NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 F 4.9257 8.3244 119.4001 57.1919 40.5428 175.0254 4 S 4.1984 8.3680 117.9633 57.1214 64.5094 171.7825 5 E 4.0027 8.8021 126.3268 59.2449 29.9001 178.3405 6 E 3.9876 8.1272 119.3416 59.2421 29.7948 178.7041 7 Q 4.3229 8.0431 117.1803 59.4150 28.9162 178.1970 8 T 3.4317 8.4603 117.8023 65.9539 68.2426 176.6724 9 A 4.0958 7.9862 122.5994 55.2859 18.4949 179.5989 10 E 4.2423 7.9437 116.9880 58.7583 29.5690 179.5254 11 F 3.9532 8.5240 118.4721 60.2901 38.9214 177.6763 12 K 2.0000 7.6947 118.2529 59.2589 31.8285 178.6880 13 E 3.8001 7.6958 119.8468 59.2254 29.2503 179.2921 14 A 3.8847 7.7277 119.1556 55.0180 18.5941 179.3176 15 F 4.0287 7.8048 118.8905 61.5674 39.3837 177.3787 16 Q 4.3368 8.2415 115.4002 57.6336 28.6849 177.3833 17 L 4.1725 7.6113 120.2397 55.5103 43.4496 177.5048 18 F 4.6831 7.1482 118.0975 53.1355 37.3640 172.7286 19 D 4.5794 7.1919 118.3569 53.3824 43.4449 175.6851 20 R 4.0574 8.1821 125.8344 58.8042 31.7134 179.9099 21 T 4.0203 8.4664 111.1662 61.1480 68.1879 174.7945 22 G 4.3515 9.0458 108.7926 45.2380 0.0000 174.8669 23 D 4.4418 8.5627 120.2478 55.1043 40.9309 177.0266 24 G 4.0727 8.3523 107.3439 46.3399 0.0000 172.7079 25 K 5.0336 8.1634 118.2698 54.2843 34.5000 175.9960 26 I 4.0129 10.5318 126.0816 59.9581 38.4994 175.4166 27 L 4.4252 8.2585 128.9339 55.7897 42.6680 177.2555 28 Y 4.2045 8.5230 125.6045 60.9632 38.5444 177.8108 29 S 4.2681 8.4186 113.8413 61.1680 63.9093 175.1465 30 Q 4.4582 7.3478 121.6389 56.1542 28.1538 175.1250 31 C 4.6203 7.7922 119.4049 60.6759 34.5015 175.2529 32 G 3.7682 7.5884 106.0671 48.3932 0.0000 175.2784 33 D 4.3248 7.8726 121.3495 56.5686 40.5870 179.0454 34 V 2.7818 6.9667 117.4985 65.8768 31.7239 177.6124 35 M 4.4597 8.1734 118.3737 58.5564 31.8899 178.9464 36 R 4.7910 8.4084 119.3158 59.0043 30.0519 178.8452 37 A 4.2726 8.2319 119.6803 55.1519 18.3245 178.7667 38 L 4.1888 7.3695 114.5202 54.5862 41.6274 177.1272 39 G 3.8094 8.4778 106.9091 46.7425 0.0000 173.5786 40 Q 4.7560 7.9015 119.0854 54.0453 31.6097 175.1460 41 N 5.2745 8.3873 121.0608 51.8193 39.3345 173.5511 42 P 4.5078 0.0000 0.0000 62.7814 32.3835 176.3997 43 T 4.1128 8.6369 111.6308 61.6046 69.3411 174.1492 44 N 4.4132 8.6566 117.8412 54.1034 38.7587 174.9235 45 A 4.5621 7.9486 117.0774 53.3510 20.6916 178.7643 46 E 3.8638 7.8972 116.2682 59.8976 29.4353 180.0756 47 V 3.5425 7.7799 109.9328 64.9081 31.9346 177.8755 48 M 4.1540 7.9866 117.2864 58.3679 32.2035 178.0500 49 K 3.9311 8.3528 119.5203 60.0724 32.4841 178.8879 50 V 3.9024 7.8288 117.1816 63.9512 31.9069 176.7230 51 L 4.4447 7.6468 118.0463 54.3020 41.4843 178.2169 52 G 3.9372 8.0848 105.4632 45.3978 0.0000 173.0761 53 N 4.2421 7.9025 114.4615 53.1247 35.2103 171.6991 54 P 4.5256 0.0000 0.0000 62.9723 32.7246 176.2207 55 K 4.6105 8.2195 117.3832 54.5415 34.6952 177.6061 56 S 4.1716 8.7248 118.0692 61.9785 62.3275 176.8138 57 D 4.3734 7.9761 121.1388 56.3224 39.6795 178.1157 58 E 4.0963 8.1237 118.9066 58.5510 29.9253 178.6046 59 M 4.2882 8.6075 120.5466 58.0479 31.8079 177.2885 60 N 4.7916 7.7144 113.6438 54.3029 39.3288 175.0146 61 L 4.8485 7.5170 118.1134 54.9259 43.3772 176.0152 62 K 4.7142 8.0466 117.4689 54.8870 35.2275 175.1448 63 T 4.9527 7.9406 111.3679 60.2535 72.2196 173.4032 64 L 4.4328 8.0563 120.6864 54.6738 45.5661 174.1716 65 K 4.8954 8.7278 126.2534 55.1691 33.3548 177.7777 66 F 2.4132 8.5282 124.0891 61.3838 38.6943 177.6253 67 E 3.5439 7.8112 116.1491 59.3721 29.3447 178.9122 68 Q 4.1384 7.7388 116.7951 58.6011 29.1958 177.8127 69 F 4.2662 8.6855 122.4065 60.6325 39.2696 176.7272 70 L 3.9974 7.8130 120.7051 57.9002 41.8112 