NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4244 8.3049 120.3497 55.1124 33.3965 175.1080 2 L 4.1420 8.4159 126.1499 53.0825 42.4280 175.2620 3 T 4.4949 9.4519 110.7770 60.4124 71.8092 175.0859 4 G 3.7848 7.2724 107.4868 45.9570 0.0000 170.8461 5 L 4.2636 8.1003 124.9925 54.0905 42.3322 177.0814 6 N 4.5675 8.7742 125.6679 56.2138 39.3013 174.0155 7 H 5.0086 7.3342 110.3562 54.2167 32.0480 171.3756 8 L 4.6163 8.6725 120.8685 53.4477 44.6205 174.9636 9 T 5.0446 8.3390 122.1110 61.6620 71.1562 173.3140 10 L 4.5913 8.4423 125.6664 52.3800 45.0911 175.8056 11 A 4.4399 8.1968 125.1704 51.9612 19.2658 177.2085 12 V 4.8682 8.7878 114.4763 58.6954 35.3252 176.7103 13 A 4.3700 9.2689 127.9728 53.7310 19.3957 177.1336 14 D 4.7431 7.6635 115.7109 51.9310 42.1108 176.1320 15 L 3.8282 8.1746 128.2921 57.6432 42.3192 176.4639 16 P 4.1991 0.0000 0.0000 65.7654 31.2834 178.4467 17 A 4.0542 8.1434 118.9020 55.2708 18.2788 179.9369 18 S 4.2333 8.1510 113.7839 61.5664 62.8163 177.0011 19 I 3.7628 8.1505 122.6590 64.4687 36.8751 178.3771 20 A 4.0687 8.2384 121.5792 54.9030 18.2423 179.5939 21 F 4.0020 8.4158 119.3442 61.7935 39.4889 177.2155 22 Y 4.0946 8.2576 116.3539 60.5571 37.5499 178.0900 23 R 4.3585 8.4613 121.5647 59.0168 30.1165 178.1890 24 D 4.3307 8.0138 117.0736 57.1735 41.4582 178.2124 25 L 3.8182 7.8037 116.9347 57.5432 41.5352 178.3902 26 L 4.4572 7.5281 114.9578 54.4254 42.3675 177.7739 27 G 3.9474 8.0803 106.3103 45.6815 0.0000 173.7593 28 F 4.3201 8.6882 118.6130 57.1960 40.4649 174.4581 29 R 4.2871 9.1512 123.2945 55.7238 31.2679 175.1277 30 L 4.5265 8.6460 129.0822 55.3874 42.0203 175.9568 31 E 4.4515 9.4625 127.1442 58.7476 30.3499 176.8318 32 A 4.9737 7.9407 118.9006 50.6908 22.9127 174.8990 33 R 5.1892 8.5519 115.0339 54.6562 33.2970 173.9267 34 W 5.1055 8.4473 115.9945 55.5265 31.1312 175.0979 35 D 4.3030 9.0121 117.4793 57.0749 40.3204 177.6243 36 Q 4.3591 8.2606 115.5342 54.4478 29.5224 175.1154 37 G 3.4347 5.3800 104.5957 46.2837 0.0000 171.4903 38 A 4.7905 7.2591 119.7088 50.2577 23.1780 175.0036 39 Y 5.7952 8.9165 117.4441 56.5521 40.8918 175.2148 40 L 5.5601 9.3362 122.7211 53.4086 47.2086 175.0343 41 E 5.2991 9.4059 120.7196 54.8576 33.4372 173.6875 42 L 4.4564 9.1364 129.1231 53.8203 44.4859 178.5498 43 G 3.9123 8.9549 119.6720 46.8236 0.0000 173.8621 44 S 4.5639 9.1428 118.5702 57.8358 64.5233 174.1495 45 L 4.2252 8.1728 125.4808 54.5266 42.5898 174.7760 46 W 5.4341 8.9460 135.0000 55.9565 32.7890 173.8913 47 L 5.0368 9.2675 130.7419 53.8128 43.4507 174.6680 48 C 5.4125 9.0188 124.9994 58.4977 30.4786 172.6124 49 L 4.7867 8.9381 124.0578 53.0701 43.6522 175.2913 50 S 4.8347 8.5514 119.3894 56.1129 64.5727 172.9773 51 R 4.4625 8.4050 129.3932 56.3920 30.8645 175.9794 52 E 4.5176 9.5022 126.7264 54.7045 32.5936 174.4875 53 P 4.2183 0.0000 0.0000 65.9636 31.8162 177.9221 54 Q 4.2228 8.0054 113.9465 55.8480 28.4118 175.2738 55 Y 4.2902 8.0109 121.4567 58.0434 38.8735 176.9873 56 G 3.4947 8.3108 115.8905 45.8255 0.0000 174.0756 57 G 3.3754 5.3800 104.8099 43.5763 0.0000 171.1161 58 P 4.4955 0.0000 0.0000 61.8277 32.0183 176.0806 59 A 4.0609 8.2066 121.3944 52.0149 18.7774 178.6693 60 A 4.2784 8.2028 124.5383 51.6773 16.3874 176.4184 61 D 4.7852 7.5733 119.5756 52.2669 42.6823 175.2049 62 Y 4.2923 8.4467 117.8673 57.7482 39.3386 176.0205 63 T 3.6073 7.2908 116.1967 65.5342 68.7989 172.5327 64 H 3.9059 7.3951 119.6143 54.9568 31.6393 172.6221 65 Y 4.6984 8.3730 115.4542 56.2392 40.9718 174.5871 66 A 5.0305 8.5597 126.1286 50.0709 21.3505 175.4045 67 F 5.0087 9.2371 121.2703 55.5886 42.0853 175.8010 68 G 4.1743 8.7753 108.1138 46.6579 0.0000 172.8783 69 I 4.5495 7.9741 119.0194 59.5824 41.9628 174.2383 70 A 4.1529 8.6291 131.2972 51.6246 18.8735 178.3093 71 A 3.9538 8.5843 122.2452 