NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.5124 8.4244 119.1969 53.4598 39.9772 177.2715 4 Q 3.9162 7.2895 112.9597 54.7313 30.3212 171.3825 5 Y 5.4728 9.1631 119.7503 55.3634 43.2899 173.2771 6 Y 5.0475 9.2036 121.9424 55.7757 42.3956 174.2068 7 G 3.4772 8.1235 114.1031 45.6056 0.0000 172.8394 8 T 3.7972 7.9407 117.5633 59.6072 68.3848 171.5047 9 G 4.0050 9.1350 114.4925 44.2096 0.0000 173.0114 10 R 4.8114 8.0096 117.1137 56.0647 31.6094 173.9213 11 R 4.2713 8.8273 113.5498 56.7370 32.7837 174.1677 12 K 3.7496 9.3223 118.3235 58.6682 29.3668 174.9059 13 S 3.6508 7.7463 108.0319 58.7969 62.8437 171.8480 14 S 4.9774 8.1182 115.1768 56.3058 64.1332 172.4693 15 A 4.9849 9.2561 130.3773 50.3117 20.6093 175.7681 16 A 4.6675 9.1964 125.4423 50.6004 20.7230 177.2746 17 R 4.6701 7.6063 115.4922 54.8585 30.1884 175.1657 18 V 3.8422 8.1021 121.4738 63.3863 33.8264 176.0926 19 F 6.1110 8.3712 122.3544 55.2354 41.3236 171.9608 20 I 4.1658 8.3644 122.7929 61.3821 38.5656 174.6824 21 K 4.6727 9.2012 128.8043 53.8775 35.2867 173.7062 22 P 4.6229 0.0000 0.0000 62.8765 29.4621 174.7812 23 G 3.5723 8.8007 110.7739 48.1860 0.0000 171.9680 24 N 4.1466 9.2877 130.0865 53.1844 39.2353 175.8019 25 G 5.4758 8.3976 113.4482 46.0056 0.0000 171.6803 26 K 4.3699 6.9419 120.4016 55.8561 35.3036 177.8210 27 I 4.8197 8.1618 121.5556 59.4505 38.4142 173.2970 28 V 5.2291 8.2768 125.1354 60.0814 34.1932 173.9920 29 I 5.0742 7.8517 127.2390 59.1931 41.1599 175.0904 30 N 4.0618 9.4335 120.6855 54.2253 36.1232 174.0552 31 Q 3.7549 8.1961 112.2426 57.2709 25.9516 173.6773 32 R 4.6469 7.9003 115.0790 53.4216 34.2715 175.3367 33 S 4.6246 8.3312 114.1318 58.4604 64.6764 173.3722 34 L 4.0154 8.7158 124.2698 58.9794 41.4504 178.3612 35 E 4.8306 8.0525 120.3195 59.3405 29.6596 178.2152 36 Q 4.0031 8.2455 117.0886 59.7479 28.6926 178.0060 37 Y 4.5933 8.2297 121.6036 59.6662 39.9397 176.7668 38 F 5.0871 8.2797 123.6176 55.6440 40.0334 174.4592 39 G 4.8623 8.3510 111.6647 43.7861 0.0000 170.4675 40 R 3.9657 8.7739 117.6061 56.5396 28.8915 175.4931 41 E 4.7118 7.5782 111.9986 53.2229 34.0223 176.3327 42 T 3.8455 8.5303 114.3196 65.0022 66.7237 175.5946 43 A 3.8176 7.8800 121.9099 54.6030 18.1533 179.1102 44 R 3.9910 7.9318 117.0869 58.8778 30.4076 178.3317 45 M 4.0051 8.0640 115.4364 58.8770 31.0810 178.6544 46 V 3.8693 7.6587 112.4713 64.3837 31.6716 178.9866 47 V 3.7169 7.2023 109.7036 63.4313 31.6048 177.6852 48 R 4.4284 7.7172 116.5212 56.1657 30.8249 177.9145 49 Q 4.0128 7.9305 119.4403 58.7762 28.6746 177.7062 50 P 4.0199 0.0000 0.0000 65.6061 31.2166 178.0187 51 L 4.1794 8.0003 118.1235 56.5791 41.3118 178.0120 52 E 4.4359 7.8755 117.1311 56.7725 29.4698 176.8418 53 L 4.8560 7.8081 117.3200 53.9798 43.8593 177.3923 54 V 4.3044 7.5128 108.9310 59.6458 33.8390 173.0634 55 D 4.8011 8.8623 124.8727 54.0390 41.5386 173.7213 56 M 4.3666 8.0736 117.8340 55.8689 33.1111 173.9015 57 V 4.0813 9.1732 120.8865 63.9040 31.1281 174.1014 58 E 4.8106 7.9502 113.5636 55.8144 30.1772 175.8570 59 K 4.5772 8.2738 118.5282 57.9124 35.0000 176.3920 60 L 4.5593 7.2093 116.8978 55.1827 43.1093 172.6568 61 D 5.3807 9.1813 119.3791 51.6754 42.4972 174.6082 62 L 5.8650 8.3247 119.2040 52.6930 45.6274 174.8950 63 Y 5.2882 8.5015 121.1361 56.0810 38.3982 174.7476 64 I 4.6763 8.0786 123.1593 60.0061 39.1564 175.9834 65 T 4.7323 7.3620 119.0379 62.5484 68.3541 174.3619 66 V 4.1209 7.3985 121.3948 62.0053 33.1668 177.3340 67 K 4.5606 9.4379 121.3357 56.2170 37.1652 176.7439 68 G 4.4737 8.4566 107.1638 46.7314 0.0000 174.7868 69 G 4.1679 8.0751 107.6379 44.9304 0.0000 172.2214 70 G 4.3831 7.9813 108.4055 44.5738 0.0000 172.5231 71 I 3.8970 7.7316 118.5888 63.6046 36.9946 177.6604 72 S 4.0674 8.0453 116.2327 61.6938 62.7886 177.2719 