NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5325 8.3044 120.2867 55.2939 33.9396 174.0806 3 V 4.1199 8.0653 121.2606 59.6799 33.0711 173.2161 4 W 4.5882 9.0613 135.0000 57.1882 31.9303 174.8746 5 T 3.9852 7.9595 122.1117 61.4564 67.1638 172.3266 6 P 4.5525 0.0000 0.0000 63.1435 32.2131 175.5686 7 V 4.1031 7.4138 119.5624 62.6208 32.8398 175.2355 8 N 4.1989 8.6602 125.2127 54.9467 36.0709 173.3976 9 N 5.0345 7.6212 108.8214 52.9666 40.1099 174.1681 10 K 4.1082 8.3627 116.2730 56.4765 32.7524 176.6592 11 M 4.9704 8.3187 121.1448 53.9837 35.1208 175.4265 12 F 4.6589 8.1300 116.3734 57.2389 41.1317 176.3802 13 E 3.4998 8.3978 122.3855 57.2758 27.8392 175.7087 14 T 3.9250 8.3527 122.8747 66.2487 68.8464 174.3959 15 F 4.4975 8.9967 123.7676 57.6980 36.8425 176.5525 16 S 4.4468 8.2966 114.9082 60.5169 62.8954 174.5239 17 Y 4.4138 8.2689 117.2008 58.1284 38.2284 175.1371 18 L 4.6727 7.6678 120.3619 52.2282 43.5542 174.5519 19 P 4.4645 0.0000 0.0000 61.8230 31.8077 175.0831 20 P 4.3642 0.0000 0.0000 62.5162 31.8290 176.5465 21 L 3.9922 8.2957 122.5303 54.8259 42.1690 178.0240 22 T 4.2509 8.1931 113.9860 61.1782 71.2448 175.3429 23 D 4.3360 8.5708 121.1936 57.5897 40.7551 178.8066 24 E 3.9683 8.0830 119.4132 59.2669 29.8227 178.7324 25 Q 3.9437 7.8771 117.7830 58.6949 28.7711 178.5548 26 I 3.7285 8.0752 121.0180 64.3814 37.2035 178.2452 27 A 4.0486 8.1756 121.3518 55.2061 18.2263 179.5280 28 A 3.9980 8.0984 119.2450 55.4436 18.4166 179.9460 29 Q 4.1150 7.9912 116.2198 59.0050 28.7899 178.9884 30 V 3.7521 8.1710 119.4660 66.0606 31.5421 177.7513 31 D 4.4063 8.3569 118.7212 57.5526 40.6014 178.0476 32 Y 4.1493 8.1072 119.7919 60.8297 38.8730 178.2921 33 I 3.9457 7.9739 120.5380 64.5937 37.3180 178.6561 34 V 3.5364 7.9729 118.6960 65.9734 31.1830 177.8631 35 A 3.9278 8.3624 119.6008 54.5984 18.2326 178.3449 36 N 4.0735 7.1402 112.0568 52.1539 38.7527 175.7931 37 G 3.7514 7.3372 108.3227 45.9848 0.0000 173.9782 38 W 4.9622 7.4800 118.7356 56.0202 30.7408 176.2652 39 I 4.4137 8.8923 123.0354 59.3643 37.9738 173.9926 40 P 4.8893 0.0000 0.0000 62.8941 32.7564 175.2451 41 C 5.0033 8.9890 122.0063 58.2707 35.6285 172.3923 42 L 5.3189 8.7555 123.8509 53.2048 44.3522 175.2010 43 E 5.6366 9.3137 121.4554 54.8544 33.9734 174.6756 44 F 5.6307 9.0686 116.1927 55.8567 42.0810 173.0330 45 A 4.5480 8.3060 120.1668 50.1910 22.6288 176.2073 46 E 4.2785 8.6339 118.3119 55.7038 30.7564 177.6450 47 A 4.2776 8.9135 123.1569 55.9394 18.3511 179.7518 48 D 4.5703 8.1485 112.9168 56.2849 41.0381 177.1468 49 K 4.6232 7.9830 117.4288 56.0388 32.7855 176.8993 50 A 3.8375 7.7242 124.4353 54.1945 18.7507 178.3387 51 Y 4.6461 7.4289 111.3237 55.5965 40.0526 175.7394 52 V 3.7553 8.3890 122.0329 63.9163 31.8632 175.2915 53 S 4.8033 8.8834 119.9299 56.6087 66.4151 173.7301 54 N 5.0935 8.5322 114.6140 52.7827 39.0644 176.2615 55 E 3.9588 8.2164 120.7739 59.8016 29.5350 179.1746 56 S 4.0169 8.7347 115.3424 60.6080 62.8606 175.9609 57 A 2.5800 7.6413 123.1662 53.3908 17.7424 179.0553 58 I 3.5848 6.9767 116.9304 63.5762 38.0668 177.1236 59 R 4.2791 7.4513 116.3696 55.7455 30.4955 176.3558 60 F 5.0273 7.1508 118.0928 56.1960 41.1645 177.0014 61 G 4.0502 8.2233 117.5725 46.4442 0.0000 176.2334 62 S 4.6103 8.4239 114.8285 58.0691 61.7730 174.4085 63 V 4.4476 7.2232 107.5855 61.0875 33.4405 177.5586 64 S 4.4989 8.1875 114.8570 59.4558 63.4861 173.5468 65 C 4.0072 8.0887 119.2538 61.6253 