NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4597 8.3049 120.3570 55.5378 32.6555 174.0272 2 T 4.5017 7.4980 117.5099 60.3457 71.9357 173.7706 3 H 4.5027 9.4157 125.4151 56.6768 28.2568 173.6913 4 D 4.8818 7.4787 121.4055 52.4652 43.6988 175.9066 5 N 4.5498 8.3876 117.9598 54.8431 38.9655 174.8423 6 K 3.8352 7.9590 111.1600 57.4124 30.2499 176.9012 7 L 4.1401 7.9205 118.9090 57.7277 41.9771 179.4178 8 Q 4.4610 7.6872 110.6672 56.0266 32.1370 175.4911 9 V 4.0757 7.3033 111.0249 60.5096 33.5771 172.9875 10 E 4.1349 8.5693 125.7457 55.2797 30.3205 176.2999 11 A 4.2395 8.3252 125.2113 52.3675 19.4904 178.3362 12 I 4.3687 7.6894 123.2807 62.0581 38.8304 174.9821 13 K 3.8993 8.5446 117.7411 58.6425 34.6948 174.9580 14 R 4.6081 7.7622 121.9799 55.7979 27.2233 174.4120 15 G 4.0717 8.1223 103.6118 45.5827 0.0000 172.4393 16 T 4.7813 7.9766 116.5362 62.3621 71.6913 174.3545 17 V 4.5225 7.9523 120.1812 62.1203 35.7556 172.6031 18 I 4.4810 9.2724 129.1740 59.8654 38.9498 174.5705 19 D 4.7731 8.8253 127.5784 52.1319 43.6831 175.2554 20 H 4.1060 8.7516 117.1810 56.7032 26.9159 175.6066 21 I 4.2420 7.8963 120.0596 59.5374 38.7379 174.9160 22 P 4.4764 0.0000 0.0000 62.0867 31.8472 175.5219 23 A 4.2252 8.5121 123.5559 54.4968 18.2877 177.8506 24 Q 3.9114 9.2128 120.3122 57.0078 26.3590 174.8178 25 I 4.3526 7.9186 120.3042 62.4566 37.6811 177.9419 26 G 3.9553 8.2820 108.1325 47.2258 0.0000 175.2529 27 F 4.4698 8.2604 122.5916 60.7725 39.3853 177.0265 28 K 3.6471 7.9780 117.6298 59.4275 31.8347 178.9944 29 L 3.9865 8.2013 119.2851 57.9090 41.1757 179.3368 30 L 3.9657 8.3704 120.4471 57.4738 41.8025 178.1398 31 S 4.1860 7.5400 111.4536 59.7907 63.1963 175.6496 32 L 3.8602 7.9688 122.6385 57.2547 41.7230 177.5035 33 F 4.7853 7.4897 115.0838 56.3430 39.7119 175.5011 34 K 3.8450 8.1860 118.5406 57.5452 29.8597 175.9966 35 L 4.1974 7.6306 117.7612 57.2066 42.1344 178.3468 36 T 4.5907 7.6761 108.2047 61.8657 69.3158 175.0773 37 E 4.4682 8.0206 121.5066 57.9748 31.1885 176.7958 38 T 4.0819 7.7548 114.7799 63.9840 68.9617 173.5634 39 D 4.7480 8.4277 120.7564 54.4106 41.5908 176.8547 40 Q 4.4399 7.5962 118.3646 54.0028 30.4534 175.1779 41 R 3.9335 8.4036 120.3552 57.4881 30.9834 175.0201 42 I 4.9953 8.2822 125.1185 59.9862 41.3952 175.2195 43 T 4.4827 9.0786 123.5273 61.7534 70.1918 172.8595 44 I 4.2986 8.2557 126.7738 60.7110 38.7654 176.4100 45 G 4.0174 9.5913 113.1464 44.4841 0.0000 170.8154 46 L 4.6797 8.4364 126.0222 53.7751 43.0929 176.5814 47 N 4.1236 8.2438 118.8794 54.3330 36.5600 174.2747 48 L 4.5914 8.7761 119.1973 52.7269 44.3600 176.4966 49 P 4.4918 0.0000 0.0000 63.0308 31.2968 175.5121 50 S 4.5897 8.7054 120.1372 56.5839 63.4279 175.2822 51 G 3.8802 9.0575 116.3570 48.0056 0.0000 173.7126 52 E 4.3465 7.7123 118.1590 58.0159 30.8698 175.8539 53 M 4.4248 7.7451 116.0696 54.0641 34.5294 173.9395 54 G 3.9642 8.4389 107.1200 45.3536 0.0000 174.2076 55 R 3.6834 8.6509 122.6779 57.0742 27.2909 175.6945 56 K 4.4662 8.5120 120.3383 57.0636 34.6405 177.1830 57 D 5.2295 9.1496 120.8976 52.7831 43.9097 175.2977 58 L 4.9653 8.9270 122.8347 53.8643 46.1774 174.8123 59 I 5.1402 8.7500 124.4023 59.6236 42.2114 174.6924 60 K 4.6220 8.4749 123.1993 55.9477 35.8776 174.7085 61 I 4.6550 8.1397 125.7849 59.4099 38.2970 174.5596 62 E 4.4413 8.8473 126.5159 55.8000 30.9947 176.6138 63 N 4.9492 8.6342 119.2797 53.9536 36.1464 173.8638 64 T 4.6637 6.8584 113.4682 61.6566 71.5740 173.5759 65 F 5.4321 8.4520 121.5538 54.5084 42.6523 174.3460 66 L 5.5213 8.3340 122.2691 52.1853 43.6804 176.9706 67 S 4.3899 8.8558 119.7956 58.2631 63.9841 175.1262 68 E 4.1051 8.7956 123.9578 59.9639 29.3041 179.1825 69 D 4.6764 8.0253 114.5208 53.6801 39.2497 176.7950 70 Q 4.3747 8.9156 123.8442 57.8833 30.5199 177.7892 71 V 3.6137 7.5766 112.8586 64.0574 