73 G 3.5372 7.9590 108.8260 47.8219 0.0000 175.5773 74 Q 4.2999 8.8026 122.4440 58.0310 28.8579 178.2810 75 A 4.4508 8.5193 121.9784 55.6887 18.1968 179.9563 76 G 3.5967 7.8928 102.1233 47.8416 0.0000 175.4245 77 A 4.1694 7.9928 122.9858 54.8520 18.4105 179.6402 78 I 3.5753 8.5620 119.0683 64.7555 37.2714 178.4465 79 R 3.7802 7.9748 119.2933 60.2545 29.5830 177.1968 80 H 4.2667 8.2587 118.4027 58.4979 29.8172 177.0055 81 G 3.6006 7.9856 106.4789 48.3584 0.0000 174.6268 82 I 3.5745 7.8084 121.9743 64.7009 36.9157 178.4020 83 T 3.7997 7.8563 113.8153 65.3467 67.4723 176.2085 84 R 3.9371 8.5905 120.8435 58.9652 30.0808 178.6792 85 A 4.0138 8.6831 120.8991 54.5640 18.2615 179.0513 86 L 3.3506 7.8595 119.4075 58.1572 42.0363 178.5726 87 M 4.9819 8.0100 117.5046 57.0639 30.7776 178.2136 88 E 3.8744 8.7677 121.4948 59.0366 29.3432 177.6073 89 Y 4.3717 6.9256 117.2333 56.9423 39.2688 174.4935 90 D 4.1912 7.0759 114.0747 54.5169 44.5201 175.7339 91 E 4.4661 8.9638 125.7779 57.0381 29.4081 177.5862 92 S 4.4850 8.0664 116.8173 60.1682 63.8777 176.0896 93 L 4.1894 7.5843 119.8797 57.4574 39.9311 178.9333 94 R 3.8578 7.5985 119.1799 59.7805 30.0459 178.0850 95 S 4.0639 8.1449 111.7921 61.9994 62.0560 176.3909 96 E 3.9706 8.0543 118.9442 59.1931 29.5543 178.9733 97 L 4.3731 8.4598 119.5251 57.9833 41.8174 179.4307 98 R 3.8811 8.6285 118.8532 59.3069 29.8146 178.2420 99 K 3.8937 7.9403 118.4235 58.2804 32.1351 176.5231 100 A 4.3594 7.2478 121.7179 51.9154 19.6017 176.4772 101 G 4.0045 7.8820 106.2741 48.1369 0.0000 172.6011 102 F 5.1569 7.7417 118.5228 59.7763 41.8463 178.5719 103 V 3.8591 8.0571 112.0150 64.2358 31.6189 177.3336 104 T 3.9467 7.2323 106.4139 61.5272 69.0061 173.7645 105 R 4.1949 8.2165 123.8562 54.2295 30.8910 175.1278 106 D 4.4042 8.5308 125.7068 54.6839 39.8765 175.9771 107 A 4.4169 8.0434 130.4148 51.1650 16.4344 176.6194 108 R 4.6650 7.3518 118.6896 54.1003 34.4723 174.5453 109 Q 4.4335 8.2142 120.0749 55.0457 31.8935 173.4854 110 V 3.5757 8.2620 118.8685 63.2353 31.7233 174.6827 111 E 4.2912 8.4956 126.2860 54.2293 29.8681 175.5379 112 R 3.7755 8.6960 123.4090 56.1261 29.2290 176.1913 113 K 3.8762 8.6401 124.5772 56.4903 32.3945 176.4202 114 K 4.3814 8.4437 125.9525 55.2352 33.2491 176.6571 115 V 3.7367 8.0320 121.4276 62.9530 32.0066 175.9045 116 G 4.0610 9.1114 111.4032 45.1290 0.0000 173.4034 117 L 4.6944 7.0505 118.0557 53.1199 43.6254 176.4768 118 R 4.2365 8.4382 120.5131 57.7719 31.1439 177.1861 119 K 4.4129 7.7853 118.6770 55.6833 32.2233 175.8766 120 A 3.9371 8.1155 118.2537 53.3938 17.6080 177.4648 121 R 4.7013 8.1558 112.2199 57.2906 37.7400 175.6628 122 R 3.8486 8.0673 119.9393 56.7233 30.0861 175.1059 123 R 4.6664 8.4162 125.2790 53.8706 31.2624 174.7859 124 P 4.3237 0.0000 0.0000 62.4691 31.6858 176.1560 125 Q 3.9445 8.7167 121.4182 56.2941 28.9935 175.8049 126 F 4.5705 7.9714 116.6425 56.5052 38.9392 178.3193 127 S 3.0123 6.4052 111.5528 58.7973 64.7179 171.1523 128 K 3.8515 7.9551 126.4648 56.2129 32.4660 177.2474 129 R 4.2971 8.4483 124.3706 56.4548 30.9234 175.4353 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 3 N 8.42 4.51 0.00 2.66 1.82 0.00 0.00 6.92 6.19 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 4 Q 7.29 3.92 0.00 1.93 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.55 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 5 Y 9.16 5.47 0.00 3.12 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 6 Y 9.20 5.05 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 7 G 8.12 3.48 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 0.00 8 T 7.94 3.80 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 1.35 0.00 0.00 9 G 9.14 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 10 R 8.01 4.81 0.00 2.01 1.86 0.00 3.08 