27.9745 173.1871 66 L 3.6824 8.4904 123.4210 55.6809 38.9879 173.2101 67 Y 4.4508 7.6666 119.2060 55.8655 40.1846 174.5516 68 Y 4.8330 7.3128 123.3328 56.2118 42.2689 174.8247 69 D 4.4821 8.9083 123.4563 55.2588 41.7140 176.9695 70 N 4.4294 8.8892 116.2604 54.1761 36.0843 176.0195 71 R 3.9488 7.9567 118.7052 59.3215 30.3602 177.1962 72 Y 4.3841 7.6590 114.4897 57.9034 38.4468 175.0379 73 W 5.1278 8.6705 123.8278 55.4374 32.7716 174.3466 74 T 4.3876 8.1123 116.8384 62.5201 69.8325 174.3972 75 M 4.4999 8.4734 126.1792 55.1591 33.2170 175.2957 76 W 4.7685 9.5122 135.0000 56.1894 31.1686 176.9134 77 K 3.4221 8.4999 129.2496 57.6255 30.4643 178.1094 78 L 4.9187 8.2373 125.6169 52.6382 45.0002 174.0087 79 P 4.3562 0.0000 0.0000 63.3244 32.0661 177.6517 80 M 4.3096 8.6780 123.4460 53.7164 30.4222 175.5939 81 F 4.4324 7.4939 118.9524 58.6902 40.0375 176.3234 82 G 3.9480 9.1336 111.8826 45.7771 0.0000 173.1344 83 C 4.2458 7.8850 120.4658 59.7837 31.6697 173.3907 84 R 4.6123 8.5830 125.3277 55.5842 31.1310 174.7995 85 D 4.5986 7.8591 117.6544 51.1716 43.2823 173.8062 86 P 4.3233 0.0000 0.0000 66.0880 31.2470 178.4312 87 M 4.1064 8.2703 116.9347 58.4150 31.8528 178.3779 88 Q 3.9846 7.9894 119.4365 59.0341 29.2242 178.5661 89 V 3.5873 7.7370 118.7509 66.0536 31.7779 177.6982 90 L 4.0181 7.9698 118.7005 58.0852 41.4694 179.8292 91 R 3.9706 8.4092 118.2000 59.3438 29.9103 179.0271 92 E 4.1364 8.2329 118.4158 59.1795 29.4133 179.3715 93 I 3.5177 7.8318 120.0463 64.2751 37.1777 178.4566 94 V 3.4746 7.6386 118.6359 65.9933 31.3271 177.9281 95 A 3.9159 8.0043 120.3816 55.1207 18.2567 179.1430 96 C 2.0000 7.6264 117.6656 62.1282 31.2872 176.0442 97 T 3.7669 7.5682 111.0686 64.2487 67.9563 176.3588 98 K 3.8257 7.5762 122.0368 59.3173 32.3174 178.4149 99 A 3.9764 7.5785 120.0407 53.5662 19.7175 177.6544 100 F 4.7048 7.7307 115.5463 55.0698 39.2051 173.8764 101 P 4.4402 0.0000 0.0000 64.2330 31.9020 177.9080 102 D 4.6497 8.0560 116.5467 53.8893 41.2476 175.5581 103 A 4.7307 7.3487 121.2479 50.6096 21.0659 177.0731 104 Y 4.2025 8.6117 117.9247 57.8159 39.4005 175.2363 105 V 5.2055 9.0320 123.6419 61.1075 35.0628 174.3062 106 R 5.0070 9.5605 123.9601 54.2649 33.0297 173.8427 107 L 4.7363 8.1224 123.4528 53.8942 43.8363 175.7084 108 V 4.8148 8.7214 118.3978 59.5111 36.4069 174.1051 109 A 4.8508 8.0171 121.2832 50.5586 22.8122 175.2256 110 F 5.2530 9.0150 119.8222 55.7239 42.5187 174.1849 111 D 5.4017 8.8017 122.6797 52.7340 42.3443 176.5621 112 N 4.7397 9.1696 123.1483 54.2001 38.3820 176.3339 113 Q 4.2057 8.7675 118.9137 58.8888 29.0564 177.6413 114 K 4.0195 8.3415 114.8672 57.1792 32.8960 176.6230 115 Q 3.4154 8.0476 118.1745 55.8238 27.0206 172.5394 116 V 4.4761 7.8275 117.5325 60.1109 34.9761 173.9233 117 Q 4.3738 8.7318 123.2136 56.5072 29.2781 175.5431 118 I 4.1765 8.1581 125.2350 61.3642 39.5944 174.5895 119 M 4.6393 6.7441 117.4597 54.3627 34.3845 173.7944 120 G 4.7929 8.2674 106.7189 47.2434 0.0000 172.2593 121 F 4.9927 7.0386 115.4336 55.4071 41.0226 172.7212 122 L 4.5452 8.8314 122.7664 55.4572 42.0800 176.7542 123 V 4.5190 8.8837 118.1050 61.4394 34.0368 175.6970 124 Q 4.5968 7.8111 121.4755 54.4922 32.3647 173.1872 125 R 4.3388 8.1516 122.1197 52.9033 32.5604 173.7260 126 P 4.1825 0.0000 0.0000 62.7511 31.7180 177.6696 127 K 4.0897 8.4711 120.2211 59.3274 32.1503 178.2815 128 T 4.0647 7.7990 107.1422 62.8096 69.2805 174.7540 129 A 4.2533 7.8569 126.7361 