NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.3410 8.3344 116.7797 58.1982 65.2997 174.1287 5 V 3.8468 7.3758 121.8292 59.8570 29.7054 169.6373 6 V 3.7090 8.4062 122.8450 62.7906 33.6437 175.3121 7 K 4.7410 8.3554 125.9222 55.6088 34.1916 176.8448 8 S 4.8095 7.7779 119.3419 59.3495 63.1433 174.2134 9 E 4.4968 7.9122 119.5103 56.1926 30.2557 176.3132 10 D 4.7115 7.5604 117.3251 53.6974 43.2918 177.3165 11 Y 4.1866 8.0012 116.2271 59.2876 37.7504 176.8609 12 A 4.4409 7.3235 121.1015 52.1004 19.4230 176.4930 13 L 4.8569 7.2234 115.3407 51.5883 44.8766 174.8905 14 P 4.4008 0.0000 0.0000 63.0417 31.7729 175.6811 15 S 4.7687 8.0913 114.4091 56.6783 66.3814 172.5206 16 Y 4.3640 8.3850 120.9826 57.0682 39.4723 174.7378 17 V 4.3363 6.8296 116.9269 60.0228 35.7061 174.0674 18 D 4.6975 8.4934 123.5684 52.8731 41.5809 176.4312 19 R 4.5314 7.9346 122.9083 54.4929 34.2404 176.5766 20 R 3.4120 8.6247 122.3661 59.1603 30.1957 177.1870 21 D 4.7949 7.9962 114.1661 53.7165 38.8645 176.5732 22 Y 4.7904 8.0567 120.9950 56.2024 39.4772 173.4888 23 P 4.5430 0.0000 0.0000 64.6664 32.1680 177.3070 24 L 4.7326 6.6578 116.9987 51.6835 40.0339 174.2503 25 P 4.7177 0.0000 0.0000 62.1234 32.1168 177.5083 26 D 4.6265 8.6672 118.9047 56.7748 40.9939 177.0475 27 V 4.5430 7.1133 110.2441 59.1463 35.7643 174.8769 28 A 4.2109 8.2842 124.0960 51.9368 19.1684 177.5439 29 H 3.6726 8.6152 121.4023 58.3235 29.9678 175.9463 30 V 4.0101 7.8226 120.0551 61.0096 32.0140 174.6846 31 K 4.0565 8.5655 128.6585 57.5116 32.8511 175.7136 32 N 4.7114 7.8282 116.3838 51.4669 38.5763 174.0860 33 L 4.3768 8.1518 124.0182 53.3206 43.0543 178.0679 34 S 4.2986 8.8386 117.6088 59.6549 64.7120 175.0782 35 A 3.5133 8.0788 119.8568 54.9069 19.0955 179.8599 36 S 4.1155 7.9617 111.6718 60.6802 63.6263 176.7183 37 Q 3.9456 7.9773 121.8387 59.0941 28.5078 179.1606 38 K 3.9993 8.3048 118.8729 58.9150 31.8652 179.3966 39 A 3.9291 7.6485 121.4011 55.0084 18.3734 178.9611 40 L 3.8873 8.2624 119.2498 58.7447 41.8726 179.6627 41 K 4.0667 7.9983 116.4115 59.2930 32.1873 179.0416 42 E 4.1257 8.3711 119.2860 59.2848 29.4467 179.0816 43 K 3.9564 8.8533 120.2000 59.5431 31.9312 178.1590 44 E 4.2775 8.0188 118.3623 58.4174 29.6762 178.1253 45 K 4.2726 8.0207 116.7678 57.4483 32.4579 176.4565 46 A 4.5145 7.5963 122.4787 49.9489 20.6614 176.4532 47 S 4.0518 8.3354 112.7534 58.7069 62.8888 175.2977 48 W 4.6298 8.5176 126.0596 59.2539 29.3128 178.6638 49 S 4.2450 7.9004 113.9362 61.6447 62.2684 175.4075 50 S 4.4953 7.8148 113.2536 58.8795 62.6028 173.7523 51 L 4.8026 7.5084 121.2960 53.1801 43.2369 177.2711 52 S 4.4931 9.6555 118.4222 57.6745 65.2884 175.3567 53 I 3.6694 8.3759 123.2420 65.2036 36.7852 178.2894 54 D 4.3678 8.0281 118.7641 57.2270 40.6525 178.5289 55 E 3.9700 8.2667 119.2599 59.1635 29.3830 179.2816 56 K 3.8314 8.1270 118.5643 59.6741 32.1681 179.2833 57 V 3.6277 8.0530 118.5478 66.2526 31.4143 177.6977 58 E 4.0513 8.1624 118.8813 59.1002 29.3058 178.8377 59 L 3.9372 8.2425 119.4544 57.6932 41.8188 178.4310 60 Y 4.0952 8.3209 119.9381 61.0820 38.5726 178.4013 61 R 4.7913 8.2952 117.2413 57.1482 30.6119 178.4346 62 L 4.0662 7.7483 120.0261 57.3852 41.5441 178.9762 63 K 3.7190 7.5681 119.4966 57.1900 32.3434 176.5224 64 F 5.2332 7.4218 116.6557 55.3273 41.7097 174.9997 65 K 3.7652 8.4027 125.2552 57.3647 32.2807 176.3308 66 E 4.9378 8.9842 118.4883 54.5705 31.7089 176.4633 67 S 4.9670 8.7885 119.1467 57.3634 65.2990 175.4660 68 F 3.8434 9.1772 120.7350 60.9958 38.4301 177.8630 69 A 4.0813 8.0985 118.2040 55.1821 18.4623 179.0709 