NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.6424 8.4293 116.2336 55.1975 30.4197 173.3114 2 C 4.1839 7.7476 114.0896 56.8389 29.9795 172.1056 3 D 4.5826 8.4120 118.2644 55.0959 40.1566 175.5068 4 L 4.0826 8.0748 120.0768 57.1978 42.1960 175.7446 5 P 4.6028 0.0000 0.0000 62.4173 32.2095 175.5151 6 C 4.2676 8.5003 113.7074 57.8671 30.5484 174.9168 7 G 3.9107 8.2633 107.7249 45.4831 0.0000 172.9977 8 V 4.2614 7.1825 119.1870 61.0730 32.4965 174.4176 9 Y 4.7072 8.1889 123.8590 56.5252 42.0396 174.5733 10 D 3.9740 8.0867 121.0868 51.4929 44.1118 174.3374 11 P 4.0441 0.0000 0.0000 64.9878 31.1497 178.1041 12 A 4.0140 8.7937 120.3321 55.0376 17.7987 179.6562 13 Q 3.7506 7.9948 116.4436 59.0912 28.7712 178.7983 14 A 4.0586 7.7705 121.1435 55.1790 18.5142 179.4548 15 R 3.8265 8.2983 117.6139 59.6351 30.1897 178.6122 16 I 3.8169 8.1579 118.8466 64.0391 37.9221 177.7673 17 E 3.9849 8.0290 119.1457 59.3375 29.3304 179.1685 18 A 4.0398 8.2551 120.8674 55.0271 18.3000 179.5268 19 E 3.9663 8.7120 117.9825 59.5812 29.5235 179.7040 20 S 4.1281 8.1024 114.3979 61.2266 63.0408 176.6294 21 V 3.5230 7.9320 121.9053 65.7516 31.2296 177.9338 22 K 4.1203 8.1547 119.0000 59.4842 31.9704 178.4581 23 A 4.1566 8.3713 121.4646 55.2554 18.2813 179.8107 24 V 3.5561 8.3056 117.0880 66.1738 31.7354 178.1249 25 Q 4.0278 8.2175 117.8367 59.1997 28.6926 178.9348 26 E 4.0183 8.4792 119.5764 59.4248 29.5131 179.5406 27 K 4.0948 8.5556 118.9041 59.8280 31.8966 179.2508 28 M 4.3354 8.0812 117.7374 57.8679 31.9257 178.0011 29 A 4.3681 7.9009 119.4710 53.3405 18.7273 177.9706 30 G 3.9006 7.8073 104.4737 44.9940 0.0000 173.4514 31 N 4.5026 7.7577 118.7652 52.8184 39.4306 173.2274 32 D 4.6688 8.5120 124.2724 53.2049 40.2824 176.8233 33 D 4.3832 8.3374 121.0916 54.5142 42.0317 174.9340 34 P 4.2801 0.0000 0.0000 65.9558 31.3497 178.0257 35 H 4.1429 8.3593 116.5651 59.2786 29.7406 176.8658 36 F 4.0503 8.5484 122.3313 61.4467 39.2298 176.9962 37 Q 3.9445 8.5825 118.0093 59.2439 28.4215 179.2106 38 T 3.8087 8.1760 116.9181 66.6658 68.4860 176.9003 39 R 3.7524 8.0135 120.0179 59.2692 30.0751 178.9343 40 A 3.7141 7.7836 120.6616 55.3337 18.2719 179.8705 41 T 3.7409 7.8436 114.1714 66.5828 68.6230 176.8968 42 V 3.5113 7.7940 120.2267 66.3191 31.4408 178.2380 43 I 3.8785 7.8468 119.4423 64.1203 36.8564 178.1792 44 K 3.8181 8.4298 120.9932 59.5742 31.9359 178.3636 45 E 3.8913 8.1229 119.3966 59.3518 29.5620 178.8502 46 Q 3.9683 7.9483 117.8030 59.1563 28.8046 179.0579 47 R 3.9646 8.3597 119.1857 59.0347 30.1150 178.9605 48 A 4.0036 8.2821 120.9625 55.0166 18.3399 179.2910 49 E 3.8947 8.2434 117.9509 59.3577 29.6160 179.0580 50 L 3.9116 8.0065 118.8809 57.6694 41.6166 179.1684 51 A 4.0385 8.1408 120.7118 55.2549 18.2669 179.8456 52 K 3.8900 8.1593 116.8243 59.7513 32.0381 178.9854 53 H 4.1226 8.2135 118.4658 59.7131 29.7941 176.9976 54 H 4.2083 8.3386 118.1408 58.8550 28.5767 178.0322 55 V 3.6150 8.0716 120.1754 66.0317 31.3444 177.9515 56 S 4.3032 8.5621 113.3783 61.5213 62.1362 176.3300 57 V 3.6801 8.2242 121.2668 65.9345 31.1797 177.8017 58 L 3.9610 8.0601 118.8316 57.7461 41.2762 179.4615 59 W 4.7211 8.2055 126.7362 60.5365 30.8072 177.7177 60 S 4.0993 8.4620 113.0490 60.4468 63.0101 175.2115 61 D 4.6986 8.3539 121.0187 55.3312 41.7555 177.2893 62 Y 3.5427 7.5273 118.8697 59.7321 39.1770 175.6480 63 F 4.2167 7.9567 117.9720 57.1973 39.6259 174.8581 64 K 4.6459 7.9708 122.0664 53.1146 36.0508 175.3102 65 P 4.4317 0.0000 0.0000 65.9408 31.1368 177.2186 66 P 4.2207 0.0000 0.0000 65.6575 31.0934 178.4479 67 H 4.3782 8.0087 115.6329 58.8695 28.1506 177.8265 68 F 4.4102 7.5106 119.0688 60.2743 38.5110 177.2671 69 E 4.0385 8.1556 118.7718 59.0944 29.5680 178.4218 70 K 4.0538 8.0208 118.6689 57.8878 33.6689 176.3495 71 Y 4.8504 8.2053 116.7943 53.8714 37.8611 174.1266 72 P 4.6487 0.0000 0.0000 63.9861 31.9922 177.9611 73 E 4.3639 8.1235 116.2995 56.8305 30.6687 177.8102 74 L 4.0359 8.1983 122.4936 58.5729 42.0321 178.3192 75 H 4.3431 8.2224 115.6680 59.1952 28.7069 177.4653 76 Q 3.8817 8.0640 120.7120 58.7995 28.9135 177.6559 77 L 3.8696 8.2257 121.9446 58.1411 42.1521 179.1828 78 V 3.4228 8.0279 118.5724 65.8394 31.3076 177.5109 79 N 3.9890 7.8842 116.8031 