NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.2134 8.1744 110.9382 61.5601 69.9756 173.2785 2 D 4.3756 8.4001 122.9234 51.9096 42.6324 173.2431 3 L 5.3148 8.4713 127.7239 54.1410 42.8605 178.0697 4 S 4.1882 8.1353 118.0627 61.2888 62.7808 176.3801 5 A 3.9860 7.9631 124.0284 55.1815 18.3209 179.3785 6 Q 4.0091 8.1423 116.0797 59.1240 28.8760 178.7783 7 K 3.8806 8.3733 119.5178 59.8258 31.9641 179.2496 8 R 3.9353 7.9213 118.3451 59.2445 29.9477 178.6461 9 L 4.0122 8.0065 118.6628 57.6762 41.6632 179.1671 10 A 4.0412 9.0744 121.6887 55.2671 18.3051 179.2421 11 A 3.9995 8.1086 119.2150 55.6663 18.4026 179.4423 12 D 4.2882 7.9678 116.6155 57.1339 41.1210 178.8109 13 V 3.6316 7.9666 118.5329 64.8109 31.3906 177.4881 14 L 4.0373 8.5167 118.9278 54.7501 42.1940 176.1570 15 D 4.3802 7.5439 117.1647 54.2312 39.3851 172.3032 16 V 4.4591 8.3315 118.4033 61.0112 35.4063 173.6992 17 G 3.7448 8.6002 113.4276 45.4638 0.0000 174.6499 18 K 3.4694 8.9267 123.2678 59.7570 32.1659 178.1051 19 N 4.5921 8.0944 112.9930 54.5266 38.8401 175.2839 20 R 4.5775 8.9136 118.0671 56.1741 32.2671 176.5956 21 V 4.3752 7.4429 112.8603 60.7964 32.5151 175.4634 22 W 4.7810 9.9140 135.0000 55.5572 33.6993 173.9947 23 F 5.0089 7.9405 125.0771 55.1899 40.7030 174.5929 24 N 3.1400 7.8983 123.4516 53.1043 38.9704 173.8103 25 P 4.1447 0.0000 0.0000 65.7364 31.6017 177.6130 26 E 4.1867 8.6338 116.5928 58.1874 29.6713 177.3211 27 R 4.6687 7.7380 119.1156 55.4059 31.3774 178.1317 28 Q 3.9885 8.3839 119.2122 58.9206 28.6466 178.1413 29 G 3.6533 8.0249 106.2152 48.1761 0.0000 175.3029 30 D 4.3360 7.8662 119.7291 56.9854 41.2628 178.5213 31 I 3.6532 7.9028 120.2261 63.8940 36.7308 178.2798 32 A 3.9521 8.1784 121.5252 55.2884 18.3367 179.1419 33 D 4.5413 7.6744 115.3655 55.1900 40.9447 176.6688 34 A 4.0606 7.2912 123.2023 52.3970 18.4317 176.8165 35 I 4.3151 8.8716 124.2715 61.9155 39.7116 176.8926 36 T 4.6368 7.6590 109.4286 59.7192 72.3113 175.3585 37 R 3.9317 8.4230 120.7525 59.5172 30.0442 178.9168 38 E 3.9068 8.1126 118.5078 59.3786 29.8570 178.2648 39 D 4.3510 8.0691 118.9275 57.3776 40.8323 179.1403 40 V 3.5057 7.7101 118.4579 66.2477 31.6440 178.1709 41 R 3.9308 8.1729 117.9149 59.2945 29.7535 178.7584 42 E 3.8853 8.1711 118.9722 59.4043 29.6689 178.9871 43 L 3.9605 7.7882 118.3682 57.3349 41.4662 179.8159 44 V 3.8718 7.7392 119.9935 65.6430 31.3097 177.7516 45 D 4.3992 7.8214 117.1960 57.4325 40.8337 178.2549 46 E 4.2256 8.3035 116.4965 56.7040 29.4004 177.8395 47 G 3.9670 8.1620 107.1855 46.0497 0.0000 174.7498 48 A 4.3013 8.3822 124.1951 53.6520 19.4641 178.2198 49 I 5.1602 7.8431 116.1236 59.8997 40.4869 175.1384 50 Q 4.7991 9.8067 124.2975 54.5114 34.1592 173.3160 51 A 5.2640 8.4053 121.5028 50.0411 20.7807 176.8258 52 K 4.1884 9.2701 122.8945 56.4760 32.9989 176.9196 53 D 4.6603 8.4959 121.9341 53.4408 41.9564 176.1750 54 K 4.3885 8.2282 121.2294 