70 E 4.1280 8.1333 117.1732 59.6076 29.4482 179.2585 71 M 4.4039 8.1615 117.7031 57.2252 31.4474 177.3563 72 N 4.6718 7.9405 115.5620 52.2785 39.3573 175.4822 73 R 4.0826 7.3116 118.2714 55.9645 30.2085 176.9017 74 S 4.6324 8.2936 115.2094 57.6912 65.0888 172.4715 75 T 4.7336 7.9599 108.9543 60.8925 71.4717 172.7682 76 N 4.7841 8.5578 116.6934 53.3793 38.8115 176.8047 77 E 3.9080 8.3836 122.9512 59.3046 29.4452 178.8655 78 W 4.3745 8.3715 116.1343 59.6820 27.8997 178.2434 79 K 3.0892 6.4169 118.8637 59.2589 31.2888 179.4771 80 T 3.8012 7.5083 115.4137 66.3755 68.3923 176.9607 81 V 3.5911 8.1376 120.5521 66.1102 31.6986 178.2915 82 V 3.7946 8.5869 118.4897 65.9801 31.3562 178.2668 83 G 3.5943 8.3774 105.3808 47.6398 0.0000 175.5381 84 A 4.1513 8.3704 123.3767 54.9384 18.3706 179.3814 85 A 4.1715 8.3725 119.3548 56.0022 18.3694 179.8799 86 M 4.0932 8.3548 116.9992 58.1406 31.9022 178.6816 87 F 4.0232 8.5099 121.1447 61.4820 39.5682 177.2542 88 F 3.9874 8.5199 117.4146 60.6054 38.4578 177.7931 89 I 3.9958 8.1911 119.2152 64.0617 37.2421 178.3996 90 G 3.6112 8.2646 107.2942 47.6230 0.0000 175.5943 91 F 3.8934 7.9373 123.1772 61.2069 39.2953 177.3562 92 T 3.7050 7.9197 115.3212 66.4109 68.1394 176.4362 93 A 4.0176 7.7766 122.4357 54.7851 18.2162 179.6199 94 L 3.8721 7.3195 117.5960 57.8645 41.4966 179.6930 95 L 3.8552 7.2253 118.4100 57.7454 41.6737 179.3488 96 L 4.0491 7.8790 118.9277 57.6988 41.4848 179.6772 97 I 3.7146 8.1073 120.2963 64.0365 37.0795 177.9920 98 W 4.2037 8.4745 129.4681 60.6574 30.4183 177.5018 99 E 3.9741 8.8109 119.3260 59.3195 28.8773 178.7194 100 K 4.1585 8.0133 118.4465 59.5597 32.2817 177.9118 101 H 4.0998 7.7861 117.7013 58.6511 30.0131 176.0661 102 Y 4.2270 7.6454 116.0618 57.9180 38.3727 176.3809 103 V 3.9881 7.3597 117.9874 64.3412 33.0329 175.7274 104 Y 4.4476 7.5548 116.2214 57.8333 38.3198 175.9395 105 G 4.0346 8.3804 113.5533 43.1610 0.0000 171.3102 106 P 4.3080 0.0000 0.0000 62.5620 31.6850 176.0788 107 I 4.0496 7.7461 113.4088 59.0280 39.2584 173.7371 108 P 4.4222 0.0000 0.0000 62.6332 31.8471 177.4575 109 H 4.3340 8.4971 115.2754 57.9556 28.5750 177.2102 110 T 2.4820 6.9717 109.3112 62.9010 68.6131 174.8278 111 F 4.2755 7.6782 119.6795 57.7729 39.6306 176.5621 112 E 4.1870 8.0074 121.8423 56.2334 31.1764 177.3507 113 E 3.9948 8.8376 122.6166 59.6325 29.7522 179.0402 114 E 3.9960 8.2096 118.8554 58.8601 29.8288 178.3223 115 W 3.9482 8.2711 128.1053 60.5181 30.8679 178.0109 116 V 3.7799 8.4926 118.4408 65.7645 30.9323 177.8902 117 A 4.0138 8.0800 120.6891 55.2390 18.2459 179.8588 118 K 3.8524 8.1361 117.0881 59.3783 31.9654 179.5170 119 Q 3.7955 8.4073 120.3724 59.1899 28.8737 178.2151 120 T 3.9907 8.4033 117.2441 66.4935 68.5665 176.2745 121 K 3.5528 7.8449 121.3390 59.5668 32.1578 178.4466 122 R 3.8485 7.9371 118.8465 60.0123 29.7841 178.3217 123 M 4.0350 8.2542 118.3224 58.3559 32.0457 178.7869 124 L 4.1300 8.3552 119.5608 57.7838 41.4417 179.2601 125 D 4.5091 8.4370 118.9608 56.7366 40.7872 177.5221 126 M 4.3171 8.0579 115.1990 53.9505 32.4494 175.9941 127 K 4.0004 7.8699 116.6349 56.5167 30.1684 176.5256 128 V 3.4522 8.2140 118.6342 64.6446 32.8778 175.0310 129 A 3.9592 8.6896 128.7875 52.9163 15.4890 175.3578 130 P 4.7823 0.0000 0.0000 63.4297 32.9113 178.4138 131 I 4.1856 7.8296 119.4121 63.4052 37.7923 176.5008 132 Q 4.4836 7.9817 113.9208 56.7179 32.6836 176.3369 133 G 3.8839 8.3075 105.4396 47.4979 0.0000 173.1370 134 F 4.8527 8.4024 121.3074 59.3076 43.9087 176.3134 135 S 4.3180 9.9293 117.1015 61.4415 63.2570 176.6669 136 A 