56.6724 38.6858 176.6134 80 D 4.0504 8.0632 120.5282 57.3949 40.7841 178.9189 81 T 3.4367 7.5007 116.1859 66.4353 68.4370 176.7203 82 L 3.9218 7.6658 120.8027 57.7840 41.6480 179.8065 83 K 3.9254 8.1333 118.3165 59.2421 31.8974 179.3104 84 A 4.0532 8.1214 121.6448 55.2691 18.2491 179.3788 85 M 4.0191 8.1303 116.8798 58.7044 32.4087 178.5734 86 S 4.0916 8.2494 115.3221 61.5778 62.7729 176.5410 87 A 4.0092 7.8900 122.1721 55.0605 18.4551 179.2328 88 A 4.2016 8.1346 120.7155 54.5512 18.1919 179.7436 89 K 3.9220 8.0398 116.4839 59.7314 32.3378 179.0359 90 G 3.8338 7.6494 101.7960 44.7516 0.0000 173.2076 91 S 4.7528 7.2531 114.4883 56.4572 65.4094 173.7239 92 K 4.2875 8.5050 123.1816 56.4086 32.7689 176.0881 93 D 4.6078 8.3299 121.3226 52.6835 41.4869 175.2577 94 P 4.8887 0.0000 0.0000 64.6868 31.1789 178.2369 95 A 4.0450 8.6515 120.6443 55.2538 18.0272 179.7547 96 T 3.9622 8.2818 108.7666 64.8660 68.9301 177.1998 97 G 3.6306 8.1866 108.2168 47.5848 0.0000 175.2533 98 Q 3.9736 8.5132 122.4168 58.7132 29.0509 178.1753 99 K 3.8177 8.4326 120.8260 59.3611 32.1808 178.6191 100 A 4.1843 8.0385 120.8682 55.2870 18.3593 179.5271 101 L 3.9763 8.1467 117.5246 58.1437 41.5297 179.5990 102 D 4.3536 8.2935 119.0097 57.4857 40.7002 178.4255 103 Y 4.2058 8.0890 117.3107 61.1910 37.7921 178.5665 104 I 3.7786 8.1864 120.6261 64.3496 37.0763 178.3228 105 A 3.8795 8.2017 121.6568 55.2304 18.2419 179.7623 106 Q 3.9861 7.8978 116.8708 59.1554 28.7291 178.9161 107 I 3.8019 7.8222 120.9982 64.3477 37.1429 177.9421 108 D 4.3595 8.8519 119.7190 57.1268 41.0578 178.2789 109 K 4.1336 8.4228 120.4971 59.6061 32.3095 178.9146 110 I 3.5067 7.7178 119.8906 64.1353 36.7343 177.8330 111 F 4.0053 8.3856 120.7407 61.5322 39.2975 177.2134 112 W 4.3781 8.2673 117.9493 59.6037 28.5587 178.4597 113 E 4.1696 8.1209 118.4135 59.3870 28.9791 178.9342 114 T 4.1479 7.6563 108.3340 63.5087 68.9542 174.6207 115 K 4.1665 7.5014 125.9041 56.6123 32.2545 176.2596 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 H 8.43 4.64 0.00 3.23 3.30 0.00 5.48 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 2 C 7.75 4.18 0.00 3.12 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 3 D 8.41 4.58 0.00 2.88 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 4 L 8.07 4.08 0.00 1.60 1.75 0.92 0.98 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 5 P 0.00 4.60 0.00 2.29 2.10 0.00 3.82 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 6 C 8.50 4.27 0.00 3.00 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 7 G 8.26 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 0.00 0.00 0.00 8 V 7.18 4.26 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 0.87 0.00 0.00 0.96 0.00 0.00 9 Y 8.19 4.71 0.00 2.84 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 10 D 8.09 3.97 0.00 2.62 2.38 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 11 P 0.00 4.04 0.00 2.24 1.87 0.00 3.05 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.06 0.00 12 A 8.79 4.01 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 13 Q 7.99 3.75 0.00 1.79 1.52 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 2.20 2.31 0.00 14 A 7.77 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 15 R 8.30 3.83 0.00 1.87 1.93 0.00 3.23 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.65 0.00 16 I 8.16 3.82 1.86 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 1.52 1.19 1.01 0.00 0.00 17 E 8.03 3.98 0.00 2.19 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 0.00 2.58 2.55 0.00 18 A 8.26 4.04 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 19 E 8.71 3.97 0.00 2.16 2.02 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 2.34 2.51 0.00 20 S 8.10 4.13 0.00 4.07 4.13 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 21 V 7.93 3.52 2.24 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 0.99 0.00 0.00 0.99 0.00 0.00 22 K 8.15 4.12 0.00 1.89 1.80 0.00 1.80 0.00 0.00 1.66 0.00 0.00 3.15 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.60 7.81 23 A 8.37 4.16 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 24 V 8.31 3.56 2.21 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 1.01 0.00 0.00 0.95 0.00 0.00 25 Q 8.22 4.03 0.00 2.32 