52.8397 18.6118 177.3063 130 R 4.6624 8.8185 121.0801 55.9795 31.4953 175.5158 131 D 4.9748 8.5380 116.0976 52.7628 39.7095 175.3153 132 F 5.3384 7.8100 112.8751 55.5740 41.0822 173.6190 133 Q 4.4087 8.3653 119.9240 53.0710 31.4268 174.1915 134 P 4.5417 0.0000 0.0000 62.1433 32.6636 176.9205 135 A 3.9724 8.8413 122.9019 55.6185 18.1659 179.3002 136 N 4.6722 8.0540 109.8196 53.9813 37.9486 175.6207 137 K 4.4103 7.9060 117.8702 56.2785 32.7805 177.4139 138 R 3.5609 7.4669 119.4351 57.7038 30.1388 176.6243 139 S 5.0854 7.5055 110.4395 56.3402 65.9735 174.2641 140 V 3.9926 8.3997 114.3680 61.7737 32.2683 175.5594 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 M 8.30 4.53 0.00 1.98 2.15 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.58 0.00 3 V 8.07 4.12 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 1.02 0.00 0.00 0.97 0.00 0.00 4 W 9.06 4.59 0.00 3.42 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 5 T 7.96 3.99 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 1.01 0.00 0.00 6 P 0.00 4.55 0.00 2.23 2.19 0.00 3.78 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 1.95 1.96 0.00 7 V 7.41 4.10 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 0.77 0.00 0.00 0.91 0.00 0.00 8 N 8.66 4.20 0.00 2.89 2.88 0.00 0.00 6.81 8.00 0.00 0.00 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 N 7.62 5.03 0.00 2.65 2.68 0.00 0.00 7.30 6.68 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 10 K 8.36 4.11 0.00 1.97 1.56 0.00 1.25 0.00 0.00 0.61 0.00 0.00 2.45 0.00 0.00 2.48 0.00 0.00 0.00 0.00 1.22 1.25 7.81 11 M 8.32 4.97 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.64 0.00 12 F 8.13 4.66 0.00 3.10 3.05 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 13 E 8.40 3.50 0.00 2.14 1.69 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 0.00 2.22 2.14 0.00 14 T 8.35 3.93 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 0.12 0.00 0.00 15 F 9.00 4.50 0.00 3.31 3.09 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 16 S 8.30 4.45 0.00 4.13 4.22 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 17 Y 8.27 4.41 0.00 3.02 3.19 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 18 L 7.67 4.67 0.00 1.82 1.61 0.87 1.13 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 19 P 0.00 4.46 0.00 2.03 2.00 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 20 P 0.00 4.36 0.00 2.04 2.00 0.00 3.70 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 21 L 8.30 3.99 0.00 1.59 1.50 0.29 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.19 4.25 4.22 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 1.18 0.00 0.00 23 D 8.57 4.34 0.00 2.70 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 24 E 8.08 3.97 0.00 2.02 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 2.35 2.38 0.00 25 Q 7.88 3.94 0.00 2.29 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.58 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 26 I 8.08 3.73 2.06 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 1.64 0.97 1.08 0.00 0.00 27 A 8.18 4.05 1.42 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 0.00 0.00 0.00 28 A 8.10 4.00 1.37 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 29 Q 7.99 4.11 0.00 2.49 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.75 0.00 0.00 0.00 0.00 0.00 2.38 1.91 0.00 30 V 8.17 3.75 2.30 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 1.10 0.00 0.00 1.13 0.00 0.00 