4.2213 8.3827 122.2790 54.9168 18.0925 178.0249 137 K 4.4785 8.6006 113.6055 56.1522 32.7674 175.6552 138 W 4.6920 8.3345 130.0701 55.3748 32.2133 174.8696 139 D 4.5078 7.5028 125.6541 52.9201 40.1566 176.4488 140 Y 4.2638 8.5447 124.7577 59.9393 38.6287 177.2805 141 D 4.4629 8.3634 119.3877 57.0948 41.1420 177.3607 142 K 4.1214 8.2009 114.9771 55.2476 32.5990 176.2002 143 N 3.8446 7.7621 116.7372 53.3304 37.2516 171.6052 144 E 3.4968 5.9864 114.6623 54.3969 34.0763 175.9176 145 W 4.4849 7.9108 120.2089 56.4110 29.4818 176.7641 146 K 3.9122 8.8202 124.3950 56.8405 32.4688 177.3147 147 K 4.1576 8.4569 121.1806 56.7483 32.1978 176.8411 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 4 S 8.33 4.34 0.00 3.80 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 5 V 7.38 3.85 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 0.74 0.00 0.00 0.91 0.00 0.00 6 V 8.41 3.71 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 0.87 0.00 0.00 0.95 0.00 0.00 7 K 8.36 4.74 0.00 1.85 1.74 0.00 1.79 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.48 7.81 8 S 7.78 4.81 0.00 3.78 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 9 E 7.91 4.50 0.00 1.79 1.79 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 2.14 2.18 0.00 10 D 7.56 4.71 0.00 2.85 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 11 Y 8.00 4.19 0.00 3.02 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 12 A 7.32 4.44 1.09 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 13 L 7.22 4.86 0.00 1.59 1.53 0.87 0.99 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 14 P 0.00 4.40 0.00 2.06 2.02 0.00 3.62 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 15 S 8.09 4.77 0.00 3.96 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 16 Y 8.39 4.36 0.00 3.03 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 17 V 6.83 4.34 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 0.64 0.00 0.00 0.80 0.00 0.00 18 D 8.49 4.70 0.00 2.69 2.57 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 19 R 7.93 4.53 0.00 1.84 1.96 0.00 3.27 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 20 R 8.62 3.41 0.00 1.81 2.13 0.00 3.27 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.39 0.00 21 D 8.00 4.79 0.00 2.84 2.81 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 0.00 0.00 0.00 22 Y 8.06 4.79 0.00 3.02 2.81 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 0.00 0.00 0.00 23 P 0.00 4.54 0.00 2.29 2.45 0.00 3.70 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.03 0.00 24 L 6.66 4.73 0.00 1.50 1.66 0.95 1.22 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 25 P 0.00 4.72 0.00 2.01 1.83 0.00 3.93 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.02 0.00 26 D 8.67 4.63 0.00 2.89 2.80 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 0.00 0.00 0.00 27 V 7.11 4.54 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 0.72 0.00 0.00 1.11 0.00 0.00 28 A 8.28 4.21 1.14 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 29 H 8.62 3.67 0.00 2.36 3.24 0.00 5.92 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.82 4.01 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 0.72 0.00 0.00 0.71 0.00 0.00 31 K 8.57 4.06 0.00 1.71 1.76 0.00 1.79 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.41 7.81 32 N 7.83 4.71 0.00 2.71 2.74 0.00 0.00 6.90 7.85 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 33 L 8.15 4.38 0.00 1.61 1.56 0.89 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.84 4.30 0.00 4.03 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 35 A 