NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.6757 8.1076 122.5024 52.3056 20.6726 175.0163 3 F 5.5208 8.0484 112.7781 55.4736 41.2159 171.9789 4 Q 4.6552 10.2015 119.6647 54.1817 32.5677 175.5368 5 L 5.1505 8.7182 123.5679 53.0093 44.0969 175.6038 6 E 4.5414 9.0315 124.3492 54.5957 33.0661 174.3190 7 M 4.5784 8.7360 127.3546 55.2447 32.1901 176.3920 8 V 3.7521 8.4632 125.3883 64.9633 31.9961 175.4845 9 T 4.7574 7.3202 107.4929 59.2670 71.7902 174.4610 10 R 3.9672 8.6092 119.7121 58.2308 30.1854 177.4490 11 E 4.7879 8.0114 112.9192 54.9238 31.3036 174.9631 12 T 5.1285 7.6655 117.7487 61.6936 71.7918 173.1687 13 V 4.8117 8.5474 126.0337 59.7827 34.5047 174.6296 14 V 4.4985 8.8393 124.1721 61.5478 33.5640 174.4515 15 I 4.6913 8.3394 128.9493 59.7764 39.2727 174.5581 16 R 4.7773 9.0450 127.8231 54.7832 31.6570 175.8000 17 L 5.3447 8.0975 123.8847 53.0181 44.3259 176.1013 18 F 4.8198 9.0008 120.9719 56.5417 42.5359 174.5346 19 G 4.0855 9.8160 115.1029 46.3073 0.0000 176.0774 20 E 5.0854 8.9817 117.6144 54.1951 33.4523 174.3665 21 L 4.5650 8.5495 121.6345 53.9188 43.1458 176.7037 22 D 5.0152 8.3122 122.8327 51.7580 43.3342 176.8825 23 H 4.2370 8.5654 114.3902 59.1093 28.2918 177.2758 24 H 4.1897 7.8725 118.3500 58.6591 28.6623 177.4371 25 A 4.1560 8.4574 122.6818 55.0560 18.1824 179.7639 26 V 3.5112 7.9355 116.8513 66.2355 31.5109 177.9571 27 E 3.9482 8.3607 118.9857 59.2850 29.4287 178.7489 28 Q 4.0170 8.2470 118.2050 58.9289 28.7146 178.8676 29 I 3.4583 7.5701 120.7565 64.2023 37.1143 178.3720 30 R 3.8689 8.1476 119.4247 59.3422 30.0028 178.3195 31 A 3.9988 8.2247 120.6201 55.2992 18.4655 179.8459 32 K 3.9676 8.1860 117.0004 59.6510 32.1450 179.8028 33 I 3.7577 7.9816 120.4585 63.9901 37.0211 178.3994 34 S 4.1085 8.1909 115.2686 61.8769 62.6210 176.8382 35 T 3.9096 7.8754 118.5581 66.3357 68.3495 176.4200 36 A 4.0323 7.9840 122.6226 55.1492 18.0572 179.9101 37 I 3.6849 7.4311 117.4552 64.6626 37.3205 178.3834 38 F 4.7339 7.9076 117.2070 59.3258 39.3380 175.5890 39 Q 4.7093 8.5301 119.8202 54.5556 29.6354 173.9696 40 G 3.9775 7.4838 106.0486 45.6568 0.0000 174.0788 41 A 4.6151 8.3201 126.4362 51.4339 20.4131 175.9410 42 V 4.0035 7.6817 118.4832 64.4300 31.8529 175.8428 43 T 4.6839 9.1389 115.5697 61.4080 70.8851 173.4241 44 T 5.1729 7.6726 119.1313 62.2900 73.2109 172.4595 45 I 4.6232 8.6780 126.9678 59.4799 40.2097 174.6251 46 I 4.6860 8.3467 128.6095 59.4786 38.8788 175.0669 47 W 4.5978 9.1552 129.3314 55.6586 30.3208 175.7641 48 N 4.8241 9.0680 126.3260 52.2826 39.0516 174.9951 49 F 4.5864 9.1356 125.2477 57.2108 39.5911 177.5611 50 E 4.0923 8.3170 122.9089 58.6601 29.3893 178.2314 51 R 4.4460 7.6626 114.5222 55.7366 30.5164 175.0213 52 L 4.7695 7.8549 122.1995 54.9693 41.9415 176.7975 53 S 4.6502 9.1883 121.5260 59.7763 64.3794 174.3524 54 F 4.9381 7.9846 121.2199 56.8332 42.2920 173.3387 55 M 4.3264 7.6317 124.2627 53.3802 35.1729 173.6667 56 D 4.8055 7.7133 124.2290 50.7491 42.6928 176.2027 57 S 4.1057 8.4848 112.9431 61.7855 62.5641 176.4193 58 S 4.1760 8.4082 118.2055 61.0688 62.7390 176.8081 59 G 3.4183 8.0381 108.8470 47.4909 0.0000 175.4852 60 V 3.6525 7.5820 121.4173 65.7555 31.4125 178.3529 61 G 3.5543 8.2735 105.4682 47.4982 0.0000 175.3717 62 L 3.9466 7.7648 122.6188 57.9659 42.1586 179.2679 63 V 3.2679 7.4761 118.0116 66.0419 31.4567 178.0884 64 L 3.9790 8.1722 119.1345 57.4638 41.4993 179.7351 65 G 3.6407 8.4304 106.3038 47.8705 0.0000 176.0364 66 R 4.3005 7.9065 121.2671 58.7229 30.1720 179.0146 67 M 4.0330 8.0561 118.6718 58.3730 31.6782 178.7698 68 R 3.9504 7.8639 117.9270 59.3600 30.0736 178.1147 69 E 4.2599 8.1383 118.0961 59.5099 29.3973 179.3779 70 L 4.0151 8.2693 119.0102 57.3378 41.3664 179.0744 71 E 3.9478 7.8559 118.1857 58.7356 29.6309 177.8383 72 A 4.4329 7.8145 118.4572 53.0408 18.7785 177.8061 73 V 4.3349 6.9998 109.3741 60.5922 33.3806 175.1771 74 A 3.6882 8.2419 119.0323 53.2481 15.7465 177.8394 75 G 4.6386 8.1139 107.5998 46.4564 0.0000 174.2245 76 R 5.0491 8.2698 116.8403 54.7130 34.7518 174.6970 77 T 5.3369 8.8058 117.5855 61.9522 72.1636 173.3287 78 I 4.8136 8.9296 125.7598 59.6607 41.0397 174.7124 79 L 5.0306 9.1141 127.5502 53.2992 42.5225 