31 D 8.36 4.41 0.00 3.00 2.76 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 32 Y 8.11 4.15 0.00 3.25 3.36 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 0.00 0.00 0.00 0.00 33 I 7.97 3.95 2.19 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.41 1.08 0.00 0.00 34 V 7.97 3.54 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 1.00 0.00 0.00 1.00 0.00 0.00 35 A 8.36 3.93 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 36 N 7.14 4.07 0.00 1.44 1.42 0.00 0.00 7.04 8.99 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 37 G 7.34 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 38 W 7.48 4.96 0.00 3.38 3.08 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 39 I 8.89 4.41 2.12 0.00 0.00 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 1.49 1.01 0.75 0.00 0.00 40 P 0.00 4.89 0.00 2.09 1.99 0.00 3.81 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.14 0.00 41 C 8.99 5.00 0.00 3.09 2.71 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 0.00 0.00 0.00 0.00 42 L 8.76 5.32 0.00 1.87 1.64 0.87 0.83 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 43 E 9.31 5.64 0.00 2.03 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 2.36 2.33 0.00 44 F 9.07 5.63 0.00 3.04 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 45 A 8.31 4.55 -0.08 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 0.00 0.00 46 E 8.63 4.28 0.00 2.18 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 0.00 2.30 2.28 0.00 47 A 8.91 4.28 1.50 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 0.00 0.00 48 D 8.15 4.57 0.00 2.70 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 49 K 7.98 4.62 0.00 1.50 1.68 0.00 1.71 0.00 0.00 1.84 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.33 1.42 7.81 50 A 7.72 3.84 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.43 4.65 0.00 2.91 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 52 V 8.39 3.76 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 0.64 0.00 0.00 0.72 0.00 0.00 53 S 8.88 4.80 0.00 4.08 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 54 N 8.53 5.09 0.00 2.75 2.85 0.00 0.00 6.56 7.66 0.00 0.00 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 E 8.22 3.96 0.00 2.15 2.23 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 2.39 2.38 0.00 56 S 8.73 4.02 0.00 4.08 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 57 A 7.64 2.58 1.10 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 0.00 0.00 58 I 6.98 3.58 1.78 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.81 0.89 0.00 0.00 59 R 7.45 4.28 0.00 1.91 2.00 0.00 3.19 0.00 0.00 3.22 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 60 F 7.15 5.03 0.00 3.00 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 61 G 8.22 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 0.00 0.00 0.00 62 S 8.42 4.61 0.00 3.86 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 63 V 7.22 4.45 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 0.66 0.00 0.00 0.46 0.00 0.00 64 S 8.19 4.50 0.00 4.11 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 65 C 8.09 4.01 0.00 2.97 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 66 L 8.49 3.68 0.00 1.79 1.78 0.95 0.98 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 67 Y 7.67 4.45 0.00 2.92 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 68 Y 7.31 4.83 0.00 2.81 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 69 D 8.91 4.48 