NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.7181 8.4249 119.1953 52.9707 41.6197 174.2291 4 Q 4.1701 7.5946 118.2444 55.4033 32.7523 173.0609 5 Y 4.8870 8.8212 120.5615 57.6579 43.1063 173.5972 6 Y 5.3073 8.2541 123.7653 55.0047 42.5293 174.5767 7 G 3.7477 6.4207 109.2757 48.7249 0.0000 176.5720 8 T 3.3746 9.3025 109.6480 60.6087 72.6011 174.6161 9 G 3.9551 9.1790 111.5952 46.0585 0.0000 174.8450 10 R 4.7223 7.6593 116.9505 54.0509 31.3094 175.6745 11 R 4.2826 8.7648 122.9588 55.4848 33.3632 174.8995 12 K 3.7086 9.6062 126.2294 58.7069 30.1509 173.6369 13 S 3.7293 7.8427 109.2737 59.1466 61.4721 172.5198 14 S 4.6106 8.5018 117.1123 56.6379 64.3266 172.7878 15 A 5.8836 8.7381 126.3202 49.4395 22.0669 174.7461 16 A 5.0190 8.3611 121.8352 50.0963 21.9100 176.4133 17 R 4.5861 8.8913 122.4125 56.3727 31.9563 176.8840 18 V 4.8316 7.7688 114.8823 60.4349 35.9265 173.4962 19 F 5.3537 9.7063 125.4298 55.7377 42.2895 174.5744 20 I 4.5143 9.2068 125.9982 60.4689 38.3331 175.2847 21 K 4.5285 8.4384 127.8971 54.3495 35.6166 172.8497 22 P 4.2859 0.0000 0.0000 63.3581 31.5366 176.1074 23 G 3.9685 8.0680 112.8502 45.5034 0.0000 173.5820 24 N 4.3875 8.6253 117.7133 54.1216 37.4654 176.1537 25 G 4.5188 8.2222 107.5691 46.1073 0.0000 174.1341 26 K 3.7424 7.6557 117.0547 57.3330 32.2245 176.4558 27 I 4.1907 8.4899 124.8094 59.6652 38.5450 174.0263 28 V 4.3851 8.0838 129.3913 61.8431 33.8121 175.0481 29 I 4.2045 9.7189 126.9466 60.6606 40.7009 173.8335 30 N 4.2827 9.5068 126.8492 55.4635 35.9399 174.1669 31 Q 3.4172 8.1111 112.7393 56.6022 28.1398 172.5061 32 R 4.7347 7.7988 114.3790 55.0716 34.2951 172.5255 33 S 4.6987 8.0408 110.6188 57.5658 65.2381 173.3699 34 L 3.8122 7.6235 117.4562 58.9138 41.7658 179.8206 35 E 4.3985 8.1318 112.6558 57.1982 28.8486 177.5697 36 Q 4.5229 8.0543 118.2212 55.5970 31.0890 175.0300 37 Y 4.1364 8.1378 116.2279 58.4578 40.8645 177.2041 38 F 6.0629 6.9557 116.4742 55.3622 39.6025 175.5008 39 G 4.2020 8.4052 110.4778 46.3949 0.0000 172.4448 40 R 3.8672 8.5950 123.8471 56.4397 28.4406 177.6777 41 E 4.5277 8.3964 119.5369 56.0660 32.8996 175.8775 42 T 4.0616 8.2418 108.1448 64.8019 69.6794 176.2266 43 A 3.6413 7.7069 123.4880 54.9353 17.9026 179.4055 44 R 4.2701 8.1136 113.7405 60.1805 29.1721 178.7307 45 M 4.1827 8.2980 119.4694 58.1329 31.6823 178.8040 46 V 4.4407 7.4587 118.9255 65.4828 31.8197 177.6870 47 V 4.0658 7.6407 108.2814 61.9390 31.8602 176.8673 48 R 4.4023 7.4791 118.5630 57.8912 30.8029 177.8528 49 Q 4.1209 8.1916 118.3182 58.5614 27.3557 177.1035 50 P 4.4437 0.0000 0.0000 64.7296 31.4991 177.4392 51 L 4.4482 8.1661 118.9675 55.9187 41.7716 177.3332 52 E 4.4255 7.8925 117.2771 56.3549 29.5009 176.2230 53 L 4.4601 7.8902 117.7201 56.3323 43.5686 177.9342 54 V 4.0249 7.0671 107.2639 59.9547 32.0879 171.9242 55 D 4.5325 7.8386 127.1459 53.9183 43.8323 171.6452 56 M 4.2774 8.1071 125.1739 55.9623 34.8587 177.8835 57 V 3.8681 9.3773 116.9612 63.3665 31.5278 172.9530 58 E 5.4752 8.4388 111.4531 56.9700 32.0777 175.3562 59 K 4.2852 7.9453 121.4013 58.1536 33.2889 176.5102 60 L 4.7597 7.3125 117.7665 54.4432 43.6389 175.7598 61 D 4.6999 8.2373 122.0036 55.2708 42.7437 173.6775 62 L 4.8379 7.7134 115.7868 58.2743 44.3981 172.3239 63 Y 4.7235 7.8941 115.1399 57.6568 42.2781 174.4067 64 I 5.5321 7.6094 126.4500 59.2197 42.0175 174.7997 65 T 5.0108 8.4568 120.9603 60.9856 70.0523 172.2685 66 V 5.1483 7.9051 123.6339 59.2709 33.8273 177.0045 67 K 4.6392 7.9579 120.2193 58.0802 33.6469 174.9499 68 G 4.0110 8.1578 105.9281 44.3625 0.0000 175.5555 69 G 4.2656 8.1112 111.7196 44.0634 0.0000 175.3954 70 G 4.2694 8.0878 113.0667 45.4039 0.0000 174.4920 71 I 4.3103 8.6825 125.0512 63.3789 37.1402 177.9393 72 S 4.1765 8.0046 116.0495 61.2373 