55.0044 18.5953 179.5816 72 A 4.3906 7.9195 116.2035 53.4882 19.4391 177.9864 73 D 4.7265 7.8073 115.3872 54.8765 41.5034 178.3009 74 F 4.0300 7.9197 120.6928 61.3446 39.4579 176.8901 75 A 3.9512 8.1213 120.0554 54.9232 18.2043 179.4488 76 R 3.9068 7.7890 114.0391 58.8004 29.9554 178.6320 77 F 3.6954 7.9830 121.2130 60.8024 39.3596 177.0436 78 A 2.5800 7.3374 120.1313 54.5147 18.0623 179.2667 79 A 3.7593 7.3798 119.0600 55.3246 18.3710 179.6928 80 Q 3.6834 7.7835 117.8323 59.3242 29.1458 178.5098 81 L 3.7186 7.0586 119.9195 57.4944 41.4858 179.7931 82 R 3.9308 7.7962 117.8657 59.2802 29.8415 178.7485 83 A 4.0491 8.1993 119.4436 55.4764 18.3902 178.5509 84 H 4.4966 8.1746 111.5460 55.2917 28.9830 175.6716 85 G 3.9350 8.3667 109.2030 46.2996 0.0000 174.2637 86 V 3.8894 7.8013 119.9726 62.5500 32.2336 175.7286 87 R 4.2916 8.8510 128.2599 56.4351 31.3796 174.7035 88 E 5.5208 9.0477 124.9441 54.3545 30.7352 176.0788 89 W 4.7211 8.1625 118.5214 56.0200 29.6472 175.4268 90 K 4.0794 6.8955 117.2430 55.5967 34.0584 173.8939 91 Q 4.4557 8.1099 122.4797 54.4330 30.3615 174.8791 92 N 4.7138 8.5729 118.9160 53.8950 39.6029 175.3679 93 R 4.6348 8.5111 117.9874 56.2809 31.4742 174.0183 94 S 4.8300 7.7910 111.8987 55.7562 65.8365 173.2130 95 E 3.7636 8.7323 120.4926 58.1660 29.4641 177.1183 96 G 4.0870 8.6837 110.4413 46.5943 0.0000 172.5132 97 D 4.3060 8.0603 120.2231 54.4802 41.8558 175.7419 98 S 5.0792 8.4433 117.6442 56.9692 67.2281 172.9297 99 F 4.9537 9.6208 127.2006 56.8435 41.7042 173.6972 100 Y 5.1330 8.2290 124.6173 56.3768 39.3565 174.6994 101 F 5.6861 9.0799 119.1234 55.1185 42.0082 173.7503 102 L 5.2670 8.9740 119.5548 53.3604 43.7753 176.5446 103 D 4.0025 8.5748 122.1475 50.9680 41.2320 175.5415 104 P 4.1179 0.0000 0.0000 65.2234 30.9722 177.1849 105 D 4.5653 8.4331 117.2816 53.4959 40.7266 177.5476 106 G 3.9013 8.3183 106.4048 46.2142 0.0000 174.2646 107 H 4.2370 7.8746 116.4643 56.3503 29.4683 174.0938 108 R 4.3608 8.3007 121.3756 54.7424 31.6351 175.4491 109 L 5.5590 8.8510 123.0266 52.1477 46.6343 175.2946 110 E 5.2181 8.4098 119.3180 55.3998 33.1925 173.2592 111 A 5.3413 9.8847 129.8773 51.1420 20.8135 175.2657 112 H 5.2752 9.3337 122.0534 54.3518 33.1263 172.1200 113 V 4.5160 7.9197 125.8210 61.1067 32.9812 174.5101 114 G 3.7515 8.3209 112.9081 44.2718 0.0000 171.0748 115 D 4.6725 8.5059 116.7776 51.3264 42.2087 175.4644 116 L 3.9840 8.6556 119.0265 58.4193 42.1011 179.0121 117 R 3.8914 8.0897 118.5742 59.7648 30.0337 178.4963 118 S 4.1668 8.6716 113.9525 61.2810 62.8041 176.4109 119 R 4.1459 7.9291 123.6402 58.7947 29.8055 178.4721 120 L 4.0314 8.0358 118.5914 57.6506 41.6732 179.3246 121 A 3.9412 7.8759 120.0093 55.2125 18.4132 179.3555 122 A 3.9623 7.8777 118.9867 55.7946 18.2815 179.7196 123 C 4.0564 8.3441 115.2868 62.6969 27.9024 176.3285 124 R 3.6583 8.3158 119.8673 59.5444 29.7155 178.7975 125 Q 4.2682 7.6839 115.5628 57.4415 30.0234 176.6132 126 A 4.6911 7.7669 121.9139 49.6344 19.2627 173.3602 127 P 4.6638 0.0000 0.0000 61.3248 32.9012 177.2689 128 Y 4.5209 8.0198 117.5641 57.1766 38.6777 175.0130 129 A 4.0911 8.6879 124.2416 54.1108 18.5028 177.7824 130 G 3.9308 8.9001 110.5874 46.4888 0.0000 173.1672 131 M 4.0603 7.8290 119.1877 55.0056 32.7039 175.9068 132 R 4.4256 7.8706 123.4149 54.4288 33.9463 174.8818 133 F 4.6115 8.3659 120.2251 55.5527 41.0027 175.8083 134 A 4.2040 8.5596 123.7773 52.7143 18.1789 177.6852 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 M 8.30 4.42 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.58 0.00 2 L 8.42 4.14 0.00 1.76 1.58 0.92 0.57 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 3 T 9.45 4.49 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 4 G 7.27 3.78 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 0.00 0.00 0.00 5 L 8.10 