55.0065 33.9970 176.7163 55 K 4.1444 8.5546 124.3858 56.3817 32.8645 175.8985 56 G 4.1872 8.1225 110.7292 43.4075 0.0000 172.3744 57 N 4.4311 8.6993 121.4318 52.9717 39.1801 175.1440 58 S 4.2600 8.5944 119.4592 58.9269 63.5945 174.7506 59 R 4.6472 8.5492 123.2076 56.2379 30.4256 178.5402 60 G 3.5766 7.9518 106.9975 48.1495 0.0000 176.2256 61 R 3.9731 8.0702 120.4249 58.4686 30.0677 179.0632 62 A 3.9888 7.9054 120.1335 55.1008 18.4209 179.6247 63 R 3.8460 7.8726 116.5892 59.4299 30.1911 178.7864 64 E 3.9175 7.9520 117.9197 59.6677 29.5209 179.3204 65 R 3.9006 7.7519 117.7834 59.7952 30.0032 178.2567 66 Q 4.0197 8.4304 117.9366 59.0255 28.7284 179.2664 67 K 3.9483 8.2923 119.3343 59.5425 32.1936 179.2262 68 K 3.8958 8.0524 118.5772 60.0569 32.0303 179.5208 69 R 4.8260 8.5730 118.9931 58.4324 29.8098 178.8118 70 A 4.1441 8.1920 120.1256 54.5036 18.4885 178.0508 71 Y 4.4518 7.9401 116.1362 57.9808 39.1398 175.9579 72 G 3.9369 8.0610 107.3010 46.2432 0.0000 173.1481 73 H 4.7727 8.8298 117.4149 54.8934 30.7069 174.3309 74 Q 3.8519 8.6355 116.1798 57.2946 25.6286 174.3976 75 K 4.6277 7.8888 111.9087 56.0392 33.9807 177.3216 76 G 3.8524 8.1016 108.3160 44.6292 0.0000 175.0731 77 A 3.9304 8.6054 121.2341 55.1008 18.2936 179.4678 78 G 3.8688 8.0368 101.8438 46.7339 0.0000 173.9811 79 S 4.6428 8.0575 115.0316 58.3689 64.6620 174.7513 80 R 4.3493 7.3261 118.6925 55.4317 30.7376 176.0307 81 K 4.3574 8.5622 120.4823 57.3449 34.5587 176.9267 82 G 3.8890 7.8158 105.6669 44.0910 0.0000 172.9998 83 K 4.0457 8.3436 121.0617 55.8409 33.2255 177.6418 84 A 4.1122 8.8038 124.1759 55.3927 18.1157 180.0973 85 G 3.7575 8.0293 100.4207 45.8611 0.0000 174.4835 86 A 4.3369 7.7157 122.5195 54.4910 19.2765 179.4480 87 R 4.2795 7.8185 115.6483 57.5276 29.9410 176.9192 88 Q 4.1922 7.4334 119.8828 53.3900 31.2386 172.7020 89 N 4.4636 8.8463 124.7559 53.6446 39.5277 174.7261 90 S 4.1638 8.7612 124.7870 61.5990 62.9022 176.3759 91 K 3.9399 8.1691 122.5962 59.3099 32.0472 178.4168 92 E 4.8449 8.4307 120.4401 58.9547 29.5428 178.1125 93 D 4.3942 8.5645 118.6156 56.8594 41.2006 178.0259 94 W 4.2260 8.2904 129.1413 60.2373 30.7563 177.9318 95 E 3.7020 8.3171 118.7680 59.4161 28.8757 178.6513 96 S 3.9928 7.7832 112.5770 61.7141 62.2666 176.2256 97 R 3.7507 8.0656 120.0678 59.5413 30.1375 178.9893 98 I 3.1342 7.3155 118.2643 63.9143 37.6066 178.2332 99 R 3.8439 7.6490 118.6216 58.7225 29.8479 178.4891 100 A 3.9433 7.6956 120.5650 55.5367 18.5741 179.6712 101 Q 3.9208 8.2239 116.5318 59.2842 28.5352 179.4737 102 R 4.1860 7.6121 117.7391 59.0130 30.3152 178.8364 103 T 4.1279 8.0119 116.1439 66.4780 68.4996 176.2256 104 K 3.8309 8.3176 121.6259 59.8557 32.1002 178.4769 105 L 4.1456 8.1943 118.6358 58.0921 41.4907 179.8459 106 R 3.9082 7.9672 118.4316 59.2328 30.0134 178.4939 107 E 3.9709 8.2725 118.3893 59.5863 29.6137 179.1272 108 L 4.1951 8.0687 118.4007 57.8178 41.6085 