NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0124 8.2133 108.0319 46.1929 0.0000 171.6138 2 I 4.3656 8.2362 120.6204 60.1804 37.4356 174.4370 3 Y 4.2138 9.3268 129.5774 59.8986 39.8448 175.0952 4 G 4.1600 7.7387 103.1053 46.1752 0.0000 172.0976 5 I 5.2494 7.8512 113.0277 59.1355 41.6332 174.3325 6 G 4.2967 8.8899 109.1252 44.8868 0.0000 171.4957 7 L 5.4002 8.4099 124.0145 53.1745 45.5176 175.0171 8 D 4.8745 9.1196 124.0714 52.9068 45.1911 173.7310 9 I 5.0563 8.4831 125.0731 59.8521 40.5220 174.8412 10 T 4.8080 9.3918 123.0448 61.5710 72.5159 173.0127 11 E 4.4259 8.8969 126.9497 55.4908 30.4685 176.8955 12 L 3.9382 8.5758 127.4775 58.0714 41.6404 179.6030 13 K 3.8307 7.8136 118.7961 59.3921 32.1224 178.7037 14 R 3.7846 7.7269 118.7908 59.2380 29.8894 178.6062 15 I 3.3204 7.4987 118.9715 64.1457 37.2391 178.0173 16 A 3.9104 8.0218 121.6931 55.1537 18.1695 179.8802 17 S 3.9329 8.0741 113.6094 62.0622 62.9563 176.7971 18 M 3.7360 7.7495 121.0113 58.2860 31.3470 178.7877 19 A 3.9589 7.5760 120.1193 54.7625 18.5465 179.4766 20 G 3.6743 7.6591 103.6718 46.8768 0.0000 175.4854 21 R 4.3487 7.7409 116.7237 55.8792 30.4078 176.4077 22 Q 4.5408 7.4616 118.8310 53.6347 30.0784 174.7672 23 K 3.8612 8.6847 124.8275 59.4506 32.5562 177.4020 24 R 4.9396 7.4787 114.7635 54.3645 30.7854 177.1429 25 F 3.9789 8.2482 123.1476 61.4298 39.8945 175.5924 26 A 3.5674 8.0654 119.8189 55.2174 18.2698 179.3096 27 E 3.8299 7.7004 116.5735 59.3571 29.2059 179.6426 28 R 3.9459 7.3619 118.0095 59.2085 30.1903 178.1404 29 I 3.3736 7.0180 118.0748 61.9617 37.7374 176.0247 30 L 4.7524 7.1226 118.6931 53.1704 43.4336 177.0377 31 T 4.3058 8.7035 113.5454 60.6698 71.3906 176.1621 32 R 3.9427 8.4371 119.4971 59.6499 29.9171 179.4396 33 S 4.3417 8.0163 113.3202 61.5526 62.9542 176.1861 34 E 4.1634 8.0031 121.8958 59.2009 29.1943 179.2905 35 L 4.0328 8.4041 119.5105 57.7440 41.4237 179.1436 36 D 4.4667 8.0321 118.1758 57.5523 41.1242 178.7021 37 Q 3.9915 7.8847 118.1351 58.9987 28.7941 177.9459 38 Y 3.4893 7.9051 121.2076 60.8120 38.7799 177.3270 39 Y 4.3071 7.8605 113.7792 59.1152 37.9235 175.9265 40 E 4.3714 7.6904 118.3894 56.2093 30.2756 176.0553 41 L 4.3830 7.0000 118.9030 53.0957 43.2917 176.8776 42 S 4.3702 8.0325 115.6459 57.7779 65.0708 174.7646 43 E 3.8411 8.5433 121.9981 59.3310 29.2761 178.6989 44 K 3.9591 7.9005 119.1011 59.6064 32.3743 178.9469 45 R 3.9870 7.9388 118.2856 58.9620 29.8605 179.1782 46 K 3.8532 8.3301 118.8982 59.4132 31.9373 178.7680 47 N 4.4025 7.9228 117.2471 56.7560 38.8918 176.6990 48 E 3.9976 8.0704 119.4479 59.3587 29.6060 179.0252 49 F 4.1383 8.6926 120.9987 61.3193 39.4471 176.8284 50 L 3.8986 8.7561 120.0663 58.2156 41.8616 178.7676 51 A 4.1657 8.4839 121.1193 55.1205 18.2554 179.8949 52 G 3.5390 8.3077 104.3027 48.0278 0.0000 176.2878 53 R 3.7858 7.9065 120.5875 58.5898 29.9215 178.8396 54 F 3.9236 8.5762 120.7280 61.2949 39.3603 177.0399 55 A 4.5448 8.8739 121.8656 54.7624 18.1613 179.5006 56 A 3.9573 8.2338 119.3455 55.2056 18.3469 180.0674 57 K 4.0016 8.2804 117.1811 59.3766 32.2410 179.5266 58 E 3.8133 8.3746 118.9929 59.3104 29.3823 179.1999 59 A 4.0150 8.2651 121.0403 55.1134 18.3873 179.4435 60 F 3.9845 8.4904 119.5138 61.4192 39.5509 177.5574 61 S 4.2462 8.4946 113.9500 61.1903 62.5330 176.6259 62 K 4.0088 7.9193 121.9218 59.0920 31.6342 179.1314 63 A 4.2445 7.7884 122.5511 54.4518 18.0440 179.4623 64 F 4.1023 8.1087 118.9835 59.5703 39.4753 176.2949 65 G 3.9321 8.0153 105.9786 45.1530 