NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6861 8.3049 120.6127 55.4908 33.6250 174.1978 2 I 4.3453 8.8856 127.4362 58.6186 39.6659 171.4592 3 E 4.3978 8.9004 128.7860 55.7936 31.1900 174.8072 4 I 5.1264 8.4117 126.0594 59.4034 41.2530 174.1416 5 T 4.8638 8.5922 116.1909 59.9204 71.5218 172.8979 6 L 4.6886 8.3216 122.7275 52.7809 43.8775 176.9337 7 K 4.1201 8.7526 121.8517 59.2686 32.5101 177.4370 8 K 4.6067 7.5000 114.9809 53.8202 35.1681 174.6018 9 P 4.2786 0.0000 0.0000 65.6374 29.9442 178.1428 10 E 4.2816 8.0098 113.8192 57.7157 29.6877 177.8232 11 D 4.5369 8.5139 120.8807 56.1183 40.8994 178.1056 12 F 3.8622 8.3321 122.4540 61.2906 39.4687 176.8671 13 L 4.0033 8.1126 119.3792 57.7153 41.8637 178.6054 14 K 3.8837 7.5119 117.5000 59.5168 32.0790 178.9643 15 V 3.5787 7.5898 118.4656 65.5307 31.2066 177.7374 16 K 3.6906 7.7724 118.8228 59.5074 32.2688 178.0825 17 E 4.0862 8.3296 119.3873 59.6573 29.6614 178.6103 18 T 3.9368 8.0569 115.8635 66.9647 68.3398 176.4505 19 L 4.1559 8.0040 119.6663 57.4871 41.6494 179.2546 20 T 4.0671 7.8153 109.1049 63.6062 68.9102 175.0585 21 R 4.5110 7.8163 121.1822 55.2518 30.7131 175.4649 22 M 4.8942 7.2307 114.3095 53.1129 34.7688 175.0701 23 G 4.3233 7.3615 110.7185 46.1940 0.0000 171.4950 24 I 4.5679 7.8926 124.0792 60.1924 38.8921 174.6454 25 A 5.0271 8.6559 129.4058 50.6196 20.5321 175.5636 26 N 4.7499 9.2089 123.1285 52.3995 39.9031 175.5321 27 N 4.4552 8.8947 125.0577 55.7463 39.1711 177.7014 28 K 4.1687 8.1308 116.3911 58.3500 32.2540 176.9329 29 D 4.6313 8.0804 117.3987 52.3978 40.6642 176.2066 30 K 3.1041 7.2756 115.9102 57.9743 29.8390 174.1318 31 V 4.8091 7.8656 118.7212 59.6135 34.7276 176.1047 32 L 4.9949 8.7237 126.3845 53.5081 44.5655 174.3729 33 Y 5.6557 8.8655 124.8879 55.9850 39.4359 174.8765 34 Q 4.5817 8.7052 126.6892 56.0304 30.4724 176.0139 35 S 4.8305 8.8958 117.0133 57.6881 65.3453 172.8199 36 C 5.4566 8.2349 117.5649 58.4420 31.0838 172.8245 37 H 4.9952 9.4627 118.8272 54.0710 33.0395 171.9840 38 I 4.7858 8.1834 119.8788 59.4924 39.7372 174.3499 39 L 5.0789 9.2011 130.4169 53.3774 45.1087 174.5723 40 Q 5.3932 8.9896 126.2497 54.5081 31.5756 175.0201 41 K 4.2903 9.2685 126.7121 56.3717 34.8504 175.7987 42 K 3.7853 9.7209 127.7697 57.6684 29.5341 176.3339 43 G 3.7430 8.7435 104.2890 45.4800 0.0000 173.6009 44 L 4.4052 7.6065 119.2521 52.7186 45.2663 174.9605 45 Y 5.4055 7.7083 117.0370 56.6806 41.7336 174.4261 46 Y 5.2447 8.8998 118.6229 56.5264 43.1053 174.2583 47 I 4.8420 8.8848 124.8080 60.1985 38.9175 175.1964 48 V 4.7617 8.7783 126.9364 59.9442 34.6694 174.7612 49 H 4.9126 9.0548 123.3043 55.3549 30.6365 176.1816 50 F 4.1851 9.2852 122.0721 60.0334 37.2800 177.9507 51 K 3.7671 7.2472 118.5432 58.9607 31.9128 178.8586 52 E 3.9358 8.3275 119.3779 59.4270 29.4333 179.2119 53 M 4.1184 7.8322 118.4849 58.1525 32.1594 178.5024 54 L 4.2690 8.4550 119.6365 57.7172 41.7419 179.2883 55 R 4.3064 8.1811 120.1892 59.2730 29.9145 178.2854 56 M 4.2251 8.2972 116.5997 57.1295 32.0646 177.1611 57 D 4.9316 7.4247 116.5140 53.5503 41.9904 176.6745 58 G 4.0861 8.3501 108.0601 45.2237 0.0000 174.6593 59 R 4.2429 8.1630 119.3959 55.8858 31.3620 176.6965 60 Q 4.5705 8.3760 120.2205 55.4924 28.1113 176.3401 61 V 4.3422 7.3233 116.5936 59.7132 34.1121 175.1053 62 E 4.4998 8.4595 122.7896 54.5544 30.8523 175.1631 63 M 4.2801 8.5052 126.7550 55.1528 32.8696 177.0437 64 T 4.4057 8.7480 115.2143 60.3700 72.2429 175.4299 65 E 3.9500 8.4650 120.0024 59.4258 29.5961 177.8786 66 E 3.7926 8.1794 118.9088 59.6161 29.5285 178.5397 67 D 4.2914 8.0837 118.6565 57.2182 40.7789 178.6313 68 E 3.9675 7.9289 119.2229 59.4101 29.5033 