62.5474 176.8429 73 G 3.7313 8.0621 108.2623 48.0801 0.0000 174.9185 74 Q 4.1138 7.9484 118.7306 59.2675 28.9743 179.0507 75 A 4.3063 8.1048 118.5577 55.3713 18.1276 179.8138 76 G 3.6277 7.7779 103.4304 48.2171 0.0000 175.5464 77 A 4.1866 8.2366 123.0780 54.3731 18.3372 179.8149 78 I 3.5951 7.6213 118.2911 64.8210 36.0310 178.6657 79 R 4.2826 7.9675 118.1130 58.7526 29.5261 177.4863 80 H 4.7712 7.7632 116.3075 55.9232 29.9211 175.3956 81 G 4.0981 8.3800 107.6012 46.2615 0.0000 174.5340 82 I 3.9610 7.1148 121.4842 63.9006 37.3060 177.9776 83 T 4.0037 7.6947 110.8774 64.6813 68.9894 176.6325 84 R 3.8304 7.2923 118.3234 58.6468 30.4530 177.2783 85 A 4.5466 7.4536 117.3588 51.4974 20.2385 176.7046 86 L 5.1537 7.7708 119.7586 55.0404 41.7261 176.8449 87 M 4.6439 7.7422 114.3832 54.7833 33.3830 177.4728 88 E 3.8296 7.7368 117.8013 59.2641 30.1451 178.1305 89 Y 4.2410 7.5068 119.2773 58.9661 38.9955 175.9661 90 D 4.3150 7.5038 115.6128 53.8306 42.9136 174.9501 91 E 4.6455 8.2993 126.4125 58.2976 30.0370 177.9592 92 S 4.5468 7.9152 110.9016 58.3208 62.3213 173.7638 93 L 4.3758 7.7122 121.3860 54.8550 43.0022 178.1201 94 R 3.8363 7.5909 118.0510 59.9684 30.3364 177.9396 95 S 4.0537 8.2619 111.5162 61.6221 62.2652 175.0507 96 E 4.3686 7.9862 117.4719 56.5747 29.0324 177.3877 97 L 4.6395 8.2256 120.2589 55.0395 44.5490 179.0733 98 R 4.1127 7.9457 116.8330 58.1517 30.6787 178.0978 99 K 4.1095 7.9823 116.5853 57.7962 32.2850 176.8352 100 A 4.5823 8.0294 119.1815 51.8992 20.1788 177.0378 101 G 3.9106 7.9145 103.5774 46.5667 0.0000 174.7150 102 F 4.3371 8.7276 118.2086 57.8175 39.6954 177.2095 103 V 4.1556 7.8126 112.7725 63.2874 32.7322 176.5321 104 T 3.7727 7.8110 113.4848 63.9174 68.6973 173.2701 105 R 4.2510 8.3678 126.0397 55.4803 31.0571 176.9088 106 D 4.5529 8.3405 124.6216 54.3452 39.2451 176.1107 107 A 4.3062 7.7935 132.9405 50.3374 17.8761 180.1108 108 R 4.2886 7.5603 118.4463 55.5520 30.7760 174.0939 109 Q 4.6342 8.1743 123.4971 53.3354 32.1450 174.9261 110 V 3.7543 8.1434 112.5678 61.6523 31.9951 175.2697 111 E 4.5358 8.2789 122.0932 53.9644 30.9913 175.8474 112 R 3.7891 8.4854 122.3565 55.8743 29.5699 175.3145 113 K 3.7441 8.7630 124.7034 56.4092 31.8781 176.0079 114 K 4.2604 8.3471 125.9900 55.2714 32.9084 177.7030 115 V 3.4678 8.3752 121.5023 63.5136 31.6568 176.2187 116 G 3.7855 8.8226 110.5567 45.7213 0.0000 174.6920 117 L 4.4405 7.3695 114.4036 54.6735 45.1434 176.3703 118 R 4.0135 8.9224 124.4100 59.1056 30.6339 177.2677 119 K 4.5029 7.4084 116.6038 55.9508 32.9382 176.6140 120 A 3.8634 8.1363 117.6336 53.1514 17.7050 178.0101 121 R 4.5640 8.0117 111.7609 57.5133 37.2275 175.1376 122 R 3.8658 7.9743 119.2522 56.4587 29.6381 175.0614 123 R 4.2493 8.2823 126.2866 54.5731 31.0245 174.2916 124 P 4.3807 0.0000 0.0000 62.4305 31.9465 176.5598 125 Q 4.4921 8.5692 120.2059 56.5908 29.9805 173.7751 126 F 4.5638 7.9175 109.6523 59.2339 40.6803 173.5105 127 S 3.8837 8.1825 109.2411 58.3924 63.4648 175.0352 128 K 4.1708 6.7306 130.4440 58.6246 35.4286 174.9332 129 R 4.2271 8.6989 117.4668 57.5309 30.1753 174.7903 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 4.72 0.00 2.63 2.86 0.00 0.00 6.78 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 7.59 4.17 0.00 2.20 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.55 0.00 0.00 0.00 0.00 0.00 2.23 2.51 0.00 5 Y 8.82 4.89 0.00 2.97 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 6 Y 8.25 5.31 0.00 2.62 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 7 G 6.42 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 0.00 0.00 0.00 8 T 9.30 3.37 4.36 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 1.30 0.00 0.00 9 G 9.18 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 10 R 7.66 