NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.3501 8.2549 119.7106 55.9261 31.5557 174.3160 3 K 4.6664 8.4515 120.7389 53.9187 34.9526 174.4732 4 C 4.9231 9.3023 124.8150 55.5412 45.0660 172.3628 5 S 4.8778 8.9107 120.9833 56.4830 63.7220 174.2330 6 L 3.9409 8.5479 126.3056 57.4534 41.7933 178.0499 7 T 4.0287 7.1799 114.6117 63.8765 69.1410 173.2159 8 G 3.5686 7.9265 111.9928 44.0563 0.0000 171.7560 9 K 5.0019 8.1493 118.7408 54.5293 34.6912 175.7522 10 W 5.4958 9.2011 123.3458 55.2895 33.7705 174.1228 11 T 5.2945 9.5096 116.2546 60.5693 71.1515 172.2393 12 N 6.2159 8.9939 123.4120 49.8257 40.4910 174.6977 13 D 4.5086 8.6646 116.9633 55.2527 39.6874 176.7855 14 L 4.3857 8.5129 119.4041 54.5138 41.8891 177.4377 15 G 3.9911 8.0126 108.0009 45.0149 0.0000 174.3915 16 S 4.5748 7.9192 115.6491 58.6476 64.3830 172.8610 17 N 5.6954 8.9181 119.3706 51.9347 42.3925 173.3810 18 M 5.1037 8.9836 117.0794 54.2861 35.3742 173.6278 19 T 5.0444 8.8401 116.9525 61.8965 71.8697 173.0807 20 I 4.6220 8.8082 127.0231 59.6501 40.3671 176.1292 21 G 4.0532 8.5515 114.1168 45.0853 0.0000 173.1590 22 A 4.1567 8.5843 122.5938 52.2051 18.9849 177.3737 23 V 4.4043 8.1352 121.4370 61.3376 32.5406 175.9335 24 N 4.8073 8.7858 126.0121 51.6692 38.9071 175.8328 25 S 4.1146 8.4925 111.7580 61.0564 63.1627 175.0333 26 R 4.2150 8.1739 118.1858 56.0119 30.1970 177.1357 27 G 4.0995 8.4690 107.0994 46.2972 0.0000 173.3222 28 E 4.7736 8.5343 120.2209 56.0625 30.9633 175.7415 29 F 5.3756 8.3955 116.9606 55.8877 41.9419 173.0316 30 T 5.0446 8.3290 108.9134 60.6045 72.8310 172.9140 31 G 4.4054 8.0870 107.6659 46.3828 0.0000 171.9036 32 T 5.1572 8.5669 109.2616 59.9484 72.4194 172.3451 33 Y 4.8948 9.3497 125.8718 56.0209 41.1461 174.3344 34 I 5.0679 8.5038 127.2985 59.7290 41.0165 176.5028 35 T 4.4125 9.3094 117.5958 63.3794 67.6175 174.9695 36 A 4.4385 8.4449 123.0597 53.5997 19.6379 177.6277 37 V 4.5692 7.3403 107.8802 59.9585 35.2906 174.9189 38 T 4.4673 7.9130 114.5661 60.6096 70.1852 173.8458 39 A 4.0829 8.4158 129.7448 54.1447 18.8945 177.8546 40 T 4.4046 7.3980 105.8888 60.3810 70.6285 173.8679 41 S 4.7274 8.2733 115.9397 56.9385 64.7077 174.7230 42 N 4.7168 7.8311 121.7864 51.8173 37.0986 174.1084 43 E 4.2840 7.8421 122.6397 54.8628 32.3242 179.7645 44 I 2.2622 7.0975 124.6361 59.5619 36.3391 179.9131 45 K 4.5193 8.3249 128.9740 56.4117 34.7008 174.9819 46 E 4.1535 8.7087 121.9504 56.0192 30.1410 176.6795 47 S 5.0754 9.1957 118.9651 55.9368 67.4864 171.9262 48 P 4.9874 0.0000 0.0000 62.6172 32.9576 174.8707 49 L 5.3685 8.4908 120.6707 54.5916 44.2785 174.9637 50 H 5.1220 8.8917 116.3987 54.9166 33.6634 173.2769 51 G 4.1876 7.7918 108.1222 46.0814 0.0000 171.8532 52 T 5.2238 8.2697 108.7850 60.0747 72.6825 172.6280 53 Q 5.1459 9.3394 124.8695 54.5530 31.2545 174.3270 54 N 4.5753 9.1812 126.0626 53.8337 39.6790 174.6816 55 T 4.5246 8.3678 113.7225 61.1689 69.6894 173.9378 56 I 3.9646 8.0155 124.2754 62.9763 37.3661 175.5466 57 N 4.1148 9.0119 120.2382 53.0080 36.5577 174.5627 58 K 3.8438 7.9017 115.9741 57.3347 29.4638 175.5741 59 R 4.1213 7.4809 117.7895 56.4558 31.2822 178.8314 60 T 4.1682 8.5117 111.0470 63.8946 69.5036 173.5647 61 Q 5.4247 7.3567 117.6839 52.3880 28.2812 173.4101 62 P 4.6375 0.0000 0.0000 62.4356 33.6000 177.0346 63 T 4.7983 8.4046 111.8281 61.9635 70.8674 172.7061 64 F 5.2624 8.2980 115.9395 56.7023 41.7880 172.8639 65 G 4.6913 9.4440 105.7592 45.4220 0.0000 171.8234 66 F 5.5471 9.0585 115.4171 55.9242 42.1403 172.9084 67 T 4.9906 9.0682 116.5489 61.8533 71.3212 173.4291 68 V 4.1067 8.7847 127.0209 