179.3647 69 V 3.5775 7.8722 118.5547 66.1176 31.4763 177.9752 70 R 3.8284 7.9322 118.2663 59.4020 29.9388 178.4318 71 R 3.9527 8.2171 118.5323 59.6673 30.1336 178.3120 72 D 4.2935 8.4108 118.7972 57.4342 40.7515 178.9375 73 S 4.6141 8.4300 115.7948 61.4205 62.9060 176.7440 74 I 3.5691 7.9125 122.6046 63.9171 36.7884 178.3222 75 A 3.8362 7.9077 121.8472 54.7171 18.1564 179.5500 76 W 4.2832 8.2027 117.8253 59.8446 29.1616 178.3081 77 L 3.5488 8.0470 120.3311 58.1988 41.4737 178.9888 78 L 3.9877 7.4480 118.4337 57.6556 41.4071 179.2217 79 E 4.3987 8.1105 120.4644 59.0710 29.4388 178.4927 80 D 4.4451 8.2750 117.8792 57.2974 41.0065 178.3910 81 W 4.7475 8.1360 116.8655 57.0151 29.2172 177.2001 82 G 3.9975 8.2009 107.3279 46.1177 0.0000 174.8319 83 L 4.2391 8.1361 121.3673 56.3608 42.0422 176.2467 84 I 4.8470 7.3343 110.5203 59.6083 41.9653 173.4835 85 E 4.8473 8.4632 119.4160 54.5741 33.0973 175.7444 86 I 4.1146 8.5389 126.1338 60.9059 37.9888 176.1521 87 V 3.8857 8.3179 127.5689 61.6912 31.8232 174.2888 88 P 4.2572 0.0000 0.0000 64.5235 31.5282 176.1769 89 G 3.9545 9.1928 108.0411 45.5966 0.0000 172.8297 90 Q 4.5975 7.6193 116.6656 53.4696 31.6948 175.4579 91 R 4.1742 8.5057 121.5948 55.9858 30.5096 176.1173 92 T 4.7517 8.0713 112.2147 59.3800 71.9450 173.7177 93 F 4.6017 8.9071 121.9900 57.5484 39.5773 175.4433 94 M 4.2545 8.4731 121.9701 54.6095 32.5778 176.2239 95 K 4.1575 7.9332 122.0577 56.2654 32.6979 176.4472 96 D 4.2773 8.9220 126.8493 54.0249 42.5564 175.4150 97 L 4.3399 7.8757 131.4312 53.4623 41.0993 176.4531 98 T 3.9206 7.7673 118.2300 64.4443 69.2873 176.7760 99 N 3.7966 9.3668 118.1147 56.9595 38.6669 175.2779 100 N 5.1380 9.1875 118.2619 52.3344 41.9233 173.5572 101 F 5.0691 8.6729 127.1106 56.9965 42.8370 173.1562 102 R 4.4423 7.8140 125.0793 54.7129 33.8356 173.4490 103 V 4.7339 8.2009 124.9930 60.9152 33.7816 174.5059 104 I 4.4891 8.0627 120.8571 58.5714 39.9436 175.5761 105 S 4.3391 8.4103 118.8549 57.7831 63.5157 174.6136 106 F 4.1514 8.7286 122.2908 61.1874 38.7908 177.0811 107 K 4.0854 8.0254 117.2496 59.6394 33.0184 178.3055 108 Q 4.2249 7.9305 119.6218 57.5903 29.0359 177.6825 109 K 4.0287 7.4866 119.3549 60.1057 32.2537 178.1277 110 H 4.3106 7.9405 113.1006 57.0439 28.3093 175.2394 111 E 4.4531 8.3239 118.8062 56.1568 30.4287 175.5536 112 W 4.6423 8.2836 119.5330 54.7726 31.5161 176.3619 113 K 4.3142 8.9878 124.1340 55.4683 32.3957 175.9288 114 L 4.7324 8.4027 126.1027 54.1251 42.8926 177.0019 115 V 4.3133 8.8084 123.6284 60.4411 34.7150 172.8582 116 P 4.8622 0.0000 0.0000 62.1638 31.1781 177.9540 117 K 3.6957 8.9032 124.0854 59.1887 32.2391 178.6542 118 Y 4.5166 8.1403 119.4628 60.8117 38.5638 177.2868 119 T 3.9193 7.5218 107.4009 62.4897 69.5486 174.5450 120 I 3.4599 6.9193 123.5277 61.7394 37.1733 175.3684 121 G 3.7332 8.5924 115.1382 45.6085 0.0000 172.9129 122 N 4.6682 8.8167 121.8615 53.6411 38.1129 174.2999 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 4.69 0.00 1.96 2.08 0.00 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.37 0.00 2 I 8.89 4.35 1.82 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 1.09 0.20 0.77 0.00 0.00 3 E 8.90 4.40 0.00 2.04 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.72 0.00 4 I 8.41 5.13 1.82 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 1.21 1.12 0.92 0.00 0.00 5 T 8.59 4.86 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 1.22 0.00 0.00 6 L 8.32 4.69 0.00 1.26 1.46 0.85 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 7 K 8.75 4.12 0.00 1.85 1.87 0.00 1.67 0.00 0.00 1.77 0.00 0.00 3.15 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.50 7.81 8 K 7.50 4.61 0.00 1.89 