8.08 3.51 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 36 S 7.96 4.12 0.00 4.06 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 0.00 37 Q 7.98 3.95 0.00 2.37 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.83 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 38 K 8.30 4.00 0.00 1.79 1.86 0.00 1.66 0.00 0.00 1.64 0.00 0.00 3.09 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.60 7.81 39 A 7.65 3.93 1.37 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 0.00 0.00 40 L 8.26 3.89 0.00 1.81 1.92 0.93 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.00 4.07 0.00 1.77 1.87 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.67 1.61 7.81 42 E 8.37 4.13 0.00 2.18 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 2.53 2.47 0.00 43 K 8.85 3.96 0.00 1.90 2.00 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.50 7.81 44 E 8.02 4.28 0.00 2.19 2.28 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 2.58 2.37 0.00 45 K 8.02 4.27 0.00 1.82 1.88 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.63 7.81 46 A 7.60 4.51 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 47 S 8.34 4.05 0.00 3.81 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 48 W 8.52 4.63 0.00 3.51 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 49 S 7.90 4.25 0.00 3.90 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 50 S 7.81 4.50 0.00 4.05 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 51 L 7.51 4.80 0.00 1.89 1.61 1.05 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 52 S 9.66 4.49 0.00 4.01 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 53 I 8.38 3.67 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 1.64 0.96 0.90 0.00 0.00 54 D 8.03 4.37 0.00 2.69 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 55 E 8.27 3.97 0.00 2.18 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 2.34 2.36 0.00 56 K 8.13 3.83 0.00 1.97 1.84 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.39 1.55 7.81 57 V 8.05 3.63 2.22 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 1.06 0.00 0.00 0.94 0.00 0.00 58 E 8.16 4.05 0.00 2.18 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 0.00 2.31 2.35 0.00 59 L 8.24 3.94 0.00 1.86 1.62 0.86 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 60 Y 8.32 4.10 0.00 3.16 3.28 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 61 R 8.30 4.79 0.00 1.86 2.06 0.00 3.47 0.00 0.00 3.35 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.78 0.00 62 L 7.75 4.07 0.00 1.77 1.61 0.88 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.57 3.72 0.00 1.41 1.27 0.00 0.93 0.00 0.00 1.24 0.00 0.00 2.75 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.30 0.21 7.81 64 F 7.42 5.23 0.00 2.72 2.82 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 0.00 0.00 0.00 65 K 8.40 3.77 0.00 0.92 1.95 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.20 7.81 66 E 8.98 4.94 0.00 2.22 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 2.29 2.27 0.00 67 S 8.79 4.97 0.00 4.04 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 68 F 9.18 3.84 0.00 3.09 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 69 A 8.10 4.08 1.32 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 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.13 4.13 0.00 2.17 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 2.35 2.33 0.00 71 M 8.16 4.40 0.00 2.15 2.10 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 2.40 2.34 0.00 72 N 7.94 4.67 0.00 2.81 2.91 0.00 0.00 7.02 7.27 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 