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.55 0.00 26 E 8.48 4.02 0.00 2.20 2.02 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 2.34 2.52 0.00 27 K 8.56 4.09 0.00 2.08 2.21 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.75 1.76 7.81 28 M 8.08 4.34 0.00 2.04 2.33 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.52 0.00 29 A 7.90 4.37 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 30 G 7.81 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 31 N 7.76 4.50 0.00 2.24 2.24 0.00 0.00 7.09 8.47 0.00 0.00 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 8.51 4.67 0.00 2.85 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 33 D 8.34 4.38 0.00 2.85 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 34 P 0.00 4.28 0.00 2.24 2.12 0.00 3.70 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.18 0.00 35 H 8.36 4.14 0.00 3.25 3.60 0.00 5.87 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 F 8.55 4.05 0.00 3.13 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 37 Q 8.58 3.94 0.00 2.28 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.68 2.61 0.00 38 T 8.18 3.81 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 1.17 0.00 0.00 39 R 8.01 3.75 0.00 1.67 1.81 0.00 3.02 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 40 A 7.78 3.71 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 7.84 3.74 4.33 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 1.18 0.00 0.00 42 V 7.79 3.51 2.16 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 0.99 0.00 0.00 0.90 0.00 0.00 43 I 7.85 3.88 1.86 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 1.37 0.49 0.87 0.00 0.00 44 K 8.43 3.82 0.00 1.78 1.97 0.00 1.76 0.00 0.00 1.56 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.44 7.81 45 E 8.12 3.89 0.00 2.28 2.04 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 2.29 2.38 0.00 46 Q 7.95 3.97 0.00 2.33 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.52 0.00 47 R 8.36 3.96 0.00 1.80 2.08 0.00 3.28 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.78 0.00 48 A 8.28 4.00 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.24 3.89 0.00 2.17 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 0.00 2.29 2.38 0.00 50 L 8.01 3.91 0.00 1.92 1.66 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.14 4.04 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 52 K 8.16 3.89 0.00 2.00 1.87 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.44 1.64 7.81 53 H 8.21 4.12 0.00 3.24 3.42 0.00 5.79 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 54 H 8.34 4.21 0.00 3.35 3.29 0.00 5.67 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 V 8.07 3.61 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 0.99 0.00 0.00 0.98 0.00 0.00 56 S 8.56 4.30 0.00 4.04 4.04 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 57 V 8.22 3.68 2.24 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 1.35 0.00 0.00 0.87 0.00 0.00 58 L 8.06 3.96 0.00 2.06 1.74 0.75 0.50 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 59 W 8.21 4.72 0.00 3.42 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 60 S 8.46 4.10 0.00 4.01 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 61 D 8.35 4.70 0.00 2.97 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 62 Y 7.53 3.54 0.00 1.43 2.53 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 63 F 7.96 4.22 0.00 3.23 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 0.00 0.00 0.00 64 K 7.97 4.65 0.00 1.38 1.49 0.00 1.61 0.00 0.00 1.69 0.00 0.00 2.80 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.31 1.12 7.81 65 P 0.00 4.43 0.00 2.14 2.18 0.00 3.55 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 2.13 2.29 0.00 66 P 0.00 4.22 0.00 1.99 2.02 0.00 3.37 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 1.96 2.09 0.00 67 H 8.01 4.38 0.00 2.80 3.19 0.00 5.64 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 F 7.51 4.41 0.00 3.14 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 69 E 8.16 4.04 0.00 1.99 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 2.30 2.31 0.00 70 K 8.02 4.05 0.00 1.63 1.68 0.00 1.65 0.00 0.00 1.29 0.00 0.00 2.85 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.30 1.07 7.81 71 Y 