177.2201 71 P 5.0007 0.0000 0.0000 65.8151 31.0045 178.1532 72 M 4.1982 7.7306 119.1584 57.5076 31.8138 177.9911 73 M 4.0396 7.8213 118.3557 58.9051 32.5103 178.3165 74 Q 3.6569 7.9080 118.0927 59.0216 28.8507 178.5746 75 T 3.8232 7.5563 110.3012 65.3065 68.2778 176.2604 76 I 3.6973 7.6688 121.2207 63.7180 37.2205 178.0501 77 A 4.4250 8.2657 120.9083 53.0527 18.1905 177.2238 78 K 4.4829 7.6010 116.5326 54.9405 33.6167 174.6674 79 N 4.8528 8.3498 125.3640 52.2170 41.2891 173.3117 80 K 4.3633 8.9540 115.9219 58.9452 34.5066 175.6387 81 D 4.9942 7.6880 116.5606 51.9523 43.9927 175.1441 82 Q 4.3827 8.3294 120.8930 54.6243 32.1908 175.0073 83 G 3.1310 8.4375 112.7770 46.0338 0.0000 171.2326 84 C 4.5920 7.3012 111.8148 57.1811 31.6320 174.1354 85 F 3.6440 8.7398 119.1348 61.4395 40.1936 178.6542 86 E 3.9326 7.3961 121.5810 59.1082 30.2321 177.9672 87 D 4.8736 7.9775 117.2206 55.9301 42.2704 177.4632 88 Y 4.4649 8.7929 114.5056 62.4305 38.1684 178.9530 89 V 3.6452 8.4918 111.7439 65.1392 31.6734 179.0054 90 E 3.9685 7.8084 118.7473 59.1050 30.0419 179.3450 91 G 3.5925 7.9428 105.6584 47.5601 0.0000 175.7337 92 L 4.2180 9.0554 121.7131 57.2780 41.5350 179.5011 93 R 3.1261 7.0074 117.6008 58.9220 29.7726 178.4855 94 V 3.6635 6.8182 115.6476 65.3136 31.3768 176.9562 95 F 4.8946 7.0574 113.7676 56.2790 39.2635 174.8497 96 D 4.3563 8.1429 119.4807 55.0011 40.7411 175.9986 97 K 4.1635 8.2507 127.2424 59.4689 32.7342 177.5578 98 E 4.6839 8.6336 117.9195 56.0445 31.0793 175.7593 99 G 3.8951 8.5580 104.3837 46.6145 0.0000 175.0418 100 N 4.4206 8.4947 115.7210 53.3155 38.6300 175.9605 101 G 4.5648 8.8440 106.3241 45.8196 0.0000 173.5160 102 T 4.5256 7.9248 108.1142 60.3843 71.9981 173.7282 103 V 4.3819 8.4721 124.5626 62.0261 35.0271 174.0194 104 M 4.6850 8.3302 121.5446 54.1628 34.0916 177.5301 105 G 3.7536 8.3904 103.8073 46.8488 0.0000 175.7884 106 A 4.1424 7.7075 122.4268 54.4876 19.4387 178.5230 107 E 3.6928 8.1218 117.3448 59.6572 29.4407 179.1409 108 I 3.5119 7.2674 117.9330 64.3558 37.0559 178.3859 109 R 3.8469 7.3342 117.4916 59.6055 30.0397 178.1342 110 H 4.2546 8.4668 116.8759 59.4832 30.1127 176.8318 111 V 3.5124 7.2676 119.2955 66.0799 31.3454 177.5978 112 L 4.1993 7.9729 116.4568 55.9618 41.2102 178.0647 113 V 4.3434 7.4457 118.7892 62.2567 32.0401 175.8471 114 T 4.5251 7.7881 110.4662 63.4518 73.5769 173.4977 115 L 4.6985 7.5639 121.9243 53.5469 45.2573 176.9752 116 G 3.6636 8.6674 112.9110 46.6796 0.0000 177.0464 117 E 4.2832 8.6094 115.7425 55.7675 26.6809 174.7004 118 K 3.9959 8.0131 119.3579 56.9907 32.9175 176.2681 119 M 4.6084 8.3648 125.4574 53.7027 33.2503 176.5433 120 T 4.0075 8.8756 117.8243 62.3087 68.6141 174.7484 121 E 3.8875 8.8957 125.6744 60.4554 29.5800 178.7831 122 E 3.9249 8.5063 119.4118 58.4076 28.9023 179.5033 123 E 3.8349 7.7126 117.5853 59.5805 29.9124 180.3524 124 V 3.5909 7.6621 111.9719 64.3611 31.6430 178.1445 125 E 3.8883 8.2350 119.2416 59.4467 29.3872 178.8489 126 Q 4.0636 8.3169 116.6015 58.3442 28.8016 177.7606 127 L 4.0333 7.3958 122.3621 57.8597 42.4865 178.3474 128 V 4.0935 7.4835 110.1602 60.3411 32.4207 173.6284 129 A 4.5157 6.9919 122.1954 53.9988 17.5484 175.9662 130 G 3.6139 8.3319 109.7475 46.4404 0.0000 172.6615 131 H 4.5983 9.1824 118.6272 56.7692 29.6907 175.0370 132 E 4.8830 8.2891 118.3393 55.1902 31.0550 175.3489 133 D 5.0343 8.4831 128.6972 53.0035 40.4422 177.5640 134 S 4.0406 8.8272 111.1108 61.9787 63.0679 175.5060 135 N 4.4142 8.2760 116.3077 52.7659 39.2267 174.7084 136 G 3.7539 8.0044 106.5914 46.9628 0.0000 172.9586 137 C 5.1209 9.0320 115.9932 57.7764 31.6865 175.1827 138 I 4.9683 8.6274 123.2121 58.2145 