73 R 7.31 4.08 0.00 1.96 1.95 0.00 3.07 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 1.86 1.59 0.00 74 S 8.29 4.63 0.00 4.06 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 75 T 7.96 4.73 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 1.24 0.00 0.00 76 N 8.56 4.78 0.00 2.70 2.65 0.00 0.00 6.41 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 77 E 8.38 3.91 0.00 2.07 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 2.35 2.35 0.00 78 W 8.37 4.37 0.00 3.71 3.37 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 79 K 6.42 3.09 0.00 1.34 1.33 0.00 1.26 0.00 0.00 1.21 0.00 0.00 2.94 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.30 0.21 7.81 80 T 7.51 3.80 4.33 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 1.19 0.00 0.00 81 V 8.14 3.59 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 1.14 0.00 0.00 1.01 0.00 0.00 82 V 8.59 3.79 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 1.11 0.00 0.00 1.21 0.00 0.00 83 G 8.38 3.59 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 0.00 84 A 8.37 4.15 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 85 A 8.37 4.17 1.52 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 86 M 8.35 4.09 0.00 2.16 2.33 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 2.91 2.61 0.00 87 F 8.51 4.02 0.00 3.11 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 88 F 8.52 3.99 0.00 3.31 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 89 I 8.19 4.00 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 1.52 0.72 0.93 0.00 0.00 90 G 8.26 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 F 7.94 3.89 0.00 2.51 3.03 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 92 T 7.92 3.71 4.43 0.00 0.00 0.00 0.00 0.00 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 93 A 7.78 4.02 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 94 L 7.32 3.87 0.00 1.30 1.55 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 95 L 7.23 3.86 0.00 1.71 1.60 0.87 0.30 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 L 7.88 4.05 0.00 1.85 1.75 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 97 I 8.11 3.71 2.03 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 1.40 0.70 0.90 0.00 0.00 98 W 8.47 4.20 0.00 3.50 3.41 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 99 E 8.81 3.97 0.00 2.23 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 0.00 1.74 2.06 0.00 100 K 8.01 4.16 0.00 1.96 2.01 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.46 1.48 7.81 101 H 7.79 4.10 0.00 2.92 2.95 0.00 5.99 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 7.65 4.23 0.00 1.51 2.32 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 0.00 0.00 0.00 0.00 103 V 7.36 3.99 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 0.55 0.00 0.00 0.82 0.00 0.00 104 Y 7.55 4.45 0.00 3.14 2.73 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 0.00 105 G 8.38 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 0.00 0.00 0.00 106 P 0.00 4.31 0.00 2.15 2.03 0.00 3.74 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 107 I 7.75 4.05 1.47 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.51 0.56 0.00 0.00 108 P 0.00 4.42 0.00 2.25 1.92 0.00 3.64 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.07 0.00 109 H 8.50 4.33 0.00 3.35 3.47 0.00 5.65 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 T 6.97 2.48 3.51 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 0.00 0.00 0.00 0.02 0.00 0.00 111 F 7.68 4.28 0.00 3.05 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 