1.85 0.00 1.75 0.00 0.00 1.81 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.44 7.81 9 P 0.00 4.28 0.00 2.19 2.18 0.00 3.60 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 2.14 2.20 0.00 10 E 8.01 4.28 0.00 2.17 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 2.36 2.34 0.00 11 D 8.51 4.54 0.00 2.93 2.68 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 12 F 8.33 3.86 0.00 2.97 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 13 L 8.11 4.00 0.00 1.93 1.72 1.00 0.60 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 14 K 7.51 3.88 0.00 1.82 2.00 0.00 1.65 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.41 7.81 15 V 7.59 3.58 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 0.91 0.00 0.00 0.93 0.00 0.00 16 K 7.77 3.69 0.00 1.43 1.96 0.00 1.77 0.00 0.00 1.60 0.00 0.00 3.17 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.51 7.81 17 E 8.33 4.09 0.00 2.19 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 2.39 2.64 0.00 18 T 8.06 3.94 4.46 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 1.45 0.00 0.00 19 L 8.00 4.16 0.00 1.71 1.83 0.90 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 20 T 7.82 4.07 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 1.26 0.00 0.00 21 R 7.82 4.51 0.00 2.00 2.03 0.00 3.36 0.00 0.00 3.10 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.50 0.00 22 M 7.23 4.89 0.00 2.19 2.12 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.64 0.00 23 G 7.36 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 0.00 0.00 0.00 24 I 7.89 4.57 2.05 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.73 1.07 0.00 0.00 25 A 8.66 5.03 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 26 N 9.21 4.75 0.00 2.92 2.75 0.00 0.00 6.79 6.31 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 27 N 8.89 4.46 0.00 2.83 2.85 0.00 0.00 7.09 6.90 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 28 K 8.13 4.17 0.00 1.74 1.85 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.41 7.81 29 D 8.08 4.63 0.00 2.63 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.28 3.10 0.00 1.41 0.74 0.00 1.06 0.00 0.00 0.61 0.00 0.00 2.64 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.30 0.83 7.81 31 V 7.87 4.81 1.89 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 0.82 0.00 0.00 0.18 0.00 0.00 32 L 8.72 4.99 0.00 1.73 1.47 0.69 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 33 Y 8.87 5.66 0.00 2.87 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 34 Q 8.71 4.58 0.00 2.12 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.72 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 35 S 8.90 4.83 0.00 4.22 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 36 C 8.23 5.46 0.00 2.88 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 37 H 9.46 5.00 0.00 2.90 3.09 0.00 5.59 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 I 8.18 4.79 1.65 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.94 0.21 0.00 0.00 39 L 9.20 5.08 0.00 1.88 1.76 0.96 0.36 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 40 Q 8.99 5.39 0.00 2.05 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.48 0.00 0.00 0.00 0.00 0.00 2.05 2.16 0.00 41 K 9.27 4.29 0.00 1.85 1.79 0.00 1.78 0.00 0.00 1.57 0.00 0.00 2.69 0.00 0.00 2.41 0.00 0.00 0.00 0.00 1.36 1.41 7.81 42 K 9.72 3.79 0.00 1.92 1.84 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.78 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.41 7.81 43 G 8.74 3.74 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 0.00 0.00 0.00 44 L 7.61 4.41 0.00 1.57 1.14 0.95 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 45 Y 7.71 5.41 0.00 2.95 