4.26 0.00 1.62 1.64 0.89 0.93 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 6 N 8.77 4.57 0.00 2.76 2.78 0.00 0.00 7.02 7.89 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 7 H 7.33 5.01 0.00 2.43 2.41 0.00 5.52 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 8 L 8.67 4.62 0.00 1.68 1.48 0.56 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 9 T 8.34 5.04 4.11 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 0.00 0.00 0.00 1.13 0.00 0.00 10 L 8.44 4.59 0.00 1.31 1.17 0.60 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 11 A 8.20 4.44 0.58 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 0.00 0.00 12 V 8.79 4.87 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 0.86 0.00 0.00 0.90 0.00 0.00 13 A 9.27 4.37 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 D 7.66 4.74 0.00 2.68 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 L 8.17 3.83 0.00 1.69 1.56 0.71 0.77 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 16 P 0.00 4.20 0.00 2.19 2.09 0.00 3.94 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.14 0.00 17 A 8.14 4.05 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 S 8.15 4.23 0.00 3.94 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 19 I 8.15 3.76 2.01 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.80 0.95 0.00 0.00 20 A 8.24 4.07 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 21 F 8.42 4.00 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 22 Y 8.26 4.09 0.00 3.10 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 23 R 8.46 4.36 0.00 2.03 2.04 0.00 3.17 0.00 0.00 3.32 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 24 D 8.01 4.33 0.00 2.83 2.66 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 25 L 7.80 3.82 0.00 1.27 1.10 0.36 0.69 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 26 L 7.53 4.46 0.00 2.14 1.94 1.24 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 27 G 8.08 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 28 F 8.69 4.32 0.00 3.14 3.08 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 0.00 0.00 0.00 29 R 9.15 4.29 0.00 1.89 1.85 0.00 3.11 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 30 L 8.65 4.53 0.00 1.76 1.65 1.04 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 31 E 9.46 4.45 0.00 2.17 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 32 A 7.94 4.97 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 33 R 8.55 5.19 0.00 1.65 1.87 0.00 3.05 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 34 W 8.45 5.11 0.00 3.39 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 35 D 9.01 4.30 0.00 2.79 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 36 Q 8.26 4.36 0.00 2.39 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.93 0.00 0.00 0.00 0.00 0.00 2.50 2.38 0.00 37 G 5.38 3.43 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 0.00 0.00 0.00 0.00 38 A 7.26 4.79 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Y 8.92 5.80 0.00 3.15 2.97 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 40 L 9.34 5.56 0.00 1.72 1.81 0.92 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 41 E 9.41 5.30 0.00 2.06 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 2.31 2.49 0.00 42 L 9.14 4.46 0.00 0.27 0.79 0.49 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 43 G 8.95 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 9.14 4.56 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 45 L 8.17 4.23 0.00 1.87 1.89 1.09 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 46 W 8.95 5.43 0.00 3.46 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 L 9.27 5.04 0.00 1.99 1.68 0.56 -0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 48 C 9.02 5.41 0.00 2.87 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 49 L 8.94 4.79 