174.6457 80 L 4.8315 9.3020 127.1688 54.3467 43.5182 176.2321 81 N 4.4779 9.0682 123.6078 53.4581 36.8475 172.7992 82 P 4.5202 0.0000 0.0000 62.6717 32.4377 177.1475 83 S 4.4198 8.4785 116.3322 57.4370 65.2791 173.3724 84 P 4.2397 0.0000 0.0000 66.1803 31.1033 179.0717 85 T 3.8909 7.7643 107.8866 64.7739 68.9267 176.8690 86 V 3.2390 7.4730 121.3880 65.3358 31.4053 177.8505 87 R 3.9551 8.5571 118.9143 59.3216 29.7849 178.3239 88 K 4.0406 7.9021 119.0224 59.5816 32.2381 178.8993 89 V 3.4791 7.4235 117.9386 65.9383 31.2793 178.0371 90 F 4.4285 7.9630 117.4985 60.6854 38.8083 177.5397 91 Q 4.0652 8.5103 118.0249 59.2125 28.3685 178.9575 92 F 4.0992 8.3780 120.2988 61.0824 39.5070 176.5871 93 S 4.4596 7.9812 112.6904 58.9259 62.9930 175.1418 94 G 3.9744 7.9698 110.0091 45.4176 0.0000 173.9050 95 L 4.7570 8.3710 118.9158 54.2065 42.3840 178.4144 96 G 3.9436 8.4112 109.8796 48.4835 0.0000 173.9754 97 P 4.2480 0.0000 0.0000 63.8952 31.4120 176.7906 98 W 4.5655 8.4355 117.7360 56.7706 29.6681 175.8880 99 M 4.8933 7.8535 119.0517 55.5945 32.3068 175.6021 100 M 4.8176 9.1276 120.9500 54.2644 36.5894 173.4163 101 D 5.3670 8.4985 124.7781 53.3959 42.4168 175.1378 102 A 4.3786 8.4135 124.8114 50.2529 22.8113 176.1041 103 T 4.2991 8.5209 110.9579 61.2334 71.0275 175.7495 104 E 3.9704 8.6096 120.8661 59.5367 29.4827 179.2307 105 E 3.9231 8.1361 118.8073 59.3629 29.9092 178.5358 106 E 3.9737 8.2003 118.3144 59.3660 29.5251 179.2207 107 A 4.0488 8.1601 121.0621 55.1279 18.2288 179.7578 108 I 3.7700 7.5636 110.6961 64.1763 37.8288 177.9908 109 D 4.4799 8.0669 119.7924 56.2486 40.8818 177.7661 110 R 4.4804 7.7222 116.6122 55.5888 30.7490 178.2723 111 V 3.6356 7.3042 118.5940 64.5510 31.0786 178.0478 112 R 4.4946 8.1758 116.9386 55.0808 30.6413 176.6853 113 G 3.9975 8.1139 104.0149 45.3613 0.0000 174.4450 114 I 3.8100 8.0181 121.6847 61.3697 37.5644 176.1326 115 V 3.8335 8.2553 125.2564 62.6041 32.2077 175.2103 116 N 4.1852 8.4925 124.2569 54.4424 38.7006 173.7512 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 2 A 8.11 4.68 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 3 F 8.05 5.52 0.00 3.26 3.10 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 4 Q 10.20 4.66 0.00 2.16 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.24 2.43 0.00 5 L 8.72 5.15 0.00 1.56 1.58 0.99 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 6 E 9.03 4.54 0.00 1.98 1.72 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 2.18 2.26 0.00 7 M 8.74 4.58 0.00 2.16 2.00 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.44 0.00 8 V 8.46 3.75 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 0.76 0.00 0.00 0.91 0.00 0.00 9 T 7.32 4.76 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 10 R 8.61 3.97 0.00 1.81 2.03 0.00 3.30 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.56 0.00 11 E 8.01 4.79 0.00 2.08 2.19 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 2.22 2.22 0.00 12 T 7.67 5.13 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 1.17 0.00 0.00 13 V 8.55 4.81 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 0.58 0.00 0.00 0.83 0.00 0.00 14 V 8.84 4.50 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 0.97 0.00 0.00 0.88 0.00 0.00 15 I 8.34 4.69 1.24 0.00 0.00 -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 0.86 -0.04 0.82 0.00 0.00 16 R 9.04 4.78 0.00 1.91 1.77 0.00 3.45 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 17 L 8.10 5.34 0.00 1.54 1.67 1.17 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 18 F 9.00 4.82 0.00 2.91 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 19 G 9.82 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 20 E 8.98 5.09 0.00 2.01 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 2.50 2.43 0.00 21 L 8.55 4.56 0.00 1.69 1.66 1.01 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 22 D 8.31 5.02 0.00 2.96 2.86 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 23 H 8.57 4.24 0.00 3.42 3.60 0.00 5.65 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 24 H 7.87 4.19 0.00 3.34 3.39 0.00 5.62 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 25 A 8.46 4.16 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 