0.00 2.78 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.89 4.43 0.00 3.06 3.24 0.00 0.00 6.98 7.66 0.00 0.00 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 R 7.96 3.95 0.00 1.51 1.68 0.00 3.07 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 72 Y 7.66 4.38 0.00 3.05 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 73 W 8.67 5.13 0.00 3.06 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 74 T 8.11 4.39 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 0.94 0.00 0.00 75 M 8.47 4.50 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.77 0.00 76 W 9.51 4.77 0.00 3.68 3.30 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 77 K 8.50 3.42 0.00 1.68 0.81 0.00 1.59 0.00 0.00 1.55 0.00 0.00 2.72 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.82 0.21 7.81 78 L 8.24 4.92 0.00 1.60 1.57 1.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.36 0.00 0.60 1.80 0.00 3.62 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 1.92 2.11 0.00 80 M 8.68 4.31 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.54 0.00 81 F 7.49 4.43 0.00 3.10 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 82 G 9.13 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 83 C 7.88 4.25 0.00 3.02 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 84 R 8.58 4.61 0.00 1.80 1.86 0.00 3.22 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.78 0.00 85 D 7.86 4.60 0.00 2.70 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 86 P 0.00 4.32 0.00 2.22 2.13 0.00 3.68 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.21 0.00 87 M 8.27 4.11 0.00 2.04 2.28 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 2.71 2.56 0.00 88 Q 7.99 3.98 0.00 2.26 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 89 V 7.74 3.59 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 1.05 0.00 0.00 0.98 0.00 0.00 90 L 7.97 4.02 0.00 1.91 1.73 0.95 0.80 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 91 R 8.41 3.97 0.00 2.02 2.01 0.00 3.15 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 1.67 1.87 0.00 92 E 8.23 4.14 0.00 2.24 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 2.62 2.65 0.00 93 I 7.83 3.52 1.98 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 1.34 0.77 0.85 0.00 0.00 94 V 7.64 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 0.97 0.00 0.00 0.93 0.00 0.00 95 A 8.00 3.92 1.49 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 0.00 0.00 96 C 7.63 2.00 0.00 1.23 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 0.00 0.00 0.00 0.00 97 T 7.57 3.77 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 1.11 0.00 0.00 98 K 7.58 3.83 0.00 1.85 1.92 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.39 7.81 99 A 7.58 3.98 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 0.00 100 F 7.73 4.70 0.00 2.80 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 0.00 101 P 0.00 4.44 0.00 2.12 2.11 0.00 3.25 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.87 0.00 102 D 8.06 4.65 0.00 2.68 2.69 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 0.00 0.00 0.00 0.00 103 A 7.35 4.73 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 0.00 104 Y 8.61 4.20 0.00 2.52 2.71 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 0.00 0.00 0.00 0.00 105 V 9.03 5.21 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 1.00 0.00 0.00 0.88 0.00 0.00 106 R 9.56 5.01 0.00 1.80 1.90 0.00 2.33 