31.6504 177.9299 72 D 4.5876 8.1129 118.7518 57.4707 40.5320 178.8653 73 Q 4.1693 7.6661 118.0457 58.6732 28.5210 178.5820 74 L 4.1990 8.3450 120.4377 57.3312 41.3901 178.8130 75 A 3.5817 7.6588 120.1540 55.1881 18.2368 179.0021 76 L 4.0340 7.5136 114.9939 56.4802 41.8778 177.2589 77 Y 4.6037 8.0150 113.1740 57.4928 40.4780 175.2867 78 A 4.9106 8.8264 122.5265 50.6634 18.8697 176.2709 79 P 4.7534 0.0000 0.0000 61.7833 31.0303 178.5741 80 Q 4.4765 9.4646 111.9328 56.9722 30.3631 173.2391 81 A 4.8522 7.9807 120.1849 51.8778 20.2811 177.6123 82 T 4.4745 8.2513 117.6678 62.4702 70.8959 174.6573 83 V 4.8770 8.6501 123.9485 60.4030 33.6629 174.5108 84 N 4.9490 8.5876 125.2023 52.2088 41.0677 174.6680 85 R 4.9891 8.0551 118.3141 53.9953 30.4667 173.7805 86 I 4.1211 7.8876 122.0528 61.6844 38.6397 175.4357 87 D 4.9260 10.2732 126.8108 54.0033 45.2048 175.0654 88 N 4.0537 9.4402 121.0908 55.6009 37.2186 173.0744 89 Y 3.9373 7.6500 107.1707 58.7084 35.6169 170.5858 90 E 4.7403 8.3538 117.8517 54.7341 33.5160 175.9661 91 V 4.2188 8.2160 123.3421 61.7459 31.1339 176.5542 92 V 3.6650 8.7417 126.4181 63.4034 30.4437 178.0685 93 G 4.0333 9.0331 104.0109 47.0253 0.0000 173.6235 94 K 4.8351 7.7712 116.6094 55.5384 35.9908 175.5481 95 S 4.6824 7.7432 115.2002 58.0726 66.5714 175.3378 96 R 5.0674 8.5140 119.6149 53.6201 32.8809 173.9793 97 P 4.6261 0.0000 0.0000 62.8803 32.3181 176.0283 98 S 4.5807 8.9625 116.0857 56.1325 65.9098 174.0211 99 L 3.8402 8.7228 123.3930 55.1617 41.6548 175.7793 100 P 4.6823 0.0000 0.0000 61.5012 33.3595 175.9801 101 E 4.2799 8.7450 117.7632 59.3590 29.8031 177.5840 102 R 5.3753 7.7750 112.1360 54.6163 33.8968 173.6047 103 I 4.6200 8.8598 118.3014 59.8068 40.5888 173.7732 104 D 5.4060 8.9308 128.7193 52.2463 44.2866 175.6004 105 N 4.0736 8.0783 114.3613 54.0600 36.8641 175.4773 106 V 4.5454 7.5448 113.0002 63.0677 36.7713 173.4198 107 L 5.7265 7.8709 117.6404 52.5377 46.2935 175.8309 108 V 4.6681 8.0895 112.1365 59.5077 35.0560 175.5173 109 C 4.5105 9.5085 120.8808 58.3007 29.3738 172.7239 110 P 4.2179 0.0000 0.0000 65.1807 31.3745 176.3961 111 N 4.6656 8.2390 117.1870 53.1118 39.1822 175.6853 112 S 4.3923 8.7623 119.9658 60.0388 63.7160 174.0359 113 N 4.7835 8.5303 119.2991 53.4790 38.6078 173.9518 114 C 4.4798 7.4657 115.1634 58.4763 32.1506 173.8447 115 I 4.1068 8.0497 122.6877 61.5268 37.6404 177.1028 116 S 3.9776 7.6481 112.9028 60.7394 63.2329 174.8732 117 H 4.6038 7.7485 119.0031 58.1858 29.3494 176.7357 118 A 4.1018 7.7659 120.7184 54.4148 18.7927 177.7970 119 E 4.1409 6.9225 114.6477 55.6856 30.3014 176.6312 120 P 4.6249 0.0000 0.0000 61.6614 29.5203 176.0523 121 V 4.5582 7.1619 112.9068 59.3535 36.0883 175.1306 122 S 4.4672 8.4389 116.7673 57.6969 63.9319 174.0035 123 S 4.5604 8.5341 117.0199 58.5882 65.1063 172.5699 124 S 5.1734 7.3839 108.3440 58.2844 65.4422 174.8060 125 F 5.3502 8.6764 125.5458 55.6930 42.6303 175.1531 126 A 4.8437 9.0730 125.4011 51.4667 20.5417 176.0601 127 V 4.6430 8.1565 118.3612 61.1557 33.9090 174.7099 128 R 4.5737 9.2522 128.5757 54.3523 32.6127 174.6379 129 K 4.5096 8.8107 126.4446 56.1581 32.3228 176.5343 130 R 4.6064 8.4543 123.2058 54.0005 33.2212 176.2879 131 A 4.2162 8.4190 121.4327 55.0278 19.0817 178.7809 132 N 4.4598 8.3520 113.4809 55.5440 39.3936 174.8940 133 D 4.5236 7.3785 114.6719 52.1921 39.7570 175.1317 134 I 4.1546 7.9583 116.2785 61.3221 38.8837 174.4429 135 A 4.9405 9.0108 128.4505 50.3265 21.4819 175.3129 136 L 5.7105 8.6902 120.9155 52.5111 44.2413 175.5500 137 K 4.5786 8.4861 123.9722 54.6032 33.6285 176.0428 138 C 4.1012 8.5206 123.6685 56.9945 40.8633 174.5890 139 K 3.5776 8.1032 124.5122 59.5268 31.8467 177.3956 140 Y 4.3069 7.7939 116.9415 60.1460 38.6349 175.6146 141 C 4.3075 8.0095 116.9807 56.5850 42.8813 173.2157 142 E 3.4189 