0.00 0.00 0.00 0.00 0.00 26 V 7.94 3.51 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 1.07 0.00 0.00 0.98 0.00 0.00 27 E 8.36 3.95 0.00 2.17 2.10 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 2.35 2.43 0.00 28 Q 8.25 4.02 0.00 2.30 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.59 0.00 0.00 0.00 0.00 0.00 2.48 2.67 0.00 29 I 7.57 3.46 1.86 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 -0.36 0.88 0.00 0.00 30 R 8.15 3.87 0.00 1.95 2.14 0.00 3.13 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 31 A 8.22 4.00 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 32 K 8.19 3.97 0.00 1.88 1.87 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.49 1.62 7.81 33 I 7.98 3.76 1.88 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.85 0.74 0.00 0.00 34 S 8.19 4.11 0.00 4.25 4.37 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 35 T 7.88 3.91 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 1.25 0.00 0.00 36 A 7.98 4.03 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 37 I 7.43 3.68 1.39 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.53 0.39 0.00 0.00 38 F 7.91 4.73 0.00 3.03 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 39 Q 8.53 4.71 0.00 1.96 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.57 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 40 G 7.48 3.98 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 0.00 0.00 0.00 41 A 8.32 4.62 1.23 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 0.00 0.00 0.00 42 V 7.68 4.00 1.98 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 0.72 0.00 0.00 0.85 0.00 0.00 43 T 9.14 4.68 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 1.27 0.00 0.00 44 T 7.67 5.17 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 45 I 8.68 4.62 1.74 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.64 -0.18 0.00 0.00 46 I 8.35 4.69 1.81 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 1.23 0.68 0.92 0.00 0.00 47 W 9.16 4.60 0.00 3.15 2.33 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 48 N 9.07 4.82 0.00 2.67 2.61 0.00 0.00 6.77 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 49 F 9.14 4.59 0.00 3.44 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 50 E 8.32 4.09 0.00 2.07 1.98 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 2.36 2.36 0.00 51 R 7.66 4.45 0.00 1.58 2.00 0.00 3.39 0.00 0.00 3.36 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 52 L 7.85 4.77 0.00 1.83 1.83 1.12 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 53 S 9.19 4.65 0.00 3.96 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 54 F 7.98 4.94 0.00 2.92 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 55 M 7.63 4.33 0.00 1.33 1.43 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.01 0.00 56 D 7.71 4.81 0.00 2.83 2.59 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 0.00 0.00 0.00 57 S 8.48 4.11 0.00 4.04 4.14 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 58 S 8.41 4.18 0.00 4.09 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 59 G 8.04 3.42 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 0.00 60 V 7.58 3.65 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 1.06 0.00 0.00 0.80 0.00 0.00 61 G 8.27 3.55 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 0.00 0.00 0.00 62 L 7.76 3.95 0.00 1.87 1.82 1.04 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 63 V 7.48 3.27 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 0.50 0.00 0.00 0.04 0.00 0.00 64 L 8.17 3.98 0.00 1.62 1.61 0.84 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.43 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 66 R 7.91 4.30 0.00 2.31 2.12 0.00 3.58 0.00 0.00 3.36 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.59 0.00 67 M 8.06 4.03 0.00 1.95 2.15 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.32 0.00 68 R 7.86 3.95 0.00 1.81 2.17 0.00 3.35 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.78 0.00 69 E 8.14 4.26 0.00 2.08 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 2.63 2.58 0.00 70 L 8.27 4.02 0.00 1.82 1.73 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 71 E 7.86 3.95 0.00 2.19 