NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4141 8.1927 115.2910 58.3881 64.8229 175.4310 2 N 4.2689 8.0803 120.2516 55.7561 39.7689 175.0129 3 I 3.9113 8.6228 119.1059 63.8634 39.5685 175.7117 4 I 4.0765 6.9955 118.6549 61.8433 38.3859 176.7635 5 K 3.8442 8.7451 121.1686 58.8792 32.6078 178.5979 6 Q 3.9711 9.0406 119.9700 58.8430 29.0325 177.6466 7 L 3.8791 6.9853 116.7778 56.4731 41.8526 178.9402 8 E 4.1601 7.9812 119.2863 59.0143 30.0049 178.5127 9 Q 4.1674 8.0894 117.4363 59.3019 28.0715 178.1815 10 E 4.0784 9.1370 121.9074 58.2588 29.3359 177.8759 11 Q 4.4409 8.1355 116.0028 56.3247 31.2107 176.1348 12 M 3.6619 7.1723 116.1441 55.6549 32.3319 176.5173 13 K 4.3688 8.0789 122.0540 56.4258 34.1985 176.2721 14 Q 4.5459 8.2543 114.9038 55.6601 30.0433 176.0817 15 D 4.4164 8.0583 118.4512 55.6447 41.6852 176.7370 16 V 3.6758 7.5709 112.7879 60.5616 31.9180 174.2255 17 P 4.5234 0.0000 0.0000 62.1380 32.9688 175.8954 18 S 4.2797 8.3214 112.2204 58.9925 63.0160 174.0664 19 F 5.2968 7.9853 121.7767 57.4127 42.9874 173.7266 20 R 4.4271 7.4891 120.0770 56.0244 31.9118 173.0566 21 P 4.4952 0.0000 0.0000 63.4688 31.1357 176.8777 22 G 3.9711 7.5917 106.8385 45.8437 0.0000 173.5698 23 D 4.4768 7.8483 119.2344 55.1690 41.3496 177.0445 24 T 3.9801 9.4678 117.5807 65.4610 68.9806 176.8869 25 V 3.3150 7.6395 115.6041 61.1663 31.2571 171.7392 26 E 4.9046 8.0340 120.5792 55.4702 31.2646 173.9680 27 V 4.0049 8.6034 127.1640 62.5602 33.2820 174.9350 28 K 4.8638 8.6306 125.6350 55.0978 34.3606 176.0374 29 V 4.8288 8.7841 119.1527 58.3488 34.6007 176.3589 30 W 5.1875 8.4783 123.8814 57.9823 30.2819 176.0927 31 V 4.2036 9.0191 124.8939 62.1131 34.8210 173.6667 32 V 3.6622 8.3544 123.6244 62.3199 32.0086 172.4991 33 E 3.4540 7.8358 120.0756 57.4320 30.0176 173.3222 34 G 3.4763 8.8348 105.2498 46.4975 0.0000 173.3588 35 S 4.6308 8.7911 113.2497 57.8892 64.2464 174.4418 36 K 4.8145 7.0997 121.7082 57.0332 34.2771 175.4211 37 K 4.3870 8.0230 112.1740 56.4902 33.0528 174.4367 38 R 4.1260 8.2388 118.5384 57.8978 31.2192 176.6072 39 L 4.9059 8.3712 119.1513 53.3578 43.6901 176.2932 40 Q 4.4093 9.3637 127.0344 55.4469 30.1872 174.8303 41 A 4.9633 8.6627 127.9953 51.3462 20.7724 176.9939 42 F 4.5232 9.5903 122.8652 56.6292 40.9952 172.8633 43 E 4.2634 8.5858 124.1054 55.8561 29.6198 175.5198 44 G 4.2417 8.3070 115.8035 45.2858 0.0000 171.9238 45 V 4.4293 8.3610 122.7307 61.2508 34.5859 175.6321 46 V 3.8127 7.9125 129.5740 64.1364 31.3487 175.1104 47 I 4.1975 8.7268 121.4665 61.8389 39.6764 175.2155 48 A 4.8859 7.1378 121.2925 49.7812 22.1587 175.0435 49 I 4.6625 8.1120 117.3736 59.4547 41.1516 173.7377 50 R 3.9604 8.9451 120.1826 56.5709 29.9389 177.4732 51 N 4.2552 10.0218 108.0353 53.1853 34.7461 174.8794 52 R 4.6335 8.1187 113.6106 54.6617 32.9805 177.7402 53 G 3.6795 8.1815 108.0891 45.9599 0.0000 174.9052 54 L 4.0048 8.8340 122.0803 58.4667 41.9631 177.5310 55 H 4.5020 7.6761 116.8871 56.1211 28.3620 174.7791 56 S 4.6502 8.2277 119.2603 57.2582 66.9111 173.6251 57 A 5.5494 8.3919 124.5976 49.7876 22.4782 175.1426 58 F 4.8431 8.3565 114.3871 57.9189 41.4611 172.7383 59 T 4.0015 8.0088 130.2169 63.6304 65.2200 171.0498 60 V 5.2892 7.5991 118.4118 58.3036 35.8940 175.7952 61 R 4.3792 8.6859 123.8976 56.6105 31.1033 176.5162 62 K 4.0468 8.2605 120.5459 57.2072 35.6898 175.9013 63 I 3.5297 7.6906 116.9734 61.8265 34.3954 174.5961 64 S 4.6272 7.2766 124.5192 57.9208 63.0770 