7.4272 118.3623 57.0174 26.1119 175.6123 143 K 4.2097 7.2334 115.8261 54.1986 35.8839 177.8495 144 E 4.0360 8.7950 125.2812 57.1361 30.1476 176.8750 145 F 5.4254 9.9988 124.7467 55.2991 42.3529 175.4013 146 S 4.8497 9.2809 118.5055 58.1607 63.2582 174.8981 147 H 4.1267 8.2969 114.2481 57.6756 28.7629 176.8477 148 N 4.3635 7.7366 115.6353 54.1412 38.6104 175.5289 149 V 4.2531 6.9857 115.9447 61.3445 33.4101 176.3899 150 V 3.7256 7.0564 120.3554 62.8362 32.2456 176.0495 151 L 4.5889 8.3169 126.6301 53.7653 44.3594 174.5117 152 A 5.7336 8.2107 120.1246 49.5313 22.6436 176.3088 153 N 4.5072 8.3951 114.9164 53.5521 39.1485 175.1528 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 4.46 0.00 2.22 2.18 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 2.51 2.60 0.00 2 T 7.50 4.50 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 1.24 0.00 0.00 3 H 9.42 4.50 0.00 3.06 3.27 0.00 5.90 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 7.48 4.88 0.00 2.83 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 5 N 8.39 4.55 0.00 2.64 2.76 0.00 0.00 7.18 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 6 K 7.96 3.84 0.00 1.87 1.81 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.21 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.42 7.81 7 L 7.92 4.14 0.00 1.63 1.72 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 7.69 4.46 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.82 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 9 V 7.30 4.08 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 0.57 0.00 0.00 0.92 0.00 0.00 10 E 8.57 4.13 0.00 1.94 1.87 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 2.33 2.32 0.00 11 A 8.33 4.24 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 12 I 7.69 4.37 1.80 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 1.43 0.60 0.80 0.00 0.00 13 K 8.54 3.90 0.00 1.32 0.86 0.00 1.54 0.00 0.00 1.50 0.00 0.00 2.45 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.63 1.03 7.81 14 R 7.76 4.61 0.00 1.94 2.02 0.00 3.90 0.00 0.00 3.38 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.52 0.00 15 G 8.12 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.98 4.78 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 1.17 0.00 0.00 17 V 7.95 4.52 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 0.90 0.00 0.00 0.89 0.00 0.00 18 I 9.27 4.48 1.87 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 1.09 0.73 0.92 0.00 0.00 19 D 8.83 4.77 0.00 2.70 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 20 H 8.75 4.11 0.00 3.23 3.30 0.00 5.70 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 21 I 7.90 4.24 1.98 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 1.34 0.64 1.00 0.00 0.00 22 P 0.00 4.48 0.00 2.23 2.01 0.00 3.70 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.13 0.00 23 A 8.51 4.23 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 24 Q 9.21 3.91 0.00 2.29 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.89 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 25 I 7.92 4.35 2.10 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.13 1.08 0.00 0.00 26 G 8.28 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 27 F 8.26 4.47 0.00 3.06 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 28 K 7.98 3.65 0.00 1.89 1.61 0.00 1.58 0.00 0.00 1.79 0.00 0.00 2.70 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.55 1.53 7.81 29 L 8.20 3.99 0.00 1.68 1.83 0.98 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 30 L 8.37 3.97 0.00 2.05 1.83 0.95 0.99 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 31 S 7.54 4.19 0.00 3.38 3.28 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 32 L 7.97 3.86 0.00 1.07 1.05 0.60 -1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 33 F 7.49 4.79 0.00 3.10 