179.7704 109 R 3.9373 7.7517 118.2329 59.5828 29.8676 178.2795 110 D 4.2821 7.4329 117.2299 57.2553 40.9028 178.1682 111 E 4.0241 8.4592 119.1429 57.8967 29.6072 177.2267 112 G 4.0617 8.0707 106.2397 45.8080 0.0000 174.6488 113 T 3.9946 7.8577 115.3247 65.9178 68.5663 174.0579 114 L 4.8306 7.6318 119.4842 52.5851 44.3314 176.3727 115 S 4.4848 8.3748 117.0734 57.4595 64.7477 174.8927 116 S 4.7752 8.3640 117.6470 57.5036 61.0676 172.5563 117 S 4.8191 7.5987 117.2059 59.1782 69.9971 177.9994 118 Q 4.1060 8.5159 120.7930 58.3373 28.2926 177.8259 119 Y 4.1283 8.0914 120.3379 60.6748 38.9541 177.4785 120 R 3.7773 8.2022 119.0601 59.6113 29.5965 177.3820 121 D 4.3929 8.2263 117.4448 57.6459 41.1927 178.5125 122 L 4.2188 8.2313 119.3309 57.8901 41.6382 178.6612 123 Y 3.9696 8.6165 120.1947 61.0680 38.3574 178.2365 124 D 4.3932 8.4539 119.5708 57.1344 40.7916 178.8683 125 K 3.9315 7.7258 118.1293 58.7696 31.9946 179.3436 126 A 3.8209 7.9464 121.5549 54.9557 18.2027 179.6644 127 G 3.9339 7.7638 102.0456 46.4321 0.0000 174.8591 128 G 3.9430 7.3595 105.1952 43.4731 0.0000 173.5984 129 G 3.9798 8.3980 108.7691 46.8076 0.0000 175.3428 130 E 3.8286 8.0395 121.4290 57.2037 29.8252 177.4208 131 F 5.0386 7.1322 116.9554 55.3768 40.8350 174.4926 132 D 4.4607 8.9826 126.9442 56.5812 41.3054 177.2645 133 S 4.9145 7.4643 111.8770 56.0855 66.5719 174.5240 134 V 3.4825 8.4377 117.7239 66.3090 31.1735 177.7434 135 A 4.0902 8.0729 120.1759 55.6754 18.1233 178.9493 136 D 4.3308 7.8608 116.2008 57.3853 41.1702 178.0431 137 L 3.2178 7.6062 120.5331 57.7682 42.0475 178.3934 138 E 3.8719 8.6049 118.6455 59.7136 29.3213 179.6039 139 R 3.8987 7.9978 116.6256 59.6589 30.6582 178.0297 140 Y 4.1673 7.9732 118.8051 60.8585 38.5622 178.0151 141 I 3.7528 7.9394 119.8107 64.3343 37.6819 178.7262 142 D 4.5408 8.1814 120.1176 54.5940 40.0857 176.3274 143 A 3.8858 7.1633 126.4775 52.7323 19.3293 177.5617 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 T 8.17 4.21 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 1.19 0.00 0.00 2 D 8.40 4.38 0.00 2.66 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 3 L 8.47 5.31 0.00 1.91 1.89 0.98 1.00 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 4 S 8.14 4.19 0.00 4.01 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 5 A 7.96 3.99 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 6 Q 8.14 4.01 0.00 2.48 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.77 0.00 0.00 0.00 0.00 0.00 2.50 2.51 0.00 7 K 8.37 3.88 0.00 1.99 1.78 0.00 1.21 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.42 1.41 7.81 8 R 7.92 3.94 0.00 1.86 2.17 0.00 3.10 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 9 L 8.01 4.01 0.00 1.97 1.73 0.93 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 10 A 9.07 4.04 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 11 A 8.11 4.00 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 