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.48 0.00 11 R 8.83 4.27 0.00 1.91 1.96 0.00 2.90 0.00 0.00 3.16 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.50 0.00 12 K 9.32 3.75 0.00 1.90 1.87 0.00 1.89 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.45 1.40 7.81 13 S 7.75 3.65 0.00 4.13 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 14 S 8.12 4.98 0.00 4.07 3.99 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 15 A 9.26 4.98 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 16 A 9.20 4.67 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 17 R 7.61 4.67 0.00 1.69 1.80 0.00 3.47 0.00 0.00 3.31 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 18 V 8.10 3.84 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 0.88 0.00 0.00 0.80 0.00 0.00 19 F 8.37 6.11 0.00 3.34 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 20 I 8.36 4.17 2.21 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 1.25 0.44 1.06 0.00 0.00 21 K 9.20 4.67 0.00 1.75 1.79 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.22 1.42 7.81 22 P 0.00 4.62 0.00 2.08 1.91 0.00 3.71 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.94 0.00 23 G 8.80 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 24 N 9.29 4.15 0.00 2.87 2.44 0.00 0.00 6.88 7.91 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 25 G 8.40 5.48 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 0.00 26 K 6.94 4.37 0.00 1.75 1.75 0.00 1.60 0.00 0.00 1.95 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.46 7.81 27 I 8.16 4.82 1.90 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 1.25 0.62 0.94 0.00 0.00 28 V 8.28 5.23 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 1.20 0.00 0.00 0.98 0.00 0.00 29 I 7.85 5.07 1.62 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.02 0.71 0.00 0.00 30 N 9.43 4.06 0.00 2.10 2.46 0.00 0.00 7.06 7.69 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 31 Q 8.20 3.75 0.00 2.17 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.79 6.79 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 32 R 7.90 4.65 0.00 1.74 1.76 0.00 3.17 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.31 0.00 33 S 8.33 4.62 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 34 L 8.72 4.02 0.00 1.94 1.56 0.99 0.91 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 35 E 8.05 4.83 0.00 2.13 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 0.00 2.43 2.36 0.00 36 Q 8.25 4.00 0.00 2.10 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 7.06 0.00 0.00 0.00 0.00 0.00 2.41 2.54 0.00 37 Y 8.23 4.59 0.00 2.73 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 38 F 8.28 5.09 0.00 3.13 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 39 G 8.35 4.86 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 0.00 0.00 0.00 0.00 0.00 0.00 40 R 8.77 3.97 0.00 1.92 1.96 0.00 3.22 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 41 E 7.58 4.71 0.00 2.04 1.64 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 2.16 2.28 0.00 42 T 8.53 3.85 4.19 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 1.11 0.00 0.00 43 A 7.88 3.82 0.60 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 0.00 0.00 44 R 7.93 3.99 0.00 1.90 2.01 0.00 3.25 0.00 0.00 3.33 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.88 0.00 45 M 8.06 4.01 0.00 2.16 2.23 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.76 0.00 46 V 7.66 3.87 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 0.77 0.00 0.00 1.00 0.00 0.00 47 V 7.20 3.72 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 1.05 0.00 0.00 1.08 0.00 0.00 48 R 7.72 4.43 0.00 2.03 2.08 0.00 3.17 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.91 0.00 49 Q 7.93 4.01 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.52 