 0.00 1.73 1.74 0.92 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.59 4.04 0.00 1.88 2.00 0.99 0.73 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 39 Q 8.68 4.05 0.00 2.19 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.63 0.00 40 L 8.99 4.09 0.00 2.05 1.63 0.94 0.78 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 41 I 8.48 3.60 1.96 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 1.41 1.28 0.65 0.00 0.00 42 F 8.97 4.32 0.00 3.32 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 K 8.64 3.83 0.00 1.96 1.93 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.77 1.75 7.81 44 A 7.98 4.20 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 45 I 8.37 3.84 1.94 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 1.46 0.80 1.00 0.00 0.00 46 D 8.58 4.23 0.00 2.62 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 47 I 6.08 3.61 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.16 0.90 0.00 0.00 48 D 7.88 4.60 0.00 2.60 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.00 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 0.00 0.00 0.00 50 N 7.48 3.95 0.00 2.74 2.66 0.00 0.00 6.26 7.14 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 51 G 8.09 3.35 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 0.00 52 E 7.37 4.38 0.00 1.94 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 0.00 2.34 2.25 0.00 53 I 8.19 4.09 0.56 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.24 0.58 0.00 0.00 54 D 7.90 5.40 0.00 2.72 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 55 L 9.22 3.99 0.00 1.89 1.88 0.85 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 56 A 9.30 4.05 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 0.00 0.00 57 E 8.50 3.96 0.00 2.16 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 2.30 2.36 0.00 58 F 8.76 4.30 0.00 3.25 3.26 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 0.00 59 T 8.73 3.50 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 1.24 0.00 0.00 60 K 9.02 3.89 0.00 1.94 2.34 0.00 1.46 0.00 0.00 1.78 0.00 0.00 3.26 0.00 0.00 3.43 0.00 0.00 0.00 0.00 1.92 1.76 7.81 61 F 8.61 4.02 0.00 3.27 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 62 A 8.09 3.87 1.09 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 0.00 0.00 63 A 8.38 3.95 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 64 A 8.04 4.08 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 V 7.82 3.72 2.14 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 0.80 0.00 0.00 0.88 0.00 0.00 66 K 7.97 3.97 0.00 1.78 2.05 0.00 1.82 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.48 7.81 67 E 7.02 3.87 0.00 2.21 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 2.34 2.26 0.00 68 Q 8.07 4.39 0.00 1.97 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.65 0.00 0.00 0.00 0.00 0.00 2.26 2.38 0.00 69 D 7.02 4.93 0.00 2.65 2.54 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 70 L 6.63 4.26 0.00 1.68 1.49 0.89 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 71 S 7.85 4.13 0.00 3.89 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 72 D 8.16 4.80 0.00 2.74 2.77 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 73 E 8.24 3.91 0.00 2.03 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 2.35 2.48 0.00 74 K 7.79 4.23 0.00 2.06 1.94 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.60 1.52 7.81 75 V 8.79 3.73 2.22 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 1.01 0.00 0.00 0.99 0.00 0.00 76 G 8.45 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 0.00 0.00 0.00 77 L 8.01 4.19 0.00 1.20 1.85 0.39 0.66 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 78 K 8.58 4.28 0.00 2.09 2.07 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.55 1.64 7.81 79 I 9.00 3.75 1.97 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 1.59 0.75 0.98 0.00 0.00 80 L 8.46 4.21 0.00 2.34 2.42 1.07 0.74 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 81 Y 8.36 3.60 0.00 3.16 3.13 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 0.00 0.00 0.00 82 K 8.10 4.26 0.00 2.00 2.02 0.00 1.56 0.00 0.00 1.67 0.00 0.00 3.10 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.88 7.81 83 L 8.45 4.01 0.00 1.85 1.76 0.96 0.99 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 84 M 8.85 4.07 0.00 1.71 2.53 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.99 0.00 85 D 7.44 4.39 0.00 2.83 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 8.04 4.42 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 87 D 8.01 4.55 0.00 2.59 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 88 G 8.10 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 D 7.90 4.66 0.00 2.81 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 90 G 6.18 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 0.00 0.00 0.00 0.00 91 K 7.28 4.72 0.00 0.96 1.32 0.00 1.05 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.71 0.21 7.81 92 L 8.90 4.90 0.00 1.76 1.45 -0.85 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 93 T 9.09 3.45 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 1.26 0.00 0.00 94 K 8.80 3.83 0.00 1.90 1.68 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.44 1.62 7.81 95 E 8.37 4.36 0.00 2.06 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 2.43 2.32 0.00 96 E 7.66 3.92 0.00 1.94 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 2.29 2.31 0.00 97 V 8.97 3.76 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 0.75 0.00 0.00 0.86 0.00 0.00 98 T 8.81 3.86 4.28 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 1.26 0.00 0.00 99 T 8.35 3.84 4.56 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 100 F 9.13 4.42 0.00 3.10 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 0.00 101 F 9.54 4.14 0.00 3.24 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 0.00 102 K 8.29 4.01 0.00 2.00 2.07 0.00 1.66 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.50 7.81 103 K 8.72 3.97 0.00 1.85 1.74 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.62 7.81 104 F 8.08 3.90 0.00 2.87 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 0.00 105 G 6.52 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 Y 8.25 4.90 0.00 2.83 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 0.00 107 E 8.14 4.02 0.00 2.04 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 0.00 2.41 2.38 0.00 108 K 8.08 4.10 0.00 1.89 1.89 0.00 1.86 0.00 0.00 1.84 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.56 1.49 7.81 109 V 7.69 3.45 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 0.22 0.00 0.00 1.05 0.00 0.00 110 V 7.59 3.37 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 1.14 0.00 0.00 1.10 0.00 0.00 111 D 7.76 4.30 0.00 2.76 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 0.00 112 Q 8.03 4.15 0.00 2.44 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.78 0.00 0.00 0.00 0.00 0.00 2.79 2.67 0.00 113 I 8.65 3.58 1.94 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.17 0.75 0.00 0.00 114 M 8.15 4.05 0.00 1.99 2.27 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.54 0.00 115 K 7.91 4.24 0.00 1.96 1.84 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.50 7.81 116 A 7.75 4.08 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 0.00 117 D 7.66 4.54 0.00 2.70 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 A 7.30 5.94 1.29 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 0.00 0.00 0.00 119 N 7.99 4.79 0.00 2.73 2.86 0.00 0.00 6.08 6.93 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 0.00 120 G 6.91 4.68 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 0.00 121 D 7.20 4.22 0.00 2.11 1.54 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 0.00 122 G 8.18 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 0.00 123 Y 6.81 5.12 0.00 2.99 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 0.00 124 I 10.46 5.65 1.89 0.00 0.00 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 0.92 0.34 1.00 0.00 0.00 125 T 9.00 4.73 4.42 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 126 L 7.85 2.65 0.00 1.65 1.62 1.01 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 127 E 8.25 3.61 0.00 1.94 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 2.26 2.31 0.00 128 E 7.93 3.79 0.00 2.34 1.91 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 2.33 2.38 0.00 129 F 8.22 4.17 0.00 3.27 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 0.00 130 L 6.58 3.07 0.00 0.27 1.13 0.71 0.99 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 0.00 131 A 8.14 3.93 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 0.00 132 F 8.23 4.24 0.00 3.07 3.43 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 0.00 133 N 7.71 4.94 0.00 2.94 2.77 0.00 0.00 7.15 8.16 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 0.00 134 L 7.68 4.20 0.00 1.71 1.78 1.10 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00