39.9023 174.5096 139 N 4.5406 8.7119 127.4965 53.7439 39.4570 175.2249 140 Y 4.1228 8.3658 125.2609 60.3364 38.4644 178.3923 141 E 4.0503 7.1077 114.7674 56.5819 28.9494 177.0150 142 E 4.8652 9.0410 118.1979 56.1003 36.1593 177.3150 143 L 4.1724 8.1339 120.8699 58.1429 42.1371 178.8131 144 V 3.5596 7.8423 117.7032 66.2554 31.4014 177.9549 145 R 4.1181 8.1703 117.1986 59.5715 29.9713 178.5450 146 M 4.1503 8.0369 117.4582 58.0351 31.9320 178.1817 147 V 3.9922 7.4979 110.9043 63.7948 32.1128 177.2034 148 L 4.2475 8.4988 119.8763 57.2614 41.2626 179.3140 149 S 4.5079 8.5364 119.0785 61.4090 63.1729 174.9621 150 G 4.2421 7.3906 114.5056 45.2239 0.0000 173.1805 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 F 8.32 4.93 0.00 2.81 2.45 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 0.00 0.00 0.00 0.00 4 S 8.37 4.20 0.00 4.01 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 5 E 8.80 4.00 0.00 2.13 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 0.00 2.39 2.45 0.00 6 E 8.13 3.99 0.00 2.10 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 2.35 2.34 0.00 7 Q 8.04 4.32 0.00 2.59 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.68 0.00 0.00 0.00 0.00 0.00 2.50 2.09 0.00 8 T 8.46 3.43 4.38 0.00 0.00 0.00 0.00 0.00 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 9 A 7.99 4.10 1.46 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 0.00 0.00 0.00 10 E 7.94 4.24 0.00 2.38 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 2.33 2.47 0.00 11 F 8.52 3.95 0.00 3.40 3.38 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.69 2.00 0.00 1.50 0.88 0.00 1.40 0.00 0.00 1.80 0.00 0.00 3.18 0.00 0.00 3.37 0.00 0.00 0.00 0.00 1.69 1.98 7.81 13 E 7.70 3.80 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 2.28 2.48 0.00 14 A 7.73 3.88 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 15 F 7.80 4.03 0.00 3.02 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 16 Q 8.24 4.34 0.00 2.06 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.73 0.00 0.00 0.00 0.00 0.00 2.66 2.37 0.00 17 L 7.61 4.17 0.00 1.54 1.61 0.71 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 18 F 7.15 4.68 0.00 2.97 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 D 7.19 4.58 0.00 2.60 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 20 R 8.18 4.06 0.00 1.96 1.91 0.00 3.11 0.00 0.00 3.29 7.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 21 T 8.47 4.02 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 22 G 9.05 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 0.00 0.00 0.00 0.00 23 D 8.56 4.44 0.00 2.73 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 24 G 8.35 4.07 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 0.00 0.00 0.00 25 K 8.16 5.03 0.00 1.75 1.84 0.00 1.94 0.00 0.00 1.77 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.51 7.81 26 I 10.53 4.01 1.86 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.25 0.46 1.06 0.00 0.00 27 L 8.26 4.43 0.00 1.87 1.68 0.95 0.79 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 28 Y 8.52 4.20 0.00 2.97 3.09 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 29 S 8.42 4.27 0.00 4.10 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 30 Q 7.35 4.46 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.75 0.00 0.00 0.00 0.00 0.00 2.20 2.26 0.00 31 C 7.79 4.62 0.00 2.97 2.87 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 0.00 0.00 0.00 32 G 7.59 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 0.00 0.00 0.00 33 D 7.87 4.32 0.00 2.33 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 V 6.97 2.78 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 0.30 0.00 0.00 