0.00 50 P 0.00 4.02 0.00 2.08 1.83 0.00 3.49 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.86 0.00 51 L 8.00 4.18 0.00 1.89 1.75 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 52 E 7.88 4.44 0.00 2.09 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 2.51 2.52 0.00 53 L 7.81 4.86 0.00 1.73 1.71 0.99 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.51 4.30 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 0.80 0.00 0.00 0.98 0.00 0.00 55 D 8.86 4.80 0.00 2.85 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 56 M 8.07 4.37 0.00 2.05 2.17 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 2.48 2.59 0.00 57 V 9.17 4.08 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 0.95 0.00 0.00 0.94 0.00 0.00 58 E 7.95 4.81 0.00 2.07 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 2.17 2.24 0.00 59 K 8.27 4.58 0.00 1.70 1.84 0.00 1.78 0.00 0.00 1.78 0.00 0.00 2.93 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.59 1.54 7.81 60 L 7.21 4.56 0.00 1.74 1.58 0.74 0.60 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 61 D 9.18 5.38 0.00 2.80 2.91 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 62 L 8.32 5.86 0.00 1.57 1.67 0.98 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 8.50 5.29 0.00 2.88 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 64 I 8.08 4.68 1.76 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 1.19 0.63 0.83 0.00 0.00 65 T 7.36 4.73 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 1.08 0.00 0.00 66 V 7.40 4.12 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 0.69 0.00 0.00 1.00 0.00 0.00 67 K 9.44 4.56 0.00 1.63 1.68 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.33 1.35 7.81 68 G 8.46 4.47 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 0.00 69 G 8.08 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 0.00 0.00 0.00 0.00 70 G 7.98 4.38 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 0.00 71 I 7.73 3.90 1.75 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 1.60 0.42 0.47 0.00 0.00 72 S 8.05 4.07 0.00 3.98 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 G 7.96 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 74 Q 8.80 4.30 0.00 2.70 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.67 0.00 0.00 0.00 0.00 0.00 2.50 2.55 0.00 75 A 8.52 4.45 1.17 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 0.00 0.00 76 G 7.89 3.60 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 0.00 0.00 0.00 77 A 7.99 4.17 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 78 I 8.56 3.58 2.09 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 1.41 0.82 0.91 0.00 0.00 79 R 7.97 3.78 0.00 1.85 1.89 0.00 2.88 0.00 0.00 3.07 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.80 0.00 80 H 8.26 4.27 0.00 3.28 3.32 0.00 5.86 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 81 G 7.99 3.60 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 0.00 0.00 0.00 82 I 7.81 3.57 1.92 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 1.35 0.70 0.84 0.00 0.00 83 T 7.86 3.80 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 1.19 0.00 0.00 84 R 8.59 3.94 0.00 1.90 1.79 0.00 3.08 0.00 0.00 2.92 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.25 0.00 85 A 8.68 4.01 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 86 L 7.86 3.35 0.00 1.98 1.75 0.94 0.88 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 87 M 8.01 4.98 0.00 2.38 2.28 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.62 0.00 88 E 8.77 3.87 0.00 1.39 1.70 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 2.35 2.42 0.00 89 Y 6.93 4.37 0.00 2.43 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 90 D 7.08 4.19 0.00 2.58 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 