0.0000 173.6155 66 T 4.3203 7.7007 107.8383 60.0897 70.8036 175.1107 67 G 4.1193 8.2884 109.8567 45.3320 0.0000 172.5275 68 I 3.9743 7.8886 119.5897 60.5919 38.2203 176.4199 69 G 4.0374 8.5343 114.7151 46.3781 0.0000 174.8124 70 R 4.0041 8.8548 119.3602 58.5717 30.4533 177.5669 71 Q 4.3068 7.9667 115.6296 57.2282 29.5686 175.8188 72 L 4.3480 7.7270 119.6477 53.6274 45.5486 174.2748 73 S 4.8711 8.7567 120.1156 55.9579 65.1307 174.6844 74 F 4.1040 8.3729 122.6993 60.7906 38.7398 177.6724 75 Q 4.1691 8.1217 117.8058 57.8744 28.4020 176.6365 76 D 4.5052 8.0467 117.4527 54.8526 41.3617 175.4812 77 I 4.5236 7.3673 120.5451 59.1123 39.5812 174.6469 78 E 4.6675 8.7096 127.5698 54.3244 32.6702 174.2698 79 I 4.5647 8.9364 128.3328 60.1709 38.6341 175.1280 80 R 4.7339 8.3123 127.0819 54.0628 34.0738 174.2981 81 K 5.7319 8.5166 117.6052 54.2465 35.7716 177.6554 82 D 4.8520 8.8359 124.4286 53.1987 40.6160 176.3645 83 Q 4.2212 8.6681 116.7156 58.2468 28.7323 176.4632 84 N 4.6573 8.4322 113.9470 52.7993 39.5043 175.7475 85 G 3.9577 8.2479 106.7858 44.9631 0.0000 173.4490 86 K 4.4233 8.9872 122.2776 55.1934 33.5250 174.2187 87 P 5.7395 0.0000 0.0000 62.3263 32.3630 174.8887 88 Y 5.0158 8.2124 119.8871 55.6680 41.8111 173.4847 89 I 4.8249 8.4801 120.7433 59.7726 39.9375 175.1537 90 I 4.5396 8.2887 125.6800 59.6515 40.8798 174.1425 91 C 4.8738 8.3611 126.2757 56.6620 33.7069 174.2114 92 T 3.8632 8.7280 122.1109 65.0717 67.1226 175.3435 93 K 4.0922 7.9611 118.8099 57.9118 32.2460 176.1875 94 L 4.6334 7.5536 121.7991 53.3773 42.9685 176.2646 95 S 4.2890 8.4919 120.4517 56.8375 63.0953 171.4769 96 P 4.0461 0.0000 0.0000 63.6127 30.8624 175.0246 97 A 4.5375 8.1198 121.8030 51.3200 22.3369 174.5753 98 A 4.6426 8.3129 120.9206 50.3917 21.0486 176.3503 99 V 4.8852 8.3814 122.2387 61.3893 34.2645 174.4472 100 H 5.2756 9.2571 123.8680 54.1117 32.4653 172.9332 101 V 5.1603 8.3751 119.9469 60.5612 34.9645 174.2294 102 S 4.7326 8.8532 115.3932 57.0298 66.0189 172.6866 103 I 5.1216 8.4392 126.4618 59.9204 40.2599 174.4849 104 T 4.8254 9.0156 119.3206 61.0944 71.3608 171.9990 105 H 5.6007 8.7094 120.6650 54.6486 33.2251 172.5664 106 T 4.7656 8.7444 110.1594 59.7079 71.9910 173.6168 107 K 4.0283 8.9072 121.3871 59.1781 32.2124 177.1509 108 E 4.3887 8.1409 115.2175 56.1498 30.9133 174.5009 109 Y 5.4024 7.9882 115.7915 56.0571 42.8742 174.0659 110 A 5.2530 9.1331 122.0394 50.3880 22.5818 175.1440 111 A 5.2244 9.0973 121.5225 50.8438 23.4528 174.8879 112 A 5.1927 8.8997 119.7548 51.0070 23.4451 175.4945 113 Q 5.0781 8.9855 116.7820 54.6451 32.7367 174.2520 114 V 5.0139 8.9949 119.7554 61.3792 35.8029 174.0923 115 V 4.8776 8.8374 125.5424 61.2151 34.8329 173.9489 116 I 4.9519 8.7777 128.4735 59.6723 39.9611 174.2088 117 E 5.0982 9.2934 129.4195 54.8000 32.0032 177.1053 118 R 4.1880 8.6496 123.7033 57.2564 29.0584 173.9256 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 G 8.21 4.01 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 0.00 0.00 0.00 2 I 8.24 4.37 1.87 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 1.26 0.74 0.94 0.00 0.00 3 Y 9.33 4.21 0.00 2.90 3.11 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 0.00 4 G 7.74 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 I 7.85 5.25 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.19 0.90 0.00 0.00 6 G 8.89 4.30 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 0.00 0.00 0.00 7 L 8.41 5.40 0.00 1.59 1.49 0.98 1.10 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 