NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.2195 8.2544 120.8607 55.6742 31.2365 174.8020 2 V 3.4258 8.3080 125.2526 62.1898 31.8796 174.2746 3 A 4.2437 8.2589 130.4344 51.3996 19.9738 176.0801 4 E 4.0157 8.4359 118.4392 56.3828 30.6394 177.9740 5 N 4.6213 8.4034 123.8942 52.6746 37.6589 174.5903 6 R 4.2984 7.4875 117.8753 54.7632 31.1710 174.9730 7 P 4.5868 0.0000 0.0000 64.8620 31.4165 176.2122 8 G 4.0967 9.6639 111.8278 45.3127 0.0000 173.4014 9 A 4.1031 8.4483 122.8312 51.8821 19.2536 177.4535 10 F 4.8839 8.7383 120.8193 57.9555 40.3370 174.9094 11 I 4.5901 9.0704 122.2585 59.6490 40.1237 174.8434 12 K 5.0075 8.9263 126.6773 55.0254 33.9811 176.0891 13 Q 4.5099 9.6951 123.5271 54.5576 30.2042 176.0913 14 G 3.9018 8.1812 105.4531 46.8423 0.0000 174.6907 15 R 4.3590 7.9960 121.2748 53.5688 29.4390 174.3535 16 K 3.9732 8.3465 125.6900 55.9530 32.5369 175.9373 17 L 4.7432 8.5705 125.4177 53.9596 43.6121 175.4705 18 D 4.6251 8.4173 118.6820 52.7280 40.9899 175.5216 19 I 4.2206 7.5187 126.6960 59.4149 40.4938 175.8995 20 D 4.6815 8.1173 125.2685 52.7186 39.7293 175.4803 21 F 4.2306 8.6521 123.5045 60.4952 39.6127 175.3061 22 G 4.2725 9.0131 104.1574 43.0001 0.0000 174.0014 23 A 3.9917 8.9244 122.9142 55.5480 18.1441 180.1411 24 E 4.0568 8.2539 115.9056 59.6131 29.6407 179.8243 25 G 3.6401 8.1362 105.2426 47.6802 0.0000 175.1676 26 N 4.6235 8.9030 119.2174 56.4257 38.5370 177.5654 27 R 3.9682 7.8810 118.8600 59.4270 30.2163 178.3986 28 Y 4.0085 8.2511 119.2002 60.8604 38.8393 177.3640 29 Y 3.5545 8.3297 120.3772 60.7501 38.6511 177.8663 30 A 3.9590 8.1136 119.9514 55.2240 18.4280 178.8746 31 A 4.3637 7.6092 117.8394 53.4917 19.3132 177.8557 32 N 4.7289 7.4503 112.5857 52.7070 40.2018 175.5729 33 Y 3.5602 7.6934 120.2169 59.5512 37.7676 178.7260 34 W 4.2490 7.2796 116.2165 59.4456 28.0172 177.2743 35 Q 3.5293 6.5868 117.1854 58.2378 28.1416 177.1295 36 F 4.1111 7.8040 115.2006 56.1310 39.5344 173.3701 37 P 4.3654 0.0000 0.0000 62.6124 31.3331 175.9622 38 D 4.6243 8.9255 124.1851 55.0481 40.4821 176.2323 39 G 4.4420 8.5258 105.0944 44.2310 0.0000 172.0127 40 I 5.1920 8.1349 119.4874 59.4779 41.0656 174.8749 41 Y 4.3185 9.2840 129.0602 58.2535 39.1101 173.5858 42 Y 4.5479 7.7659 126.3932 56.3786 41.9622 174.6158 43 E 4.2875 7.1387 124.6771 54.2515 30.0775 175.4841 44 G 3.5739 7.4238 110.3298 47.9180 0.0000 172.8230 45 C 4.5166 8.0170 117.8109 57.5536 40.3851 172.1387 46 S 4.5826 8.9944 118.4017 58.8970 65.3573 173.6635 47 E 3.8970 7.4339 117.9759 52.9188 32.3376 175.7450 48 A 4.2610 7.9864 122.7309 55.2727 18.5845 178.9348 49 N 4.3542 8.1248 112.4712 56.1460 38.7361 175.2457 50 V 3.7649 7.8974 118.2421 62.9532 31.3761 176.3515 51 T 4.1767 8.3435 118.7699 60.4075 71.2358 175.3196 52 K 3.6014 7.3811 120.8899 59.5541 32.1983 178.0277 53 E 3.9209 8.0345 118.2682 59.8660 29.2929 179.0110 54 M 4.0544 8.0282 118.2518 58.4450 32.0973 178.4598 55 L 4.1467 8.2679 120.1048 58.3920 42.4063 179.1165 56 V 3.6497 8.2453 118.3666 66.3233 31.4302 177.9393 57 T 3.8427 7.7600 114.8418 66.9571 68.3266 176.6922 58 S 4.0967 8.3153 117.0638 61.5967 62.7951 175.9459 59 C 2.6747 8.3575 121.4598 59.2463 43.5360 175.6856 60 V 3.6690 7.7272 119.6689 66.1804 31.0745 177.6690 61 N 4.2600 8.2717 115.8495 56.2390 38.3279 177.1824 62 A 4.0103 8.1533 122.4370 55.4477 18.3676 179.5890 63 T 4.1298 8.0827 115.9063 66.4516 68.3846 176.2886 64 Q 4.2466 8.0930 117.8963 59.4208 28.8939 178.7764 65 A 4.1735 8.0180 120.1360 55.4470 18.5396 179.2947 66 A 4.1525 8.2955 118.3289 54.0897 18.9107 177.7798 67 N 5.0116 7.8789 114.2241 51.3798 39.7566 177.0235 68 Q 4.1605 8.5467 118.3429 59.3129 28.9883 178.0395 69 A 4.0107 8.0284 120.9145 55.2986 18.2201 179.1462 70 E 3.8273 8.0673 116.3124 59.6410 29.5406 179.3887 71 F 4.4539 7.5633 117.1494 60.8036 38.9846 177.3314 72 S 4.1782 8.4436 112.6823 61.7766 61.9225 176.3677 73 R 4.0208 