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 34 K 8.19 3.84 0.00 1.78 2.13 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.37 1.37 7.81 35 L 7.63 4.20 0.00 1.69 1.73 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.68 4.59 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 1.23 0.00 0.00 37 E 8.02 4.47 0.00 1.96 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 2.22 2.45 0.00 38 T 7.75 4.08 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 1.25 0.00 0.00 39 D 8.43 4.75 0.00 2.63 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 40 Q 7.60 4.44 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 41 R 8.40 3.93 0.00 1.87 1.91 0.00 3.10 0.00 0.00 3.62 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 42 I 8.28 5.00 1.87 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 1.32 0.98 0.91 0.00 0.00 43 T 9.08 4.48 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 1.21 0.00 0.00 44 I 8.26 4.30 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.38 0.95 0.00 0.00 45 G 9.59 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 0.00 0.00 0.00 46 L 8.44 4.68 0.00 1.53 1.60 0.88 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.24 4.12 0.00 2.87 2.84 0.00 0.00 6.96 7.35 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 48 L 8.78 4.59 0.00 1.55 1.56 0.95 1.04 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 49 P 0.00 4.49 0.00 1.94 2.01 0.00 3.66 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 50 S 8.71 4.59 0.00 4.01 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 51 G 9.06 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 0.00 0.00 0.00 52 E 7.71 4.35 0.00 2.12 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 2.28 2.28 0.00 53 M 7.75 4.42 0.00 2.02 2.03 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 2.55 2.55 0.00 54 G 8.44 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 55 R 8.65 3.68 0.00 1.90 1.97 0.00 3.22 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 56 K 8.51 4.47 0.00 1.84 1.98 0.00 1.34 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.58 1.42 7.81 57 D 9.15 5.23 0.00 2.95 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 58 L 8.93 4.97 0.00 1.65 1.42 0.94 0.83 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 59 I 8.75 5.14 1.87 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 1.31 0.87 0.91 0.00 0.00 60 K 8.47 4.62 0.00 1.81 1.84 0.00 1.27 0.00 0.00 1.63 0.00 0.00 2.82 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.49 1.39 7.81 61 I 8.14 4.65 1.76 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.93 0.84 0.00 0.00 62 E 8.85 4.44 0.00 2.02 1.78 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 2.19 2.21 0.00 63 N 8.63 4.95 0.00 3.04 2.90 0.00 0.00 7.07 7.54 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 64 T 6.86 4.66 4.11 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 1.18 0.00 0.00 65 F 8.45 5.43 0.00 2.96 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 66 L 8.33 5.52 0.00 1.59 1.52 0.84 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 67 S 8.86 4.39 0.00 3.88 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 68 E 8.80 4.11 0.00 2.02 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 2.41 2.35 0.00 69 D 8.03 4.68 0.00 2.79 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 70 Q 8.92 4.37 0.00 2.04 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.06 6.86 0.00 0.00 0.00 0.00 0.00 2.11 2.28 0.00 71 V 7.58 3.61 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 0.79 0.00 0.00 0.96 0.00 0.00 72 D 8.11 4.59 0.00 2.68 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 73 Q 7.67 4.17 0.00 1.97 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.81 0.00 0.00 0.00 0.00 0.00 2.55 2.52 0.00 74 L 8.34 4.20 0.00 1.75 1.78 0.88 0.53 