8 D 9.12 4.87 0.00 2.75 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 9 I 8.48 5.06 1.87 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.78 0.84 0.00 0.00 10 T 9.39 4.81 4.41 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 1.21 0.00 0.00 11 E 8.90 4.43 0.00 2.15 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 0.00 2.30 2.02 0.00 12 L 8.58 3.94 0.00 1.82 1.64 0.92 0.59 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 13 K 7.81 3.83 0.00 1.71 1.70 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.43 7.81 14 R 7.73 3.78 0.00 2.07 1.98 0.00 3.15 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 15 I 7.50 3.32 1.93 0.00 0.00 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 1.49 0.68 0.93 0.00 0.00 16 A 8.02 3.91 1.30 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 0.00 0.00 17 S 8.07 3.93 0.00 3.90 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 18 M 7.75 3.74 0.00 1.13 1.29 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.35 0.00 19 A 7.58 3.96 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 20 G 7.66 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 R 7.74 4.35 0.00 1.96 2.01 0.00 2.99 0.00 0.00 3.12 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 22 Q 7.46 4.54 0.00 2.21 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.89 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 23 K 8.68 3.86 0.00 1.74 1.88 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.54 7.81 24 R 7.48 4.94 0.00 1.92 1.87 0.00 3.49 0.00 0.00 3.25 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.57 0.00 25 F 8.25 3.98 0.00 3.02 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 26 A 8.07 3.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 E 7.70 3.83 0.00 2.18 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 2.39 2.44 0.00 28 R 7.36 3.95 0.00 1.77 1.88 0.00 3.34 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 29 I 7.02 3.37 1.34 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 -0.12 0.42 0.00 0.00 30 L 7.12 4.75 0.00 1.45 1.51 0.59 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 31 T 8.70 4.31 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 1.15 0.00 0.00 32 R 8.44 3.94 0.00 1.88 2.04 0.00 3.13 0.00 0.00 3.40 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.70 0.00 33 S 8.02 4.34 0.00 4.05 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 34 E 8.00 4.16 0.00 2.29 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 2.38 2.36 0.00 35 L 8.40 4.03 0.00 1.91 1.91 1.01 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 36 D 8.03 4.47 0.00 2.89 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 37 Q 7.88 3.99 0.00 2.04 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.77 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 38 Y 7.91 3.49 0.00 2.79 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 39 Y 7.86 4.31 0.00 3.10 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 40 E 7.69 4.37 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 2.25 2.36 0.00 41 L 7.00 4.38 0.00 1.43 1.43 0.61 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 42 S 8.03 4.37 0.00 4.00 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 43 E 8.54 3.84 0.00 2.02 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 2.36 2.36 0.00 44 K 7.90 3.96 0.00 1.84 1.76 0.00 1.76 0.00 0.00 1.81 0.00 0.00 3.15 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.63 1.51 7.81 45 R 7.94 3.99 0.00 2.05 1.92 