7.9781 119.2676 59.2721 30.1295 178.3342 74 E 4.0520 7.8975 118.8786 59.3966 29.1860 178.8512 75 K 3.9653 8.3799 119.2366 59.2070 31.9092 178.4131 76 Q 4.1324 7.5731 116.4725 58.3944 28.6380 176.7223 77 D 4.6736 7.3441 112.9154 55.3639 43.4796 176.2899 78 S 4.2205 8.1675 112.5272 58.0866 62.2939 171.4394 79 K 4.3894 7.6393 123.3189 57.0189 35.5896 177.4796 80 L 3.7359 7.7531 118.7706 58.3379 42.3667 178.5744 81 H 3.8680 7.8023 117.5583 59.5226 29.5426 176.4898 82 Q 3.9755 7.4946 119.0135 59.2481 28.4085 179.1098 83 R 4.0151 8.1053 118.7412 59.6334 30.0155 178.4913 84 V 3.6156 7.6478 117.2076 65.8848 31.5257 177.4587 85 L 4.2125 8.5066 120.4652 58.2849 41.7918 179.0010 86 W 4.2059 8.3392 118.9586 59.6810 28.9093 178.2714 87 R 4.0130 8.0122 118.5206 59.5033 29.4736 178.0201 88 L 3.9972 8.3942 119.9000 58.3922 42.0327 178.7275 89 I 3.7762 8.0930 119.8272 64.5719 37.1122 178.3109 90 K 3.9856 8.4932 119.2120 59.6666 31.9521 178.9655 91 E 3.9407 8.4706 118.8918 59.5966 29.2849 179.4769 92 I 3.7200 7.9226 119.5122 64.8131 37.0284 177.7750 93 C 4.3407 8.3501 116.0838 60.0953 40.0975 175.8920 94 S 4.2709 8.3997 113.8204 61.4609 62.0930 175.7395 95 A 4.1312 7.9340 122.3294 54.5115 19.2077 178.8498 96 K 4.2388 7.6205 117.0840 56.5170 31.4000 177.2704 97 H 4.1244 7.4403 113.9485 56.3335 29.8630 176.2698 98 C 3.6579 5.7800 119.1713 55.8661 40.6586 174.3669 99 D 4.1454 7.9973 123.5661 57.1557 40.9513 177.5446 100 F 4.4517 7.1803 112.1612 58.3858 38.2710 175.6105 101 W 4.7205 7.0833 121.1330 57.0720 29.2364 175.1389 102 L 4.9004 8.2654 121.2730 53.5224 43.2288 175.7790 103 E 4.0982 8.7056 119.3463 56.4521 29.3173 176.6395 104 R 4.6592 8.0684 119.2372 55.5374 32.7138 173.9303 105 G 3.9958 7.8376 103.9340 45.5819 0.0000 172.2895 106 A 4.7081 8.3931 120.8747 50.6807 22.4333 176.3224 107 A 4.2073 8.2683 121.3411 52.5445 19.3443 176.4037 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 R 8.25 4.22 0.00 1.79 1.90 0.00 3.21 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 2 V 8.31 3.43 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 0.70 0.00 0.00 0.93 0.00 0.00 3 A 8.26 4.24 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 E 8.44 4.02 0.00 2.08 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 2.27 2.30 0.00 5 N 8.40 4.62 0.00 2.54 2.57 0.00 0.00 6.36 5.62 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 6 R 7.49 4.30 0.00 2.12 2.09 0.00 3.06 0.00 0.00 3.38 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.71 0.00 7 P 0.00 4.59 0.00 2.22 2.10 0.00 3.78 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.20 0.00 8 G 9.66 4.10 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 0.00 9 A 8.45 4.10 1.47 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 0.00 0.00 0.00 0.00 0.00 0.00 10 F 8.74 4.88 0.00 2.94 2.83 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 11 I 9.07 4.59 1.99 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.24 0.99 0.00 0.00 12 K 8.93 5.01 0.00 1.64 1.76 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.50 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.43 1.46 7.81 13 Q 9.70 4.51 0.00 2.29 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.73 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 14 G 8.18 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 15 R 8.00 4.36 0.00 1.83 1.95 0.00 3.28 0.00 0.00 3.19 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 16 K 8.35 3.97 0.00 0.88 1.38 0.00 0.61 0.00 0.00 1.34 0.00 0.00 2.85 0.00 0.00 2.44 0.00 0.00 0.00 0.00 1.12 0.30 7.81 17 L 8.57 4.74 0.00 1.72 1.59 0.76 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 18 D 8.42 4.63 0.00 2.59 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.52 4.22 0.67 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.47 -0.15 0.00 0.00 20 D 8.12 4.68 0.00 2.53 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 21 F 8.65 4.23 