4.72 0.00 1.76 1.87 0.00 3.19 0.00 0.00 3.19 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 11 R 8.76 4.28 0.00 1.74 1.75 0.00 3.24 0.00 0.00 3.05 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 12 K 9.61 3.71 0.00 1.81 1.73 0.00 1.97 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.34 1.43 7.81 13 S 7.84 3.73 0.00 4.03 3.92 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 14 S 8.50 4.61 0.00 4.04 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 15 A 8.74 5.88 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 16 A 8.36 5.02 1.15 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 0.00 0.00 17 R 8.89 4.59 0.00 2.01 2.43 0.00 3.33 0.00 0.00 3.68 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.75 0.00 18 V 7.77 4.83 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 0.58 0.00 0.00 0.28 0.00 0.00 19 F 9.71 5.35 0.00 3.14 3.06 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 20 I 9.21 4.51 2.34 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 1.16 1.11 0.99 0.00 0.00 21 K 8.44 4.53 0.00 1.93 1.63 0.00 1.87 0.00 0.00 1.84 0.00 0.00 2.83 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.40 1.42 7.81 22 P 0.00 4.29 0.00 2.06 1.84 0.00 3.84 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 23 G 8.07 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 24 N 8.63 4.39 0.00 2.92 3.09 0.00 0.00 6.07 6.94 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 25 G 8.22 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 7.66 3.74 0.00 1.78 1.90 0.00 1.58 0.00 0.00 1.65 0.00 0.00 2.69 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.61 1.77 7.81 27 I 8.49 4.19 1.87 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.64 0.90 0.00 0.00 28 V 8.08 4.39 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 1.00 0.00 0.00 0.98 0.00 0.00 29 I 9.72 4.20 1.49 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.60 0.58 0.00 0.00 30 N 9.51 4.28 0.00 3.11 2.86 0.00 0.00 6.32 6.95 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 31 Q 8.11 3.42 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.16 6.73 0.00 0.00 0.00 0.00 0.00 2.28 2.40 0.00 32 R 7.80 4.73 0.00 2.22 1.89 0.00 3.31 0.00 0.00 3.11 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.70 0.00 33 S 8.04 4.70 0.00 3.78 3.68 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 34 L 7.62 3.81 0.00 1.78 1.66 0.99 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.13 4.40 0.00 1.99 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 2.33 2.42 0.00 36 Q 8.05 4.52 0.00 2.20 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.74 0.00 0.00 0.00 0.00 0.00 2.29 2.47 0.00 37 Y 8.14 4.14 0.00 2.63 1.78 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 38 F 6.96 6.06 0.00 3.17 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 39 G 8.41 4.20 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 0.00 40 R 8.60 3.87 0.00 1.96 2.01 0.00 3.39 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 41 E 8.40 4.53 0.00 2.14 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 2.34 2.55 0.00 42 T 8.24 4.06 4.18 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 1.19 0.00 0.00 43 A 7.71 3.64 -0.02 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 0.00 0.00 44 R 8.11 4.27 0.00 2.20 2.55 0.00 3.15 0.00 0.00 3.46 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.85 0.00 45 M 8.30 4.18 0.00 2.04 2.19 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 2.62 2.76 0.00 46 V 7.46 4.44 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 0.89 0.00 0.00 0.91 0.00 0.00 47 V 7.64 4.07 2.15 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 1.00 0.00 0.00 1.14 0.00 0.00 48 R 7.48 4.40 0.00 2.27 2.12 0.00 3.19 0.00 0.00 3.26 