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.35 0.00 107 L 8.12 4.74 0.00 1.51 0.76 0.87 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.72 4.81 1.62 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 0.42 0.00 0.00 0.49 0.00 0.00 109 A 8.02 4.85 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 0.00 110 F 9.01 5.25 0.00 3.00 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 D 8.80 5.40 0.00 2.38 2.44 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 0.00 112 N 9.17 4.74 0.00 2.94 3.05 0.00 0.00 6.32 7.39 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 0.00 113 Q 8.77 4.21 0.00 2.27 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.05 0.00 0.00 0.00 0.00 0.00 2.46 2.53 0.00 114 K 8.34 4.02 0.00 1.76 1.87 0.00 2.09 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.47 7.81 115 Q 8.05 3.42 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.71 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 116 V 7.83 4.48 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 0.54 0.00 0.00 0.92 0.00 0.00 117 Q 8.73 4.37 0.00 2.14 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.89 0.00 0.00 0.00 0.00 0.00 2.19 1.91 0.00 118 I 8.16 4.18 1.20 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.31 -0.36 0.00 0.00 119 M 6.74 4.64 0.00 2.06 2.23 0.00 0.00 0.00 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.60 0.00 120 G 8.27 4.79 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 0.00 0.00 0.00 121 F 7.04 4.99 0.00 3.21 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 0.00 122 L 8.83 4.55 0.00 1.57 1.59 0.68 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 123 V 8.88 4.52 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 0.71 0.00 0.00 0.89 0.00 0.00 124 Q 7.81 4.60 0.00 1.99 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.82 0.00 0.00 0.00 0.00 0.00 2.26 2.23 0.00 125 R 8.15 4.34 0.00 1.21 1.51 0.00 2.21 0.00 0.00 2.80 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.28 0.00 126 P 0.00 4.18 0.00 2.11 2.17 0.00 2.20 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.64 0.00 127 K 8.47 4.09 0.00 1.74 1.92 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.39 7.81 128 T 7.80 4.06 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 1.21 0.00 0.00 129 A 7.86 4.25 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 0.00 0.00 130 R 8.82 4.66 0.00 1.80 1.88 0.00 3.18 0.00 0.00 3.29 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.82 0.00 131 D 8.54 4.97 0.00 2.89 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 0.00 132 F 7.81 5.34 0.00 3.21 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 0.00 133 Q 8.37 4.41 0.00 1.86 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.07 0.00 0.00 0.00 0.00 0.00 2.28 2.03 0.00 134 P 0.00 4.54 0.00 2.21 2.20 0.00 3.56 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.88 0.00 135 A 8.84 3.97 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 0.00 136 N 8.05 4.67 0.00 2.83 2.95 0.00 0.00 5.88 7.13 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 0.00 137 K 7.91 4.41 0.00 1.60 1.72 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.30 7.81 138 R 7.47 3.56 0.00 1.68 0.66 0.00 3.00 0.00 0.00 3.20 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.27 0.00 139 S 7.51 5.09 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 0.00 140 V 8.40 3.99 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 0.60 0.00 0.00 0.95 0.00 0.00