61.5921 32.8808 174.6070 69 N 4.7755 8.3571 128.7462 51.4046 37.4154 173.3977 70 W 4.4427 7.5986 120.2552 56.7977 29.6581 176.0805 71 K 4.4704 9.0987 122.7155 56.4185 32.3084 176.9077 72 F 4.9847 7.4879 112.7164 56.1201 38.3185 174.2670 73 S 4.4962 7.2401 114.2453 58.0603 65.2264 173.7152 74 E 4.2947 8.4797 118.0672 56.8738 29.8193 176.9877 75 S 4.8114 7.7213 116.3210 58.3562 65.0111 173.1362 76 T 4.9678 8.8318 116.6918 62.3125 72.7566 173.4333 77 T 5.2063 8.3410 121.3185 61.8972 72.1970 173.4623 78 V 4.9218 8.5739 117.9123 59.6070 35.2074 174.6905 79 F 5.3397 8.8701 122.0719 56.0658 42.4845 174.1566 80 T 4.6043 8.8273 116.3024 60.7272 71.3368 173.8522 81 G 4.4028 6.6705 111.6973 45.9259 0.0000 171.4861 82 Q 4.7763 7.7544 119.6729 54.4118 33.2566 176.4022 83 C 4.5544 9.1645 126.4802 55.7915 44.5453 172.3456 84 F 5.3239 9.2785 125.8268 56.1621 41.4451 175.3339 85 I 4.7195 8.7580 122.6500 59.9838 37.9164 175.7686 86 D 4.6750 9.4024 127.9151 53.2858 42.0762 177.1565 87 R 3.9236 8.4484 119.9233 58.9307 29.9938 177.6614 88 N 4.5582 8.1612 112.7389 52.7855 37.6374 175.9133 89 G 3.9482 8.3946 107.9148 45.3900 0.0000 173.8783 90 K 4.2497 8.2925 121.6782 55.6923 32.9723 175.5471 91 E 4.8802 8.6616 125.1755 56.4899 30.3682 176.4395 92 V 4.8796 9.1780 123.8122 61.3831 35.5674 173.8180 93 L 5.0114 9.1754 128.4530 53.8191 43.1370 175.6925 94 K 5.0589 9.0458 124.9605 55.2416 33.8367 176.0600 95 T 5.3411 9.2221 114.8472 60.2723 72.7583 172.7535 96 M 5.3646 9.0809 121.7974 53.3648 36.2346 174.6617 97 W 5.4401 8.3596 117.3280 54.7393 32.4913 173.7217 98 L 5.2988 8.7624 120.6596 52.9687 44.4896 175.1469 99 L 5.0114 9.2581 126.3442 53.4779 44.3034 174.9069 100 R 4.8914 9.1274 128.6030 55.1441 31.2773 175.6957 101 S 5.0377 9.0510 123.4862 56.9644 64.3041 174.2535 102 S 4.4726 8.4715 117.1709 58.1356 63.7705 173.8897 103 V 4.5038 8.2231 115.3476 59.6775 34.6374 175.3837 104 N 4.5782 8.5930 118.4123 54.3766 39.2877 175.2320 105 D 4.9049 7.7007 117.4194 51.7833 44.0012 176.1228 106 I 3.7064 8.5802 126.2782 63.8911 38.1935 177.7849 107 G 3.8440 8.4958 108.8248 48.0481 0.0000 173.6812 108 D 4.8263 8.3389 118.8351 53.9595 41.4481 177.6225 109 D 4.3295 8.1643 122.0202 56.9050 41.3237 178.4744 110 W 4.3320 8.3946 115.3006 58.6626 27.9755 176.5757 111 K 3.7171 6.5664 115.4752 56.1267 31.9724 176.6504 112 A 4.2168 7.6909 122.2227 53.0676 19.1680 177.0991 113 T 5.0288 7.5727 112.4705 61.7382 71.0256 173.9155 114 R 4.8170 8.9783 126.0018 54.7485 32.8451 175.8637 115 V 4.3158 7.6966 119.5656 60.2464 34.8240 174.9021 116 G 3.1800 5.9630 107.4639 45.7740 0.0000 171.7897 117 I 5.1310 8.2197 112.3886 59.3268 40.6837 174.8074 118 N 5.4314 9.3918 119.2228 52.0277 43.6622 173.4705 119 I 5.1634 9.0976 123.2828 59.6835 40.1195 174.4821 120 F 5.6333 9.5544 126.2613 55.9638 41.8355 174.8176 121 T 5.5097 9.1194 112.1602 59.6406 72.6495 173.2671 122 R 3.8745 8.4689 121.1537 55.8168 30.8560 176.8377 123 L 4.0806 8.1611 124.3172 55.3244 42.0514 176.3271 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 R 8.25 4.35 0.00 1.85 1.96 0.00 3.14 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 3 K 8.45 4.67 0.00 1.70 1.71 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.51 7.81 4 C 9.30 4.92 0.00 3.01 3.19 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 0.00 5 S 8.91 4.88 0.00 3.90 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 6 L 8.55 3.94 0.00 1.18 0.93 0.27 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 7 T 7.18 4.03 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 1.20 0.00 0.00 8 G 7.93 