0.00 3.34 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.78 0.00 46 K 8.33 3.85 0.00 1.84 1.64 0.00 1.41 0.00 0.00 0.85 0.00 0.00 2.47 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.58 1.41 7.81 47 N 7.92 4.40 0.00 2.83 2.99 0.00 0.00 7.28 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 48 E 8.07 4.00 0.00 2.25 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 2.34 2.55 0.00 49 F 8.69 4.14 0.00 3.22 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 50 L 8.76 3.90 0.00 1.99 2.04 0.67 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.48 4.17 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 52 G 8.31 3.54 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 0.00 53 R 7.91 3.79 0.00 1.70 1.78 0.00 2.80 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.39 0.00 54 F 8.58 3.92 0.00 3.08 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 55 A 8.87 4.54 1.48 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 0.00 0.00 56 A 8.23 3.96 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 57 K 8.28 4.00 0.00 1.90 1.94 0.00 1.76 0.00 0.00 1.87 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.68 7.81 58 E 8.37 3.81 0.00 2.06 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 1.86 2.19 0.00 59 A 8.27 4.01 1.48 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 0.00 0.00 60 F 8.49 3.98 0.00 3.27 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 61 S 8.49 4.25 0.00 4.07 4.16 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 0.00 0.00 0.00 0.00 62 K 7.92 4.01 0.00 2.02 1.86 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.56 7.81 63 A 7.79 4.24 1.26 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 0.00 0.00 64 F 8.11 4.10 0.00 2.59 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 65 G 8.02 3.93 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 0.00 0.00 0.00 66 T 7.70 4.32 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 1.38 0.00 0.00 67 G 8.29 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 0.00 0.00 0.00 68 I 7.89 3.97 1.51 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 -0.25 0.22 0.00 0.00 69 G 8.53 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 0.00 0.00 0.00 70 R 8.85 4.00 0.00 1.82 2.01 0.00 3.37 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 71 Q 7.97 4.31 0.00 2.14 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.64 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 72 L 7.73 4.35 0.00 1.47 1.51 0.44 0.49 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 73 S 8.76 4.87 0.00 3.80 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 74 F 8.37 4.10 0.00 3.07 3.11 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 0.00 75 Q 8.12 4.17 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.89 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 76 D 8.05 4.51 0.00 2.70 2.54 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 77 I 7.37 4.52 1.69 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.36 0.37 0.00 0.00 78 E 8.71 4.67 0.00 1.90 1.60 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 2.04 2.15 0.00 79 I 8.94 4.56 1.83 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 1.10 0.58 0.80 0.00 0.00 80 R 8.31 4.73 0.00 0.67 1.58 0.00 2.86 0.00 0.00 3.10 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.22 0.00 81 K 8.52 5.73 0.00 1.62 1.63 0.00 1.86 0.00 0.00 2.61 0.00 0.00 3.04 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.37 1.28 7.81 82 D 8.84 4.85 0.00 