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 46 Y 8.90 5.24 0.00 2.99 2.80 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 0.00 0.00 0.00 0.00 47 I 8.88 4.84 1.84 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 1.23 0.76 0.90 0.00 0.00 48 V 8.78 4.76 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.96 0.00 0.00 49 H 9.05 4.91 0.00 3.27 3.12 0.00 5.80 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 F 9.29 4.19 0.00 3.38 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 K 7.25 3.77 0.00 1.59 1.70 0.00 1.62 0.00 0.00 1.79 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.03 0.49 7.81 52 E 8.33 3.94 0.00 2.13 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 2.29 2.31 0.00 53 M 7.83 4.12 0.00 1.77 2.06 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.42 0.00 54 L 8.45 4.27 0.00 1.86 1.80 1.14 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 55 R 8.18 4.31 0.00 2.04 2.06 0.00 3.13 0.00 0.00 3.24 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.53 0.00 56 M 8.30 4.23 0.00 1.99 2.32 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.56 0.00 57 D 7.42 4.93 0.00 2.86 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 58 G 8.35 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 0.00 0.00 0.00 59 R 8.16 4.24 0.00 1.96 1.87 0.00 3.29 0.00 0.00 3.18 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.76 0.00 60 Q 8.38 4.57 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.29 0.00 61 V 7.32 4.34 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 0.70 0.00 0.00 0.92 0.00 0.00 62 E 8.46 4.50 0.00 1.91 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 2.18 2.28 0.00 63 M 8.51 4.28 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.34 0.00 64 T 8.75 4.41 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 1.20 0.00 0.00 65 E 8.46 3.95 0.00 2.07 1.92 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 2.17 2.53 0.00 66 E 8.18 3.79 0.00 2.02 1.92 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 2.37 2.39 0.00 67 D 8.08 4.29 0.00 2.71 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 0.00 0.00 0.00 68 E 7.93 3.97 0.00 2.38 2.25 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 2.37 2.53 0.00 69 V 7.87 3.58 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 0.89 0.00 0.00 -0.12 0.00 0.00 70 R 7.93 3.83 0.00 2.02 1.99 0.00 3.31 0.00 0.00 3.00 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.79 0.00 71 R 8.22 3.95 0.00 2.10 2.11 0.00 3.34 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 72 D 8.41 4.29 0.00 2.93 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 73 S 8.43 4.61 0.00 3.74 3.82 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 74 I 7.91 3.57 2.00 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 1.43 1.19 0.93 0.00 0.00 75 A 7.91 3.84 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 76 W 8.20 4.28 0.00 3.38 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 77 L 8.05 3.55 0.00 1.56 1.38 0.47 0.50 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 78 L 7.45 3.99 0.00 1.83 1.71 0.90 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 79 E 8.11 4.40 0.00 2.07 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 2.41 2.45 0.00 80 D 8.28 4.45 0.00 2.69 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 81 W 8.14 4.75 0.00 3.55 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 82 G 8.20 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 L 8.14 4.24 0.00 1.76 1.78 1.07 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 84 I 7.33 4.85 1.82 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.74 0.86 0.00 0.00 85 E 8.46 4.85 0.00 1.91 