0.00 1.31 1.40 0.86 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 50 S 8.55 4.83 0.00 3.84 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 51 R 8.40 4.46 0.00 1.69 1.72 0.00 3.28 0.00 0.00 3.38 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 52 E 9.50 4.52 0.00 1.88 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 2.20 2.22 0.00 53 P 0.00 4.22 0.00 2.19 2.18 0.00 3.78 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 54 Q 8.01 4.22 0.00 2.10 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.97 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 55 Y 8.01 4.29 0.00 3.08 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 56 G 8.31 3.49 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 0.00 57 G 5.38 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 0.00 0.00 0.00 58 P 0.00 4.50 0.00 2.17 2.20 0.00 3.79 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.06 0.00 59 A 8.21 4.06 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 60 A 8.20 4.28 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 61 D 7.57 4.79 0.00 2.74 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 Y 8.45 4.29 0.00 2.93 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 63 T 7.29 3.61 4.17 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 0.00 0.00 0.99 0.00 0.00 64 H 7.40 3.91 0.00 2.92 2.64 0.00 5.47 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 Y 8.37 4.70 0.00 2.86 2.62 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 0.00 0.00 0.00 66 A 8.56 5.03 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 F 9.24 5.01 0.00 3.15 3.01 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 68 G 8.78 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 69 I 7.97 4.55 1.74 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.02 1.09 0.00 0.00 70 A 8.63 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 71 A 8.58 3.95 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 72 A 7.92 4.39 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 73 D 7.81 4.73 0.00 2.67 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 74 F 7.92 4.03 0.00 3.23 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 A 8.12 3.95 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 R 7.79 3.91 0.00 1.99 2.15 0.00 2.95 0.00 0.00 3.25 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 77 F 7.98 3.70 0.00 3.08 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 78 A 7.34 2.58 0.59 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 79 A 7.38 3.76 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 80 Q 7.78 3.68 0.00 1.99 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.75 0.00 0.00 0.00 0.00 0.00 2.09 2.26 0.00 81 L 7.06 3.72 0.00 0.91 1.51 -0.22 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 82 R 7.80 3.93 0.00 1.99 1.96 0.00 3.22 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.81 0.00 83 A 8.20 4.05 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 84 H 8.17 4.50 0.00 3.05 3.32 0.00 5.79 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.37 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 0.00 0.00 0.00 86 V 7.80 3.89 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.09 0.00 0.00 87 R 8.85 4.29 0.00 2.02 1.89 0.00 3.27 0.00 0.00 3.38 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.73 0.00 88 E 9.05 5.52 0.00 1.86 1.71 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 1.87 1.97 0.00 89 W 8.16 4.72 0.00 3.42 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 90 K 6.90 4.08 0.00 1.22 0.74 0.00 1.18 0.00 0.00 0.61 0.00 0.00 3.08 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.30 0.77 7.81 91 Q 8.11 4.46 0.00 2.17 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 92 N 8.57 4.71 0.00 3.10 2.89 0.00 0.00 6.80 