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 75 A 7.66 3.58 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 76 L 7.51 4.03 0.00 1.57 1.12 0.91 0.62 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 77 Y 8.01 4.60 0.00 2.92 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 78 A 8.83 4.91 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 79 P 0.00 4.75 0.00 2.06 2.08 0.00 3.75 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.38 0.00 80 Q 9.46 4.48 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.73 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 81 A 7.98 4.85 1.36 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 0.00 0.00 82 T 8.25 4.47 4.32 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 1.28 0.00 0.00 83 V 8.65 4.88 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 1.39 0.00 0.00 0.93 0.00 0.00 84 N 8.59 4.95 0.00 2.69 2.73 0.00 0.00 6.81 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 85 R 8.06 4.99 0.00 1.88 2.12 0.00 3.22 0.00 0.00 3.59 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.71 0.00 86 I 7.89 4.12 1.82 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 1.23 0.70 0.90 0.00 0.00 87 D 10.27 4.93 0.00 2.77 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 88 N 9.44 4.05 0.00 2.82 2.87 0.00 0.00 7.18 7.54 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 89 Y 7.65 3.94 0.00 3.12 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 90 E 8.35 4.74 0.00 2.12 1.81 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 2.30 2.42 0.00 91 V 8.22 4.22 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 0.82 0.00 0.00 0.95 0.00 0.00 92 V 8.74 3.66 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 0.81 0.00 0.00 1.06 0.00 0.00 93 G 9.03 4.03 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 0.00 0.00 0.00 94 K 7.77 4.84 0.00 1.62 1.68 0.00 1.81 0.00 0.00 1.77 0.00 0.00 3.19 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.54 1.43 7.81 95 S 7.74 4.68 0.00 3.84 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 96 R 8.51 5.07 0.00 1.68 1.84 0.00 3.22 0.00 0.00 3.35 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 97 P 0.00 4.63 0.00 1.95 2.21 0.00 3.61 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.09 0.00 98 S 8.96 4.58 0.00 3.91 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 99 L 8.72 3.84 0.00 1.66 1.70 0.91 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 4.68 0.00 2.26 2.03 0.00 3.72 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 2.05 2.14 0.00 101 E 8.75 4.28 0.00 1.90 1.99 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 2.40 2.26 0.00 102 R 7.77 5.38 0.00 1.87 1.88 0.00 2.97 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.62 0.00 103 I 8.86 4.62 2.07 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.76 1.11 0.00 0.00 104 D 8.93 5.41 0.00 2.69 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 0.00 105 N 8.08 4.07 0.00 2.99 2.91 0.00 0.00 6.67 7.56 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 0.00 106 V 7.54 4.55 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 0.69 0.00 0.00 1.12 0.00 0.00 107 L 7.87 5.73 0.00 1.29 1.26 0.53 0.99 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 0.00 108 V 8.09 4.67 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 0.84 0.00 0.00 0.96 0.00 0.00 109 C 9.51 4.51 0.00 3.43 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 0.00 110 P 0.00 4.22 0.00 1.19 1.79 0.00 4.27 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.02 0.00 111 N 8.24 4.67 0.00 3.30 2.96 0.00 0.00 6.83 7.51 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 0.00 112 S 8.76 4.39 0.00 4.02 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 0.00 113 N 8.53 4.78 0.00 2.83 2.87 0.00 0.00 7.07 7.24 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 