8.21 4.85 0.00 3.11 2.87 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 72 P 0.00 4.65 0.00 2.21 2.21 0.00 3.43 0.00 0.00 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.93 0.00 73 E 8.12 4.36 0.00 2.18 2.28 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 2.38 2.29 0.00 74 L 8.20 4.04 0.00 1.85 1.95 0.67 -0.24 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 75 H 8.22 4.34 0.00 3.23 3.33 0.00 5.67 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 8.06 3.88 0.00 2.15 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.90 0.00 0.00 0.00 0.00 0.00 2.41 2.58 0.00 77 L 8.23 3.87 0.00 1.87 1.86 1.09 0.99 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 78 V 8.03 3.42 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 0.48 0.00 0.00 1.05 0.00 0.00 79 N 7.88 3.99 0.00 2.59 2.70 0.00 0.00 7.23 8.11 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 80 D 8.06 4.05 0.00 2.47 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 0.00 0.00 0.00 81 T 7.50 3.44 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 1.21 0.00 0.00 82 L 7.67 3.92 0.00 1.69 1.61 0.76 0.83 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 83 K 8.13 3.93 0.00 1.79 1.78 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.45 7.81 84 A 8.12 4.05 1.46 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 0.00 0.00 85 M 8.13 4.02 0.00 2.23 2.06 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.76 0.00 86 S 8.25 4.09 0.00 4.05 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 87 A 7.89 4.01 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 A 8.13 4.20 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 89 K 8.04 3.92 0.00 1.95 2.02 0.00 1.69 0.00 0.00 1.90 0.00 0.00 3.20 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.62 7.81 90 G 7.65 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 0.00 0.00 0.00 91 S 7.25 4.75 0.00 3.82 3.76 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 0.00 0.00 0.00 92 K 8.50 4.29 0.00 1.78 1.84 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.37 1.41 7.81 93 D 8.33 4.61 0.00 2.66 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 94 P 0.00 4.89 0.00 2.20 2.10 0.00 3.94 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.03 0.00 95 A 8.65 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 96 T 8.28 3.96 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 97 G 8.19 3.63 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 0.00 0.00 0.00 98 Q 8.51 3.97 0.00 2.23 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 99 K 8.43 3.82 0.00 1.94 1.95 0.00 1.73 0.00 0.00 1.79 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.34 7.81 100 A 8.04 4.18 1.44 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 0.00 101 L 8.15 3.98 0.00 1.90 1.75 0.93 0.98 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 0.00 102 D 8.29 4.35 0.00 2.68 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 0.00 103 Y 8.09 4.21 0.00 3.26 2.90 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 0.00 104 I 8.19 3.78 2.03 0.00 0.00 0.89 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 1.04 0.93 0.00 0.00 105 A 8.20 3.88 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 0.00 106 Q 7.90 3.99 0.00 2.33 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.75 0.00 0.00 0.00 0.00 0.00 2.40 2.58 0.00 107 I 7.82 3.80 2.05 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.90 1.09 0.00 0.00 108 D 8.85 4.36 0.00 2.86 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 0.00 109 K 8.42 4.13 0.00 2.04 1.98 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.57 7.81 110 I 7.72 3.51 1.83 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 0.85 0.66 0.02 0.00 0.00 111 F 8.39 4.01 0.00 2.84 2.92 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 0.00 112 W 8.27 4.38 0.00 3.56 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 0.00 113 E 8.12 4.17 0.00 2.25 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 0.00 2.47 2.66 0.00 114 T 7.66 4.15 4.18 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 1.32 0.00 0.00 115 K 7.50 4.17 0.00 1.97 1.81 0.00 0.73 0.00 0.00 1.79 0.00 0.00 2.78 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.06 1.15 7.81