0.00 112 E 8.01 4.19 0.00 2.26 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 2.38 2.37 0.00 113 E 8.84 3.99 0.00 2.08 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 2.43 2.43 0.00 114 E 8.21 4.00 0.00 2.13 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 2.39 2.37 0.00 115 W 8.27 3.95 0.00 3.59 3.16 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 0.00 116 V 8.49 3.78 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 0.93 0.00 0.00 1.08 0.00 0.00 117 A 8.08 4.01 1.40 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 0.00 118 K 8.14 3.85 0.00 1.56 1.57 0.00 1.42 0.00 0.00 1.31 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.46 7.81 119 Q 8.41 3.80 0.00 2.15 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 120 T 8.40 3.99 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 1.47 0.00 0.00 121 K 7.84 3.55 0.00 1.65 1.66 0.00 1.54 0.00 0.00 1.49 0.00 0.00 2.84 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.41 1.24 7.81 122 R 7.94 3.85 0.00 1.80 1.95 0.00 3.06 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 123 M 8.25 4.03 0.00 1.88 2.28 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.41 0.00 124 L 8.36 4.13 0.00 1.33 1.17 -0.75 0.76 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 0.00 125 D 8.44 4.51 0.00 2.73 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 0.00 126 M 8.06 4.32 0.00 2.15 2.15 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 2.55 2.84 0.00 127 K 7.87 4.00 0.00 1.98 1.94 0.00 1.53 0.00 0.00 1.16 0.00 0.00 2.48 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.59 1.30 7.81 128 V 8.21 3.45 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 0.74 0.00 0.00 0.89 0.00 0.00 129 A 8.69 3.96 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 0.00 130 P 0.00 4.78 0.00 2.23 2.38 0.00 3.82 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 131 I 7.83 4.19 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 1.44 0.48 0.94 0.00 0.00 132 Q 7.98 4.48 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.03 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 133 G 8.31 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 0.00 0.00 0.00 134 F 8.40 4.85 0.00 3.11 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 0.00 135 S 9.93 4.32 0.00 4.24 4.33 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 0.00 136 A 8.38 4.22 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 0.00 137 K 8.60 4.48 0.00 2.10 1.96 0.00 1.63 0.00 0.00 1.53 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.44 7.81 138 W 8.33 4.69 0.00 2.84 2.80 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 0.00 0.00 0.00 139 D 7.50 4.51 0.00 2.33 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 0.00 0.00 0.00 0.00 140 Y 8.54 4.26 0.00 3.06 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 0.00 141 D 8.36 4.46 0.00 2.78 2.69 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 0.00 142 K 8.20 4.12 0.00 1.50 1.66 0.00 1.92 0.00 0.00 1.53 0.00 0.00 2.88 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.33 1.26 7.81 143 N 7.76 3.84 0.00 2.73 2.73 0.00 0.00 6.91 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 0.00 144 E 5.99 3.50 0.00 1.71 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.85 0.00 145 W 7.91 4.48 0.00 3.19 3.14 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 0.00 146 K 8.82 3.91 0.00 1.78 1.77 0.00 1.88 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.43 1.48 7.81 147 K 8.46 4.16 0.00 1.72 1.70 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.41 7.81