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 93 R 8.51 4.63 0.00 1.88 1.90 0.00 2.94 0.00 0.00 3.18 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.55 0.00 94 S 7.79 4.83 0.00 4.14 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 95 E 8.73 3.76 0.00 2.06 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 2.42 2.32 0.00 96 G 8.68 4.09 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 0.00 97 D 8.06 4.31 0.00 1.82 1.54 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 98 S 8.44 5.08 0.00 4.00 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 99 F 9.62 4.95 0.00 3.26 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 0.00 100 Y 8.23 5.13 0.00 2.39 1.43 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 0.00 101 F 9.08 5.69 0.00 3.45 3.01 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 0.00 102 L 8.97 5.27 0.00 1.67 1.65 0.99 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 103 D 8.57 4.00 0.00 2.08 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 P 0.00 4.12 0.00 1.93 2.05 0.00 3.06 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 105 D 8.43 4.57 0.00 2.62 2.67 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 0.00 0.00 0.00 106 G 8.32 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 0.00 107 H 7.87 4.24 0.00 3.45 3.53 0.00 5.61 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 R 8.30 4.36 0.00 1.16 0.66 0.00 2.21 0.00 0.00 2.51 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.85 0.00 109 L 8.85 5.56 0.00 0.70 1.41 1.29 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 110 E 8.41 5.22 0.00 2.05 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 2.08 1.47 0.00 111 A 9.88 5.34 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 0.00 112 H 9.33 5.28 0.00 3.37 3.17 0.00 5.77 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.92 4.52 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.82 0.00 0.00 114 G 8.32 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 0.00 115 D 8.51 4.67 0.00 2.88 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 0.00 116 L 8.66 3.98 0.00 1.82 1.73 0.97 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 117 R 8.09 3.89 0.00 1.92 2.08 0.00 3.24 0.00 0.00 3.38 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 118 S 8.67 4.17 0.00 4.11 4.12 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 0.00 119 R 7.93 4.15 0.00 2.12 2.17 0.00 3.37 0.00 0.00 3.35 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.62 0.00 120 L 8.04 4.03 0.00 1.88 1.69 0.97 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 121 A 7.88 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 122 A 7.88 3.96 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 C 8.34 4.06 0.00 3.27 3.04 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 0.00 124 R 8.32 3.66 0.00 1.78 1.77 0.00 2.87 0.00 0.00 2.87 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.50 0.00 125 Q 7.68 4.27 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.16 0.00 0.00 0.00 0.00 0.00 2.49 2.50 0.00 126 A 7.77 4.69 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 0.00 127 P 0.00 4.66 0.00 2.23 2.26 0.00 3.42 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.03 0.00 128 Y 8.02 4.52 0.00 2.97 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 0.00 129 A 8.69 4.09 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 0.00 130 G 8.90 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 0.00 0.00 0.00 131 M 7.83 4.06 0.00 1.84 1.96 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.51 0.00 132 R 7.87 4.43 0.00 1.67 1.69 0.00 3.40 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.52 0.00 133 F 8.37 4.61 0.00 3.02 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 0.00 134 A 8.56 4.20 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