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 9 K 8.15 5.00 0.00 1.53 1.61 0.00 1.53 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.32 7.81 10 W 9.20 5.50 0.00 3.18 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 11 T 9.51 5.29 4.29 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 1.33 0.00 0.00 12 N 8.99 6.22 0.00 2.22 1.61 0.00 0.00 6.64 7.61 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 13 D 8.66 4.51 0.00 2.83 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 14 L 8.51 4.39 0.00 1.81 1.78 1.03 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 15 G 8.01 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 0.00 0.00 0.00 16 S 7.92 4.57 0.00 3.97 3.86 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 17 N 8.92 5.70 0.00 2.58 2.63 0.00 0.00 6.71 8.32 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 18 M 8.98 5.10 0.00 1.58 1.98 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 19 T 8.84 5.04 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 1.17 0.00 0.00 20 I 8.81 4.62 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 0.75 0.57 0.36 0.00 0.00 21 G 8.55 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 0.00 0.00 0.00 22 A 8.58 4.16 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 23 V 8.14 4.40 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 0.96 0.00 0.00 0.89 0.00 0.00 24 N 8.79 4.81 0.00 3.00 2.99 0.00 0.00 6.30 7.45 0.00 0.00 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 S 8.49 4.11 0.00 4.01 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 26 R 8.17 4.22 0.00 1.98 2.00 0.00 3.23 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 27 G 8.47 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 28 E 8.53 4.77 0.00 2.01 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 2.26 2.24 0.00 29 F 8.40 5.38 0.00 3.01 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 30 T 8.33 5.04 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 1.26 0.00 0.00 31 G 8.09 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 0.00 0.00 0.00 0.00 32 T 8.57 5.16 4.26 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 1.20 0.00 0.00 33 Y 9.35 4.89 0.00 2.94 2.79 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 34 I 8.50 5.07 1.86 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 1.14 0.63 0.95 0.00 0.00 35 T 9.31 4.41 5.05 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 1.39 0.00 0.00 36 A 8.44 4.44 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 V 7.34 4.57 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 0.72 0.00 0.00 0.93 0.00 0.00 38 T 7.91 4.47 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 1.22 0.00 0.00 39 A 8.42 4.08 1.22 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 0.00 0.00 40 T 7.40 4.40 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 1.16 0.00 0.00 41 S 8.27 4.73 0.00 3.98 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 42 N 7.83 4.72 0.00 2.95 2.95 0.00 0.00 6.97 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 43 E 7.84 4.28 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 2.19 2.19 0.00 44 I 7.10 2.26 1.58 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.12 0.80 0.00 0.00 45 K 8.32 4.52 0.00 1.88 1.80 0.00 1.77 0.00 0.00 1.82 0.00 0.00 3.06 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.72 1.72 7.81 46 E 8.71 4.15 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 2.39 2.44 0.00 47 S 9.20 5.08 0.00 3.82 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 48 P 0.00 4.99 0.00 2.06 2.15 0.00 3.85 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 