0.00 0.00 0.00 35 M 8.17 4.46 0.00 2.23 2.28 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 2.87 3.09 0.00 36 R 8.41 4.79 0.00 2.01 2.00 0.00 3.22 0.00 0.00 3.27 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.57 0.00 37 A 8.23 4.27 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 38 L 7.37 4.19 0.00 1.81 1.36 1.08 0.55 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 39 G 8.48 3.81 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 0.00 0.00 0.00 40 Q 7.90 4.76 0.00 2.33 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.25 7.01 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 41 N 8.39 5.27 0.00 2.78 2.82 0.00 0.00 7.00 8.02 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 42 P 0.00 4.51 0.00 2.18 2.12 0.00 3.91 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 43 T 8.64 4.11 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 1.34 0.00 0.00 44 N 8.66 4.41 0.00 2.68 3.02 0.00 0.00 6.75 7.96 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 45 A 7.95 4.56 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 46 E 7.90 3.86 0.00 2.05 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 2.34 2.39 0.00 47 V 7.78 3.54 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 0.70 0.00 0.00 1.00 0.00 0.00 48 M 7.99 4.15 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.66 0.00 49 K 8.35 3.93 0.00 1.98 2.27 0.00 1.34 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.43 7.81 50 V 7.83 3.90 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 0.96 0.00 0.00 51 L 7.65 4.44 0.00 1.84 1.66 0.53 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 52 G 8.08 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 53 N 7.90 4.24 0.00 2.97 3.01 0.00 0.00 6.95 7.77 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 54 P 0.00 4.53 0.00 2.36 2.20 0.00 3.47 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 3.03 0.00 55 K 8.22 4.61 0.00 2.04 2.15 0.00 1.86 0.00 0.00 1.88 0.00 0.00 3.01 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.47 1.42 7.81 56 S 8.72 4.17 0.00 4.05 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 0.00 57 D 7.98 4.37 0.00 2.85 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 58 E 8.12 4.10 0.00 2.14 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 0.00 2.39 2.56 0.00 59 M 8.61 4.29 0.00 2.09 2.33 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 2.68 2.92 0.00 60 N 7.71 4.79 0.00 2.93 2.84 0.00 0.00 7.00 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 61 L 7.52 4.85 0.00 1.62 1.58 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 62 K 8.05 4.71 0.00 1.57 1.05 0.00 0.61 0.00 0.00 1.40 0.00 0.00 2.50 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.11 1.00 7.81 63 T 7.94 4.95 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 1.24 0.00 0.00 64 L 8.06 4.43 0.00 2.14 1.91 1.12 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 65 K 8.73 4.90 0.00 1.93 1.72 0.00 2.07 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.59 1.49 7.81 66 F 8.53 2.41 0.00 1.75 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 67 E 7.81 3.54 0.00 1.88 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 2.24 2.27 0.00 68 Q 7.74 4.14 0.00 2.34 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 7.10 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 69 F 8.69 4.27 0.00 3.40 3.27 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 70 L 7.81 4.00 0.00 1.42 1.61 0.99 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 71 P 0.00 5.00 0.00 2.25 2.26 0.00 3.84 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 2.13 1.88 0.00 72 M 7.73 4.20 0.00 1.74 1.93 