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 2.05 0.00 49 Q 8.19 4.12 0.00 2.36 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.61 0.00 0.00 0.00 0.00 0.00 2.46 2.66 0.00 50 P 0.00 4.44 0.00 2.36 2.62 0.00 3.69 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.17 0.00 51 L 8.17 4.45 0.00 1.74 1.77 0.98 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 52 E 7.89 4.43 0.00 1.98 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 2.57 2.45 0.00 53 L 7.89 4.46 0.00 1.41 1.51 0.79 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.07 4.02 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 0.61 0.00 0.00 1.01 0.00 0.00 55 D 7.84 4.53 0.00 2.84 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 56 M 8.11 4.28 0.00 2.19 1.66 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.42 0.00 57 V 9.38 3.87 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 0.98 0.00 0.00 0.95 0.00 0.00 58 E 8.44 5.48 0.00 2.01 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 2.22 2.36 0.00 59 K 7.95 4.29 0.00 1.82 1.89 0.00 2.12 0.00 0.00 1.78 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.42 1.58 7.81 60 L 7.31 4.76 0.00 1.63 1.59 0.87 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 61 D 8.24 4.70 0.00 2.76 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 62 L 7.71 4.84 0.00 1.82 1.67 1.00 0.71 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 63 Y 7.89 4.72 0.00 2.94 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 64 I 7.61 5.53 1.76 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 1.15 0.90 0.81 0.00 0.00 65 T 8.46 5.01 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 66 V 7.91 5.15 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 0.81 0.00 0.00 1.18 0.00 0.00 67 K 7.96 4.64 0.00 1.75 1.80 0.00 1.62 0.00 0.00 1.08 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.47 7.81 68 G 8.16 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 69 G 8.11 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 70 G 8.09 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 71 I 8.68 4.31 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.20 0.98 0.00 0.00 72 S 8.00 4.18 0.00 3.82 3.83 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 73 G 8.06 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 74 Q 7.95 4.11 0.00 2.64 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.64 0.00 0.00 0.00 0.00 0.00 2.83 2.88 0.00 75 A 8.10 4.31 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 76 G 7.78 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 0.00 0.00 0.00 77 A 8.24 4.19 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 78 I 7.62 3.60 2.07 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.84 0.92 0.00 0.00 79 R 7.97 4.28 0.00 1.99 1.95 0.00 3.27 0.00 0.00 3.19 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 80 H 7.76 4.77 0.00 3.11 3.44 0.00 5.89 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 G 8.38 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 82 I 7.11 3.96 1.91 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 1.69 1.03 0.94 0.00 0.00 83 T 7.69 4.00 4.31 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 1.27 0.00 0.00 84 R 7.29 3.83 0.00 1.68 1.87 0.00 3.17 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.43 0.00 85 A 7.45 4.55 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 86 L 7.77 5.15 0.00 1.75 1.63 0.93 0.79 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 87 M 7.74 4.64 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.56 0.00 88 E 7.74 3.83 0.00 1.70 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 0.00 1.49 2.18 0.00 89 Y 7.51 4.24 0.00 2.62 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 90 D 7.50 4.32 0.00 2.45 2.36 