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 2.36 2.37 0.00 72 A 7.81 4.43 1.49 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 73 V 7.00 4.33 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 0.79 0.00 0.00 0.93 0.00 0.00 74 A 8.24 3.69 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 75 G 8.11 4.64 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 76 R 8.27 5.05 0.00 1.72 1.83 0.00 3.30 0.00 0.00 3.37 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 77 T 8.81 5.34 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 1.33 0.00 0.00 78 I 8.93 4.81 1.96 0.00 0.00 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 1.31 0.85 1.00 0.00 0.00 79 L 9.11 5.03 0.00 1.46 1.43 -0.11 0.26 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 80 L 9.30 4.83 0.00 1.84 1.73 1.07 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 81 N 9.07 4.48 0.00 2.96 2.88 0.00 0.00 6.49 8.72 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 82 P 0.00 4.52 0.00 2.32 2.18 0.00 3.87 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 2.09 2.11 0.00 83 S 8.48 4.42 0.00 4.09 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 0.00 84 P 0.00 4.24 0.00 2.18 2.17 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 2.13 2.17 0.00 85 T 7.76 3.89 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 1.22 0.00 0.00 86 V 7.47 3.24 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 0.35 0.00 0.00 0.81 0.00 0.00 87 R 8.56 3.96 0.00 1.94 2.17 0.00 3.18 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 88 K 7.90 4.04 0.00 1.98 1.92 0.00 1.66 0.00 0.00 1.50 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.46 7.81 89 V 7.42 3.48 1.69 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 0.69 0.00 0.00 0.67 0.00 0.00 90 F 7.96 4.43 0.00 3.20 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 91 Q 8.51 4.07 0.00 2.29 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.79 0.00 0.00 0.00 0.00 0.00 2.44 2.62 0.00 92 F 8.38 4.10 0.00 3.08 3.22 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 93 S 7.98 4.46 0.00 4.23 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 94 G 7.97 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 0.00 0.00 0.00 95 L 8.37 4.76 0.00 1.85 1.46 0.78 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 96 G 8.41 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 97 P 0.00 4.25 0.00 1.34 1.78 0.00 3.99 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.03 0.00 98 W 8.44 4.57 0.00 3.36 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 99 M 7.85 4.89 0.00 1.97 2.09 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.41 0.00 100 M 9.13 4.82 0.00 2.09 1.87 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.55 0.00 101 D 8.50 5.37 0.00 2.60 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 0.00 102 A 8.41 4.38 1.25 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 0.00 0.00 0.00 103 T 8.52 4.30 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 1.23 0.00 0.00 104 E 8.61 3.97 0.00 2.04 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 2.40 2.37 0.00 105 E 8.14 3.92 0.00 2.03 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 2.38 2.40 0.00 106 E 8.20 3.97 0.00 2.26 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 2.34 2.34 0.00 107 A 8.16 4.05 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 0.00 108 I 7.56 3.77 1.86 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 1.74 0.63 0.94 0.00 0.00 109 D 8.07 4.48 0.00 2.84 2.77 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 0.00 110 R 7.72 4.48 0.00 1.95 1.94 0.00 3.28 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 0.00 111 V 7.30 3.64 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 0.73 0.00 0.00 0.96 0.00 0.00 112 R 8.18 4.49 0.00 1.79 1.94 0.00 3.18 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 113 G 8.11 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 0.00 114 I 8.02 3.81 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 1.30 0.84 0.91 0.00 0.00 115 V 8.26 3.83 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 0.75 0.00 0.00 0.98 0.00 0.00 116 N 8.49 4.19 0.00 2.63 2.58 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