49 L 8.49 5.37 0.00 1.84 1.66 0.68 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 50 H 8.89 5.12 0.00 3.07 3.07 0.00 5.85 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 51 G 7.79 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 0.00 0.00 0.00 0.00 52 T 8.27 5.22 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 1.13 0.00 0.00 53 Q 9.34 5.15 0.00 2.31 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.05 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 54 N 9.18 4.58 0.00 2.74 2.74 0.00 0.00 7.05 7.64 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 55 T 8.37 4.52 4.26 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 1.25 0.00 0.00 56 I 8.02 3.96 1.99 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 1.31 0.81 0.92 0.00 0.00 57 N 9.01 4.11 0.00 2.88 2.92 0.00 0.00 7.34 7.61 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 58 K 7.90 3.84 0.00 1.84 1.81 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.51 7.81 59 R 7.48 4.12 0.00 1.84 1.85 0.00 3.45 0.00 0.00 3.40 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.57 0.00 60 T 8.51 4.17 4.46 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 61 Q 7.36 5.42 0.00 1.88 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.16 0.00 62 P 0.00 4.64 0.00 2.18 2.19 0.00 3.68 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.98 0.00 63 T 8.40 4.80 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 1.14 0.00 0.00 64 F 8.30 5.26 0.00 3.56 3.25 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 65 G 9.44 4.69 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 F 9.06 5.55 0.00 3.23 3.25 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 67 T 9.07 4.99 4.26 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 1.17 0.00 0.00 68 V 8.78 4.11 1.05 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 -0.69 0.00 0.00 0.75 0.00 0.00 69 N 8.36 4.78 0.00 2.71 2.67 0.00 0.00 7.28 7.44 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 70 W 7.60 4.44 0.00 3.14 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 0.00 0.00 0.00 0.00 71 K 9.10 4.47 0.00 1.95 1.95 0.00 1.85 0.00 0.00 1.79 0.00 0.00 3.08 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.50 1.58 7.81 72 F 7.49 4.98 0.00 3.21 3.13 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 0.00 0.00 0.00 0.00 73 S 7.24 4.50 0.00 3.82 3.56 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 0.00 0.00 0.00 0.00 74 E 8.48 4.29 0.00 1.96 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 2.28 2.31 0.00 75 S 7.72 4.81 0.00 3.76 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 76 T 8.83 4.97 4.26 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 1.22 0.00 0.00 77 T 8.34 5.21 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 0.87 0.00 0.00 78 V 8.57 4.92 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 0.77 0.00 0.00 0.95 0.00 0.00 79 F 8.87 5.34 0.00 1.51 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 T 8.83 4.60 4.13 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 0.00 0.00 0.00 1.12 0.00 0.00 81 G 6.67 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 0.00 0.00 0.00 0.00 82 Q 7.75 4.78 0.00 1.83 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.91 0.00 0.00 0.00 0.00 0.00 1.32 2.10 0.00 83 C 9.16 4.55 0.00 3.03 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 84 F 9.28 5.32 0.00 3.27 2.94 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 85 I 8.76 4.72 1.97 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 1.20 0.87 0.98 0.00 0.00 86 D 9.40 4.68 0.00 2.78 