0.00 114 C 7.47 4.48 0.00 3.10 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 0.00 115 I 8.05 4.11 1.84 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 1.63 0.97 0.80 0.00 0.00 116 S 7.65 3.98 0.00 3.90 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 0.00 117 H 7.75 4.60 0.00 3.15 3.36 0.00 5.70 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 A 7.77 4.10 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 0.00 119 E 6.92 4.14 0.00 1.88 1.82 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 2.28 2.36 0.00 120 P 0.00 4.62 0.00 2.03 2.00 0.00 3.62 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 121 V 7.16 4.56 2.07 0.00 0.00 0.00 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 0.62 0.00 0.00 122 S 8.44 4.47 0.00 4.15 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 0.00 123 S 8.53 4.56 0.00 4.34 4.32 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 0.00 124 S 7.38 5.17 0.00 3.85 3.51 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 0.00 125 F 8.68 5.35 0.00 3.06 2.97 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 0.00 126 A 9.07 4.84 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 0.00 127 V 8.16 4.64 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 0.79 0.00 0.00 1.07 0.00 0.00 128 R 9.25 4.57 0.00 1.88 1.78 0.00 3.31 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.84 0.00 129 K 8.81 4.51 0.00 1.68 1.77 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.47 7.81 130 R 8.45 4.61 0.00 1.97 1.84 0.00 3.21 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 131 A 8.42 4.22 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 0.00 132 N 8.35 4.46 0.00 2.70 2.86 0.00 0.00 6.84 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 0.00 133 D 7.38 4.52 0.00 2.90 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 0.00 134 I 7.96 4.15 1.99 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 1.22 0.78 0.93 0.00 0.00 135 A 9.01 4.94 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 0.00 136 L 8.69 5.71 0.00 1.83 1.89 0.74 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 137 K 8.49 4.58 0.00 1.85 1.61 0.00 1.51 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.35 1.41 7.81 138 C 8.52 4.10 0.00 2.96 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 0.00 139 K 8.10 3.58 0.00 1.57 1.08 0.00 1.56 0.00 0.00 1.47 0.00 0.00 2.36 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.88 1.12 7.81 140 Y 7.79 4.31 0.00 2.95 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 0.00 141 C 8.01 4.31 0.00 3.10 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 0.00 142 E 7.43 3.42 0.00 2.25 2.01 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 2.15 2.19 0.00 143 K 7.23 4.21 0.00 0.89 0.82 0.00 1.67 0.00 0.00 1.62 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.24 1.37 7.81 144 E 8.80 4.04 0.00 1.80 1.95 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 2.31 2.32 0.00 145 F 10.00 5.43 0.00 2.86 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 0.00 146 S 9.28 4.85 0.00 3.99 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 0.00 147 H 8.30 4.13 0.00 3.26 3.49 0.00 5.45 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 N 7.74 4.36 0.00 2.59 2.82 0.00 0.00 6.70 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 0.00 149 V 6.99 4.25 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 0.56 0.00 0.00 0.83 0.00 0.00 150 V 7.06 3.73 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 0.49 0.00 0.00 0.95 0.00 0.00 151 L 8.32 4.59 0.00 1.62 1.57 0.90 0.88 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 0.00 152 A 8.21 5.73 1.13 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 0.00 0.00 153 N 8.40 4.51 0.00 2.69 2.70 0.00 0.00 6.74 7.56 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