178.3718 65 N 4.6120 8.7252 123.2993 54.2345 35.5620 173.3133 66 G 4.2523 8.1041 109.5180 44.8958 0.0000 171.7198 67 E 4.5581 7.6563 119.6459 53.8162 31.2969 175.1528 68 G 3.9017 8.4822 114.7519 45.6432 0.0000 172.9632 69 V 4.6945 8.2027 114.6187 59.3145 36.3117 174.0717 70 E 4.9292 8.6782 122.2201 54.6432 32.8653 174.3251 71 R 4.0725 8.3581 126.3955 54.6516 32.7449 174.7750 72 V 4.5997 7.9876 120.8671 59.5588 31.0968 175.6156 73 F 4.3176 7.8036 124.7624 56.9648 40.9110 174.8475 74 Q 5.1426 8.0923 114.9400 57.1606 29.2959 182.0895 75 T 2.6168 6.4985 108.7778 64.3662 70.2501 173.3449 76 H 4.7037 8.0443 122.4401 55.9752 28.7219 175.2260 77 S 4.6569 8.1471 115.0519 55.6634 63.8279 172.8797 78 P 3.9319 0.0000 0.0000 65.8135 31.4653 178.8481 79 V 2.8274 7.3029 110.6700 63.3802 31.7525 178.6571 80 V 3.3833 7.8804 119.7646 62.6334 32.7593 178.4443 81 D 3.9255 6.9551 117.5225 55.1061 42.0028 176.5137 82 S 4.6368 8.5159 108.7273 57.4625 65.3798 172.4564 83 I 4.5275 7.8443 121.8015 60.1904 39.7129 174.3445 84 S 4.6661 8.4313 126.5163 57.9551 63.5347 173.4841 85 V 4.4897 8.3558 115.2788 60.9017 34.4084 178.8224 86 K 3.6071 8.1677 117.1250 56.8294 32.4681 176.5359 87 R 4.7495 8.8939 128.8673 55.3732 32.5982 174.1600 88 R 4.6435 8.0161 121.3582 53.7842 32.0737 175.0718 89 G 4.4029 8.7187 106.0078 44.3427 0.0000 171.9794 90 A 4.4129 8.9798 125.5233 51.6113 19.3974 177.1404 91 V 4.0615 8.1407 120.4197 64.1180 34.0991 175.3740 92 R 3.6838 8.7571 114.7214 55.4821 26.9967 175.3919 93 K 4.2110 7.1511 114.2040 55.9253 35.4359 174.2908 94 A 4.1455 8.8503 128.7536 54.0605 18.8566 178.0401 95 K 4.3939 7.7604 114.0130 54.7257 35.1799 177.2876 96 L 4.8194 8.3679 127.8040 54.1539 40.9526 177.6288 97 Y 4.3649 7.4420 118.6974 60.8881 38.7354 178.1805 98 Y 4.2121 8.3812 116.6691 59.1852 37.9927 176.4167 99 L 3.9954 6.6927 121.7494 55.0250 41.8599 177.2606 100 R 3.9441 7.7157 117.9062 58.3497 30.0611 178.1227 101 E 4.3828 8.3332 120.6683 56.7522 28.2319 175.8347 102 R 4.2685 7.5651 120.5474 58.5902 33.2092 177.6477 103 T 3.4918 7.6493 112.9855 62.0908 67.6106 171.4154 104 G 4.1354 8.3840 110.8968 46.9967 0.0000 173.3284 105 K 4.1167 8.9412 124.1556 57.5828 30.5948 178.4275 106 A 4.1022 7.8681 118.3787 54.2579 18.6044 178.1239 107 A 4.2250 7.9986 117.9144 53.6450 19.4016 177.7862 108 R 3.7349 6.9740 113.1730 55.8993 30.0658 175.4494 109 I 4.5031 8.0824 116.7997 58.5886 39.1392 175.7657 110 K 4.1464 8.7310 126.4484 56.3932 33.3716 176.8256 111 E 3.9736 8.7191 122.2952 56.6448 30.6697 176.9950 112 R 3.9554 8.7382 119.1176 57.3262 30.5909 174.9535 113 L 3.5250 7.6824 125.2240 54.9595 39.5438 174.1269 114 N 4.6104 8.1809 118.7668 52.7756 39.0196 174.6018 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 S 8.19 4.41 0.00 3.88 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 2 N 8.08 4.27 0.00 2.78 2.83 0.00 0.00 6.91 7.06 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 3 I 8.62 3.91 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 1.41 1.46 0.91 0.00 0.00 4 I 7.00 4.08 1.94 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 1.19 0.72 0.92 0.00 0.00 5 K 8.75 3.84 0.00 2.00 1.97 0.00 1.72 0.00 0.00 1.88 0.00 0.00 2.83 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.39 1.35 7.81 6 Q 9.04 3.97 0.00 1.96 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.58 0.00 0.00 0.00 0.00 0.00 2.32 2.53 0.00 7 L 6.99 3.88 0.00 1.70 1.72 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 