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 2.23 2.28 0.00 86 I 8.54 4.11 1.60 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.19 0.62 0.00 0.00 87 V 8.32 3.89 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 0.73 0.00 0.00 0.89 0.00 0.00 88 P 0.00 4.26 0.00 2.22 2.07 0.00 3.80 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 89 G 9.19 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 90 Q 7.62 4.60 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.21 6.93 0.00 0.00 0.00 0.00 0.00 2.23 2.51 0.00 91 R 8.51 4.17 0.00 1.72 1.76 0.00 3.10 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 92 T 8.07 4.75 4.40 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 1.10 0.00 0.00 93 F 8.91 4.60 0.00 3.27 2.98 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 94 M 8.47 4.25 0.00 1.91 2.00 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 2.69 2.51 0.00 95 K 7.93 4.16 0.00 1.52 1.55 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.60 7.81 96 D 8.92 4.28 0.00 2.52 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 97 L 7.88 4.34 0.00 1.51 1.23 0.51 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 98 T 7.77 3.92 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 99 N 9.37 3.80 0.00 2.75 2.69 0.00 0.00 6.58 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 0.00 100 N 9.19 5.14 0.00 2.74 2.76 0.00 0.00 6.59 7.02 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 0.00 101 F 8.67 5.07 0.00 3.05 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 0.00 102 R 7.81 4.44 0.00 1.72 1.53 0.00 3.04 0.00 0.00 3.05 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.25 0.00 103 V 8.20 4.73 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 1.02 0.00 0.00 1.22 0.00 0.00 104 I 8.06 4.49 1.23 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.62 -0.29 0.00 0.00 105 S 8.41 4.34 0.00 3.99 3.89 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 0.00 106 F 8.73 4.15 0.00 3.09 3.07 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 0.00 107 K 8.03 4.09 0.00 1.99 2.01 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.50 7.81 108 Q 7.93 4.22 0.00 2.14 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.83 0.00 0.00 0.00 0.00 0.00 2.76 2.44 0.00 109 K 7.49 4.03 0.00 1.93 1.97 0.00 1.16 0.00 0.00 1.38 0.00 0.00 2.13 0.00 0.00 2.45 0.00 0.00 0.00 0.00 1.12 1.14 7.81 110 H 7.94 4.31 0.00 3.20 3.42 0.00 5.52 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 E 8.32 4.45 0.00 1.94 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 2.41 0.00 112 W 8.28 4.64 0.00 3.20 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 0.00 113 K 8.99 4.31 0.00 1.63 1.71 0.00 1.43 0.00 0.00 1.67 0.00 0.00 2.82 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.36 1.40 7.81 114 L 8.40 4.73 0.00 1.52 1.59 0.87 0.89 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 0.00 115 V 8.81 4.31 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 1.14 0.00 0.00 0.87 0.00 0.00 116 P 0.00 4.86 0.00 2.34 2.09 0.00 3.70 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.15 0.00 117 K 8.90 3.70 0.00 0.79 0.74 0.00 1.29 0.00 0.00 1.13 0.00 0.00 2.78 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.30 1.25 7.81 118 Y 8.14 4.52 0.00 2.94 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 0.00 119 T 7.52 3.92 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 1.20 0.00 0.00 120 I 6.92 3.46 1.94 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 1.25 0.71 0.88 0.00 0.00 121 G 8.59 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 N 8.82 4.67 0.00 2.91 2.91 0.00 0.00 7.01 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