0.00 3.23 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 22 G 9.01 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.92 3.99 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 24 E 8.25 4.06 0.00 2.06 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 2.44 2.41 0.00 25 G 8.14 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 0.00 0.00 0.00 26 N 8.90 4.62 0.00 2.97 3.02 0.00 0.00 7.09 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 27 R 7.88 3.97 0.00 2.08 2.06 0.00 3.18 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.80 0.00 28 Y 8.25 4.01 0.00 3.21 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 29 Y 8.33 3.55 0.00 2.45 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 30 A 8.11 3.96 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 31 A 7.61 4.36 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 N 7.45 4.73 0.00 2.06 2.12 0.00 0.00 5.97 7.20 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 33 Y 7.69 3.56 0.00 2.49 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 W 7.28 4.25 0.00 3.34 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 35 Q 6.59 3.53 0.00 1.21 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.68 6.50 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 36 F 7.80 4.11 0.00 3.20 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 37 P 0.00 4.37 0.00 2.30 1.46 0.00 3.70 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.22 0.00 38 D 8.93 4.62 0.00 2.77 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 39 G 8.53 4.44 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 0.00 40 I 8.13 5.19 2.01 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.86 1.15 0.00 0.00 41 Y 9.28 4.32 0.00 3.20 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 42 Y 7.77 4.55 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 43 E 7.14 4.29 0.00 1.59 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.79 0.00 44 G 7.42 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 C 8.02 4.52 0.00 2.86 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 46 S 8.99 4.58 0.00 3.88 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 47 E 7.43 3.90 0.00 1.87 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 2.16 2.20 0.00 48 A 7.99 4.26 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 N 8.12 4.35 0.00 2.83 2.92 0.00 0.00 7.27 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 50 V 7.90 3.76 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.07 0.00 0.00 51 T 8.34 4.18 4.06 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 0.00 0.00 1.18 0.00 0.00 52 K 7.38 3.60 0.00 0.79 1.40 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 3.37 0.00 0.00 0.00 0.00 1.43 1.57 7.81 53 E 8.03 3.92 0.00 2.00 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 2.35 2.33 0.00 54 M 8.03 4.05 0.00 2.17 2.46 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.60 0.00 55 L 8.27 4.15 0.00 2.19 2.16 1.02 1.01 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 56 V 8.25 3.65 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 1.00 0.00 0.00 1.14 0.00 0.00 57 T 7.76 3.84 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 58 S 8.32 4.10 0.00 4.13 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 59 C 8.36 2.67 0.00 2.72 3.20 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 60 V 7.73 3.67 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 1.02 0.00 0.00 1.08 0.00 0.00 61 N 8.27 4.26 0.00 2.95 2.83 0.00 0.00 7.17 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.15 4.01 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 63 T 8.08 4.13 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 64 Q 8.09 4.25 0.00 2.26 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.69 0.00 0.00 0.00 0.00 0.00 2.26 2.59 0.00 65 A 8.02 4.17 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 66 A 8.30 4.15 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 67 N 7.88 5.01 0.00 2.09 2.02 0.00 0.00 6.65 8.