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 87 R 8.45 3.92 0.00 1.84 1.99 0.00 3.24 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 88 N 8.16 4.56 0.00 2.83 2.94 0.00 0.00 6.15 7.00 0.00 0.00 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 G 8.39 3.95 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 0.00 0.00 0.00 90 K 8.29 4.25 0.00 1.89 1.83 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.53 1.45 7.81 91 E 8.66 4.88 0.00 2.07 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 0.00 2.45 2.39 0.00 92 V 9.18 4.88 2.29 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 1.24 0.00 0.00 1.08 0.00 0.00 93 L 9.18 5.01 0.00 1.76 1.71 -0.71 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 94 K 9.05 5.06 0.00 2.13 1.93 0.00 1.59 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.59 1.69 7.81 95 T 9.22 5.34 4.66 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 0.00 0.00 0.00 1.66 0.00 0.00 96 M 9.08 5.36 0.00 1.75 1.86 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.38 0.00 97 W 8.36 5.44 0.00 2.70 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 0.00 0.00 0.00 98 L 8.76 5.30 0.00 1.60 1.60 0.89 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 99 L 9.26 5.01 0.00 1.72 1.79 0.88 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 100 R 9.13 4.89 0.00 1.94 1.94 0.00 3.35 0.00 0.00 3.16 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 101 S 9.05 5.04 0.00 3.72 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 0.00 102 S 8.47 4.47 0.00 3.86 3.85 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 0.00 103 V 8.22 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 0.67 0.00 0.00 0.97 0.00 0.00 104 N 8.59 4.58 0.00 2.70 2.87 0.00 0.00 6.65 8.06 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 0.00 105 D 7.70 4.90 0.00 2.67 2.48 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 0.00 106 I 8.58 3.71 1.89 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 1.38 1.20 0.93 0.00 0.00 107 G 8.50 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 0.00 0.00 0.00 108 D 8.34 4.83 0.00 2.78 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 0.00 109 D 8.16 4.33 0.00 2.87 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 0.00 110 W 8.39 4.33 0.00 3.61 3.24 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 0.00 111 K 6.57 3.72 0.00 1.05 0.74 0.00 1.23 0.00 0.00 1.02 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.56 0.83 7.81 112 A 7.69 4.22 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 0.00 113 T 7.57 5.03 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 1.22 0.00 0.00 114 R 8.98 4.82 0.00 2.01 2.05 0.00 3.13 0.00 0.00 3.35 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 115 V 7.70 4.32 1.90 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 0.55 0.00 0.00 0.67 0.00 0.00 116 G 5.96 3.18 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 0.00 117 I 8.22 5.13 2.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.85 0.83 0.00 0.00 118 N 9.39 5.43 0.00 3.26 2.51 0.00 0.00 7.12 7.05 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 0.00 119 I 9.10 5.16 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.80 1.03 0.00 0.00 120 F 9.55 5.63 0.00 2.85 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 0.00 121 T 9.12 5.51 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 1.37 0.00 0.00 122 R 8.47 3.87 0.00 1.46 1.52 0.00 2.91 0.00 0.00 2.71 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.75 0.00 123 L 8.16 4.08 0.00 1.53 1.43 0.91 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00