8 E 7.98 4.16 0.00 2.10 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 0.00 2.36 2.45 0.00 9 Q 8.09 4.17 0.00 2.28 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.80 0.00 0.00 0.00 0.00 0.00 2.55 2.38 0.00 10 E 9.14 4.08 0.00 2.11 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 2.29 2.34 0.00 11 Q 8.14 4.44 0.00 2.08 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.49 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 12 M 7.17 3.66 0.00 1.94 2.05 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.30 0.00 13 K 8.08 4.37 0.00 1.83 1.79 0.00 1.61 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.46 7.81 14 Q 8.25 4.55 0.00 1.98 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 7.08 0.00 0.00 0.00 0.00 0.00 2.22 2.27 0.00 15 D 8.06 4.42 0.00 2.58 2.64 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 16 V 7.57 3.68 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 0.77 0.00 0.00 0.93 0.00 0.00 17 P 0.00 4.52 0.00 2.09 1.98 0.00 3.52 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.83 0.00 18 S 8.32 4.28 0.00 3.85 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 19 F 7.99 5.30 0.00 2.79 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 20 R 7.49 4.43 0.00 1.99 1.81 0.00 3.23 0.00 0.00 3.39 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.43 0.00 21 P 0.00 4.50 0.00 2.21 2.15 0.00 3.71 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.95 0.00 22 G 7.59 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 23 D 7.85 4.48 0.00 2.57 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 T 9.47 3.98 4.44 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 1.32 0.00 0.00 25 V 7.64 3.31 2.51 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 0.79 0.00 0.00 1.06 0.00 0.00 26 E 8.03 4.90 0.00 2.06 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 2.37 2.36 0.00 27 V 8.60 4.00 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 0.11 0.00 0.00 0.92 0.00 0.00 28 K 8.63 4.86 0.00 1.71 1.75 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.52 7.81 29 V 8.78 4.83 2.20 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 0.88 0.00 0.00 1.14 0.00 0.00 30 W 8.48 5.19 0.00 3.30 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 31 V 9.02 4.20 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 0.64 0.00 0.00 1.08 0.00 0.00 32 V 8.35 3.66 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 0.72 0.00 0.00 0.91 0.00 0.00 33 E 7.84 3.45 0.00 2.04 1.62 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 2.22 2.35 0.00 34 G 8.83 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 35 S 8.79 4.63 0.00 3.85 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 36 K 7.10 4.81 0.00 1.70 1.73 0.00 1.79 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.32 7.81 37 K 8.02 4.39 0.00 1.46 1.59 0.00 1.47 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.06 1.06 7.81 38 R 8.24 4.13 0.00 1.76 2.00 0.00 3.16 0.00 0.00 3.24 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 39 L 8.37 4.91 0.00 1.55 1.68 1.17 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 9.36 4.41 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.84 0.00 0.00 0.00 0.00 0.00 2.50 2.41 0.00 41 A 8.66 4.96 1.28 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 0.00 0.00 0.00 42 F 9.59 4.52 0.00 3.19 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 43 E 8.59 4.26 0.00 1.85 