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 Q 8.55 4.16 0.00 2.14 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.90 0.00 0.00 0.00 0.00 0.00 2.55 2.80 0.00 69 A 8.03 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 70 E 8.07 3.83 0.00 1.94 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.44 0.00 71 F 7.56 4.45 0.00 3.33 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 72 S 8.44 4.18 0.00 4.04 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 73 R 7.98 4.02 0.00 1.90 2.00 0.00 3.24 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.76 0.00 74 E 7.90 4.05 0.00 2.06 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 2.18 2.35 0.00 75 K 8.38 3.97 0.00 2.09 1.91 0.00 1.82 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.56 7.81 76 Q 7.57 4.13 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.53 0.00 0.00 0.00 0.00 0.00 2.72 2.54 0.00 77 D 7.34 4.67 0.00 2.62 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 S 8.17 4.22 0.00 3.99 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 79 K 7.64 4.39 0.00 1.76 1.52 0.00 1.77 0.00 0.00 1.72 0.00 0.00 2.83 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.36 7.81 80 L 7.75 3.74 0.00 1.61 1.21 0.86 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 81 H 7.80 3.87 0.00 3.03 3.17 0.00 5.77 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 82 Q 7.49 3.98 0.00 2.43 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.77 0.00 0.00 0.00 0.00 0.00 2.44 2.64 0.00 83 R 8.11 4.02 0.00 1.96 2.13 0.00 3.32 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.85 0.00 84 V 7.65 3.62 2.40 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 -0.04 0.00 0.00 0.95 0.00 0.00 85 L 8.51 4.21 0.00 1.66 1.68 0.63 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 86 W 8.34 4.21 0.00 3.57 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 87 R 8.01 4.01 0.00 2.11 2.49 0.00 3.19 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.71 0.00 88 L 8.39 4.00 0.00 2.20 1.91 0.91 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.09 3.78 2.14 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.61 1.13 0.00 0.00 90 K 8.49 3.99 0.00 2.17 1.93 0.00 1.83 0.00 0.00 1.92 0.00 0.00 3.08 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.62 7.81 91 E 8.47 3.94 0.00 2.09 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 2.45 2.33 0.00 92 I 7.92 3.72 2.09 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.40 1.01 0.00 0.00 93 C 8.35 4.34 0.00 3.18 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 94 S 8.40 4.27 0.00 3.92 4.10 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 95 A 7.93 4.13 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 K 7.62 4.24 0.00 1.80 1.89 0.00 1.86 0.00 0.00 1.99 0.00 0.00 3.12 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.78 1.50 7.81 97 H 7.44 4.12 0.00 3.33 3.59 0.00 5.72 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 C 5.78 3.66 0.00 1.23 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 0.00 0.00 0.00 0.00 0.00 0.00 99 D 8.00 4.15 0.00 2.45 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 0.00 100 F 7.18 4.45 0.00 3.08 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 W 7.08 4.72 0.00 3.38 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 0.00 102 L 8.27 4.90 0.00 1.75 1.70 0.98 0.85 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 0.00 103 E 8.71 4.10 0.00 2.00 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 2.32 2.32 0.00 104 R 8.07 4.66 0.00 1.87 1.89 0.00 3.09 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.62 0.00 105 G 7.84 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 0.00 106 A 8.39 4.71 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 A 8.27 4.21 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00