2.91 2.81 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 0.00 0.00 0.00 83 Q 8.67 4.22 0.00 2.08 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.86 0.00 0.00 0.00 0.00 0.00 2.38 2.33 0.00 84 N 8.43 4.66 0.00 2.89 2.87 0.00 0.00 7.11 7.65 0.00 0.00 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 G 8.25 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 86 K 8.99 4.42 0.00 1.91 2.13 0.00 1.57 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.49 1.51 7.81 87 P 0.00 5.74 0.00 2.13 2.06 0.00 3.45 0.00 0.00 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.84 0.00 88 Y 8.21 5.02 0.00 3.03 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 89 I 8.48 4.82 1.88 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.61 0.42 0.00 0.00 90 I 8.29 4.54 1.76 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 1.27 1.05 0.89 0.00 0.00 91 C 8.36 4.87 0.00 2.28 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.73 3.86 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 1.17 0.00 0.00 93 K 7.96 4.09 0.00 1.67 1.91 0.00 1.81 0.00 0.00 1.61 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.27 7.81 94 L 7.55 4.63 0.00 1.92 1.73 1.23 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 95 S 8.49 4.29 0.00 3.81 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 96 P 0.00 4.05 0.00 2.20 2.10 0.00 3.83 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 97 A 8.12 4.54 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 98 A 8.31 4.64 1.26 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 0.00 0.00 99 V 8.38 4.89 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 1.12 0.00 0.00 1.13 0.00 0.00 100 H 9.26 5.28 0.00 3.13 3.17 0.00 5.63 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 V 8.38 5.16 2.17 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 0.74 0.00 0.00 1.04 0.00 0.00 102 S 8.85 4.73 0.00 3.94 3.70 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 0.00 103 I 8.44 5.12 1.88 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 1.22 0.80 0.90 0.00 0.00 104 T 9.02 4.83 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 1.28 0.00 0.00 105 H 8.71 5.60 0.00 3.05 3.16 0.00 5.70 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 T 8.74 4.77 4.35 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 1.30 0.00 0.00 107 K 8.91 4.03 0.00 1.75 1.90 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.47 7.81 108 E 8.14 4.39 0.00 1.57 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 2.18 2.23 0.00 109 Y 7.99 5.40 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 0.00 110 A 9.13 5.25 1.26 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 0.00 0.00 111 A 9.10 5.22 1.20 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 0.00 0.00 112 A 8.90 5.19 1.20 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 0.00 0.00 113 Q 8.99 5.08 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.70 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 114 V 8.99 5.01 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 1.09 0.00 0.00 1.10 0.00 0.00 115 V 8.84 4.88 2.17 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 1.05 0.00 0.00 0.96 0.00 0.00 116 I 8.78 4.95 2.02 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.59 0.95 0.00 0.00 117 E 9.29 5.10 0.00 1.92 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 0.00 2.30 2.36 0.00 118 R 8.65 4.19 0.00 1.60 1.71 0.00 3.30 0.00 0.00 3.26 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.47 0.00