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 91 E 8.30 4.65 0.00 2.04 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 2.36 2.30 0.00 92 S 7.92 4.55 0.00 3.83 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 93 L 7.71 4.38 0.00 1.91 1.53 0.85 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 94 R 7.59 3.84 0.00 1.87 1.92 0.00 3.33 0.00 0.00 3.08 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.74 0.00 95 S 8.26 4.05 0.00 3.87 3.84 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 0.00 0.00 0.00 96 E 7.99 4.37 0.00 2.09 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 2.29 2.36 0.00 97 L 8.23 4.64 0.00 1.73 1.66 0.98 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 98 R 7.95 4.11 0.00 1.88 1.98 0.00 3.13 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.62 0.00 99 K 7.98 4.11 0.00 1.76 1.83 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.39 7.81 100 A 8.03 4.58 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 0.00 101 G 7.91 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 0.00 0.00 0.00 0.00 102 F 8.73 4.34 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 0.00 103 V 7.81 4.16 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 1.03 0.00 0.00 104 T 7.81 3.77 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 1.21 0.00 0.00 105 R 8.37 4.25 0.00 1.79 1.81 0.00 3.36 0.00 0.00 3.09 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.47 0.00 106 D 8.34 4.55 0.00 2.62 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 0.00 107 A 7.79 4.31 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 7.56 4.29 0.00 1.84 1.90 0.00 3.01 0.00 0.00 3.13 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 2.01 0.00 109 Q 8.17 4.63 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 7.02 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 110 V 8.14 3.75 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 0.72 0.00 0.00 0.93 0.00 0.00 111 E 8.28 4.54 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 2.21 2.27 0.00 112 R 8.49 3.79 0.00 1.95 1.95 0.00 3.11 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 113 K 8.76 3.74 0.00 1.73 1.83 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.43 7.81 114 K 8.35 4.26 0.00 1.78 1.71 0.00 1.99 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.60 7.81 115 V 8.38 3.47 2.07 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 0.69 0.00 0.00 0.92 0.00 0.00 116 G 8.82 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.37 4.44 0.00 1.85 1.65 0.94 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.92 4.01 0.00 1.80 2.03 0.00 3.16 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 119 K 7.41 4.50 0.00 1.75 1.70 0.00 1.82 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.42 7.81 120 A 8.14 3.86 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.01 4.56 0.00 1.78 1.91 0.00 3.17 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 122 R 7.97 3.87 0.00 1.81 1.86 0.00 3.34 0.00 0.00 3.27 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.57 0.00 123 R 8.28 4.25 0.00 1.79 1.81 0.00 3.31 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 124 P 0.00 4.38 0.00 2.23 2.05 0.00 3.80 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 125 Q 8.57 4.49 0.00 2.26 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.88 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 126 F 7.92 4.56 0.00 3.16 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 0.00 127 S 8.18 3.88 0.00 3.76 3.68 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 0.00 128 K 6.73 4.17 0.00 1.79 1.86 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.46 7.81 129 R 8.70 4.23 0.00 1.79 1.75 0.00 3.51 0.00 0.00 3.31 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.39 0.00