91 E 8.96 4.47 0.00 1.97 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.26 0.00 92 S 8.07 4.49 0.00 4.18 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 93 L 7.58 4.19 0.00 2.09 1.95 0.98 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 94 R 7.60 3.86 0.00 1.87 2.04 0.00 3.33 0.00 0.00 3.11 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.00 95 S 8.14 4.06 0.00 3.87 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 96 E 8.05 3.97 0.00 2.01 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 2.37 2.36 0.00 97 L 8.46 4.37 0.00 1.90 2.00 1.01 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 98 R 8.63 3.88 0.00 1.83 1.91 0.00 3.11 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 99 K 7.94 3.89 0.00 1.93 1.94 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.37 1.42 7.81 100 A 7.25 4.36 0.49 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 0.00 101 G 7.88 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 0.00 102 F 7.74 5.16 0.00 3.04 2.91 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 0.00 103 V 8.06 3.86 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 0.77 0.00 0.00 0.96 0.00 0.00 104 T 7.23 3.95 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 1.23 0.00 0.00 105 R 8.22 4.19 0.00 1.77 1.85 0.00 3.37 0.00 0.00 3.07 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.46 0.00 106 D 8.53 4.40 0.00 2.67 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 0.00 107 A 8.04 4.42 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 0.00 108 R 7.35 4.66 0.00 1.74 1.78 0.00 3.25 0.00 0.00 3.15 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 109 Q 8.21 4.43 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.23 2.26 0.00 110 V 8.26 3.58 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 0.82 0.00 0.00 0.93 0.00 0.00 111 E 8.50 4.29 0.00 1.94 1.85 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 2.24 2.34 0.00 112 R 8.70 3.78 0.00 1.95 1.99 0.00 3.10 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 113 K 8.64 3.88 0.00 1.74 1.79 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.48 7.81 114 K 8.44 4.38 0.00 1.91 1.70 0.00 1.77 0.00 0.00 1.93 0.00 0.00 3.15 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.51 1.48 7.81 115 V 8.03 3.74 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 0.00 116 G 9.11 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 0.00 0.00 0.00 0.00 117 L 7.05 4.69 0.00 1.62 1.60 0.96 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.44 4.24 0.00 1.78 1.95 0.00 3.28 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 119 K 7.79 4.41 0.00 1.78 1.64 0.00 1.92 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.44 7.81 120 A 8.12 3.94 1.41 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 0.00 0.00 0.00 121 R 8.16 4.70 0.00 1.78 1.92 0.00 3.35 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.71 0.00 122 R 8.07 3.85 0.00 1.84 1.85 0.00 3.16 0.00 0.00 3.34 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 123 R 8.42 4.67 0.00 1.90 1.94 0.00 3.30 0.00 0.00 3.31 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 124 P 0.00 4.32 0.00 2.22 2.10 0.00 3.82 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 2.06 2.00 0.00 125 Q 8.72 3.94 0.00 2.01 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.91 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 126 F 7.97 4.57 0.00 3.15 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 0.00 127 S 6.41 3.01 0.00 4.00 3.71 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 0.00 128 K 7.96 3.85 0.00 1.74 1.86 0.00 1.62 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.58 7.81 129 R 8.45 4.30 0.00 1.86 1.81 0.00 3.47 0.00 0.00 3.94 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.04 0.00