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.26 0.00 44 G 8.31 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 0.00 0.00 0.00 0.00 45 V 8.36 4.43 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 0.87 0.00 0.00 0.92 0.00 0.00 46 V 7.91 3.81 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 0.34 0.00 0.00 0.35 0.00 0.00 47 I 8.73 4.20 1.89 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.73 0.94 0.00 0.00 48 A 7.14 4.89 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 49 I 8.11 4.66 1.81 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 1.51 0.79 0.92 0.00 0.00 50 R 8.95 3.96 0.00 1.97 1.60 0.00 3.34 0.00 0.00 3.52 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.82 0.00 51 N 10.02 4.26 0.00 2.96 3.01 0.00 0.00 6.59 7.66 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 52 R 8.12 4.63 0.00 2.04 1.90 0.00 3.50 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.76 0.00 53 G 8.18 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 0.00 0.00 0.00 54 L 8.83 4.00 0.00 1.50 1.51 0.89 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 55 H 7.68 4.50 0.00 3.22 3.26 0.00 5.77 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 S 8.23 4.65 0.00 3.81 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 57 A 8.39 5.55 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 58 F 8.36 4.84 0.00 3.43 3.12 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 59 T 8.01 4.00 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 1.27 0.00 0.00 60 V 7.60 5.29 2.37 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 1.35 0.00 0.00 1.27 0.00 0.00 61 R 8.69 4.38 0.00 1.74 1.85 0.00 3.42 0.00 0.00 3.52 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.56 0.00 62 K 8.26 4.05 0.00 1.54 1.66 0.00 1.08 0.00 0.00 0.87 0.00 0.00 2.50 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.16 1.30 7.81 63 I 7.69 3.53 1.85 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 1.42 0.93 0.90 0.00 0.00 64 S 7.28 4.63 0.00 3.83 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 65 N 8.73 4.61 0.00 2.68 2.79 0.00 0.00 6.86 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 66 G 8.10 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 0.00 0.00 0.00 0.00 67 E 7.66 4.56 0.00 2.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 68 G 8.48 3.90 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 0.00 69 V 8.20 4.69 2.20 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 0.85 0.00 0.00 1.08 0.00 0.00 70 E 8.68 4.93 0.00 1.93 1.75 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 2.18 2.32 0.00 71 R 8.36 4.07 0.00 1.04 0.66 0.00 2.21 0.00 0.00 2.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.87 0.00 72 V 7.99 4.60 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 0.73 0.00 0.00 0.82 0.00 0.00 73 F 7.80 4.32 0.00 2.30 2.39 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 74 Q 8.09 5.14 0.00 1.94 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.34 5.99 0.00 0.00 0.00 0.00 0.00 2.27 2.17 0.00 75 T 6.50 2.62 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 1.10 0.00 0.00 76 H 8.04 4.70 0.00 3.18 3.23 0.00 5.68 0.00 0.00 0.00 0.00 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 S 8.15 4.66 0.00 3.71 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 78 P 0.00 3.93 0.00 1.99 1.94 0.00 3.55 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.05 0.00 79 V 7.30 2.83 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 