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.32 0.00 73 M 7.82 4.04 0.00 2.60 2.51 0.00 0.00 0.00 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.24 3.37 0.00 74 Q 7.91 3.66 0.00 2.01 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.50 0.00 0.00 0.00 0.00 0.00 2.18 2.51 0.00 75 T 7.56 3.82 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 1.25 0.00 0.00 76 I 7.67 3.70 2.11 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.68 0.93 0.00 0.00 77 A 8.27 4.42 1.45 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 0.00 0.00 0.00 0.00 0.00 0.00 78 K 7.60 4.48 0.00 1.69 1.70 0.00 1.45 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.24 1.47 7.81 79 N 8.35 4.85 0.00 2.65 2.64 0.00 0.00 6.96 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 80 K 8.95 4.36 0.00 1.81 1.86 0.00 1.52 0.00 0.00 1.62 0.00 0.00 2.75 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.28 1.31 7.81 81 D 7.69 4.99 0.00 2.58 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 82 Q 8.33 4.38 0.00 2.02 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.44 0.00 83 G 8.44 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 0.00 0.00 0.00 84 C 7.30 4.59 0.00 3.12 2.95 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 85 F 8.74 3.64 0.00 3.19 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 86 E 7.40 3.93 0.00 2.03 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 0.00 2.35 2.51 0.00 87 D 7.98 4.87 0.00 2.56 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 88 Y 8.79 4.46 0.00 3.05 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 89 V 8.49 3.65 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 -0.15 0.00 0.00 0.78 0.00 0.00 90 E 7.81 3.97 0.00 2.08 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 2.32 2.38 0.00 91 G 7.94 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 92 L 9.06 4.22 0.00 1.42 1.52 0.91 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 93 R 7.01 3.13 0.00 1.64 1.93 0.00 3.15 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 94 V 6.82 3.66 1.34 0.00 0.00 0.00 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 0.73 0.00 0.00 95 F 7.06 4.89 0.00 3.22 2.98 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 96 D 8.14 4.36 0.00 2.98 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.25 4.16 0.00 1.79 2.15 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.10 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.61 7.81 98 E 8.63 4.68 0.00 1.96 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 2.26 2.32 0.00 99 G 8.56 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 0.00 100 N 8.49 4.42 0.00 2.91 2.91 0.00 0.00 7.09 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 0.00 101 G 8.84 4.56 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 0.00 0.00 0.00 102 T 7.92 4.53 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 1.14 0.00 0.00 103 V 8.47 4.38 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 1.08 0.00 0.00 1.18 0.00 0.00 104 M 8.33 4.69 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.61 0.00 105 G 8.39 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 0.00 106 A 7.71 4.14 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 0.00 107 E 8.12 3.69 0.00 2.05 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 2.40 2.46 0.00 108 I 7.27 3.51 2.09 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.71 0.87 0.00 0.00 109 R 7.33 3.85 0.00 1.83 1.98 0.00 3.29 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 110 H 8.47 4.25 0.00 3.12 3.21 0.00 5.79 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.27 3.51 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 0.87 0.00 0.00 -0.17 0.00 0.00 112 L 7.97 4.20 0.00 1.74 1.64 0.87 0.75 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 0.00 113 V 7.45 4.34 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 0.83 0.00 0.00 1.03 0.00 0.00 114 T 7.79 4.53 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 1.13 0.00 0.00 115 L 7.56 4.70 0.00 1.71 1.56 0.94 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 116 G 8.67 3.66 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 0.00 0.00 0.00 0.00 117 E 8.61 4.28 0.00 1.97 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 0.00 2.32 2.29 0.00 118 K 8.01 4.00 0.00 1.63 1.76 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.60 1.49 7.81 119 M 8.36 4.61 0.00 1.96 2.08 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 2.58 2.42 0.00 120 T 8.88 4.01 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 1.26 0.00 0.00 121 E 8.90 3.89 0.00 2.19 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 0.00 2.36 2.39 0.00 122 E 8.51 3.92 0.00 2.01 2.14 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 2.32 2.50 0.00 123 E 7.71 3.83 0.00 2.30 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 0.00 2.39 2.45 0.00 124 V 7.66 3.59 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 1.03 0.00 0.00 1.01 0.00 0.00 125 E 8.24 3.89 0.00 2.07 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 2.29 2.35 0.00 126 Q 8.32 4.06 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.64 0.00 127 L 7.40 4.03 0.00 1.75 1.87 0.89 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 128 V 7.48 4.09 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 0.77 0.00 0.00 0.97 0.00 0.00 129 A 6.99 4.52 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 0.00 130 G 8.33 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 0.00 131 H 9.18 4.60 0.00 3.28 3.35 0.00 5.81 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 E 8.29 4.88 0.00 2.16 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 2.37 2.26 0.00 133 D 8.48 5.03 0.00 2.85 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 0.00 134 S 8.83 4.04 0.00 4.00 4.04 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 0.00 0.00 0.00 135 N 8.28 4.41 0.00 2.77 2.91 0.00 0.00 7.14 7.77 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 0.00 136 G 8.00 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 0.00 137 C 9.03 5.12 0.00 2.93 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 0.00 138 I 8.63 4.97 1.92 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 1.17 1.63 0.99 0.00 0.00 139 N 8.71 4.54 0.00 2.71 2.64 0.00 0.00 6.89 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 0.00 140 Y 8.37 4.12 0.00 3.19 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 0.00 141 E 7.11 4.05 0.00 1.91 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 0.00 1.76 1.82 0.00 142 E 9.04 4.87 0.00 1.90 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 2.28 2.47 0.00 143 L 8.13 4.17 0.00 1.93 1.73 0.96 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 144 V 7.84 3.56 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 0.93 0.00 0.00 0.91 0.00 0.00 145 R 8.17 4.12 0.00 2.20 2.07 0.00 3.22 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.22 0.00 146 M 8.04 4.15 0.00 2.32 2.11 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.77 0.00 147 V 7.50 3.99 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 0.84 0.00 0.00 0.99 0.00 0.00 148 L 8.50 4.25 0.00 2.00 1.72 0.91 1.10 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 0.00 149 S 8.54 4.51 0.00 4.10 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 0.00 150 G 7.39 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