0.87 0.00 0.00 0.83 0.00 0.00 80 V 7.88 3.38 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 0.55 0.00 0.00 0.53 0.00 0.00 81 D 6.96 3.93 0.00 2.33 1.88 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 82 S 8.52 4.64 0.00 3.91 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 83 I 7.84 4.53 1.83 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.23 0.83 0.00 0.00 84 S 8.43 4.67 0.00 3.98 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 85 V 8.36 4.49 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 0.84 0.00 0.00 1.01 0.00 0.00 86 K 8.17 3.61 0.00 1.88 1.59 0.00 1.59 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.65 1.42 7.81 87 R 8.89 4.75 0.00 1.88 1.77 0.00 3.12 0.00 0.00 3.39 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 88 R 8.02 4.64 0.00 1.95 1.85 0.00 2.68 0.00 0.00 2.25 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.43 0.00 89 G 8.72 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 90 A 8.98 4.41 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 91 V 8.14 4.06 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 0.94 0.00 0.00 0.94 0.00 0.00 92 R 8.76 3.68 0.00 1.98 1.99 0.00 3.31 0.00 0.00 3.12 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.58 0.00 93 K 7.15 4.21 0.00 1.66 1.65 0.00 1.61 0.00 0.00 1.45 0.00 0.00 2.79 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.33 1.40 7.81 94 A 8.85 4.15 1.27 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 95 K 7.76 4.39 0.00 1.53 0.99 0.00 1.50 0.00 0.00 1.66 0.00 0.00 3.12 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.25 0.87 7.81 96 L 8.37 4.82 0.00 1.64 1.31 1.01 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 7.44 4.36 0.00 3.15 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 98 Y 8.38 4.21 0.00 3.14 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 99 L 6.69 4.00 0.00 1.23 1.44 0.83 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 100 R 7.72 3.94 0.00 2.02 1.77 0.00 3.32 0.00 0.00 3.54 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.62 0.00 101 E 8.33 4.38 0.00 2.07 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 2.30 2.41 0.00 102 R 7.57 4.27 0.00 1.73 2.02 0.00 3.57 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.42 0.00 103 T 7.65 3.49 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 1.21 0.00 0.00 104 G 8.38 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 0.00 0.00 0.00 105 K 8.94 4.12 0.00 1.97 1.95 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.36 7.81 106 A 7.87 4.10 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 0.00 107 A 8.00 4.22 1.28 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 0.00 0.00 0.00 108 R 6.97 3.73 0.00 2.02 1.93 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 1.67 1.62 0.00 109 I 8.08 4.50 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 1.32 0.61 0.93 0.00 0.00 110 K 8.73 4.15 0.00 1.79 1.79 0.00 1.57 0.00 0.00 1.89 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.52 7.81 111 E 8.72 3.97 0.00 2.08 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 0.00 2.36 2.38 0.00 112 R 8.74 3.96 0.00 1.86 1.93 0.00 3.41 0.00 0.00 3.15 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 113 L 7.68 3.52 0.00 1.97 1.70 0.92 0.89 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 0.00 114 N 8.18 4.61 0.00 2.71 2.66 0.00 0.00 7.06 7.56 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