12 D 7.97 4.29 0.00 2.70 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 13 V 7.97 3.63 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 0.86 0.00 0.00 0.95 0.00 0.00 14 L 8.52 4.04 0.00 1.72 1.80 1.02 1.25 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 15 D 7.54 4.38 0.00 2.79 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 16 V 8.33 4.46 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 0.76 0.00 0.00 0.95 0.00 0.00 17 G 8.60 3.74 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 0.00 0.00 0.00 18 K 8.93 3.47 0.00 1.80 1.86 0.00 1.66 0.00 0.00 1.80 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.49 7.81 19 N 8.09 4.59 0.00 2.70 2.85 0.00 0.00 6.78 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 20 R 8.91 4.58 0.00 1.78 1.95 0.00 3.12 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 21 V 7.44 4.38 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 0.64 0.00 0.00 0.63 0.00 0.00 22 W 9.91 4.78 0.00 3.29 3.17 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 23 F 7.94 5.01 0.00 2.59 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 24 N 7.90 3.14 0.00 2.65 2.53 0.00 0.00 6.76 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 25 P 0.00 4.14 0.00 2.08 2.09 0.00 3.75 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.02 0.00 26 E 8.63 4.19 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 2.37 2.38 0.00 27 R 7.74 4.67 0.00 1.71 1.79 0.00 3.13 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.52 0.00 28 Q 8.38 3.99 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.87 0.00 0.00 0.00 0.00 0.00 2.40 2.59 0.00 29 G 8.02 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 D 7.87 4.34 0.00 2.58 2.68 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 31 I 7.90 3.65 1.73 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.86 0.21 0.00 0.00 32 A 8.18 3.95 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 33 D 7.67 4.54 0.00 2.71 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.29 4.06 1.21 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 0.00 0.00 0.00 0.00 0.00 35 I 8.87 4.32 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.97 0.90 0.00 0.00 36 T 7.66 4.64 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 1.24 0.00 0.00 37 R 8.42 3.93 0.00 1.88 2.04 0.00 3.14 0.00 0.00 3.27 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.71 0.00 38 E 8.11 3.91 0.00 2.07 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 2.37 2.46 0.00 39 D 8.07 4.35 0.00 2.92 2.68 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 40 V 7.71 3.51 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 1.06 0.00 0.00 0.98 0.00 0.00 41 R 8.17 3.93 0.00 1.89 1.99 0.00 3.19 0.00 0.00 3.10 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.91 0.00 42 E 8.17 3.89 0.00 2.19 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 2.51 2.34 0.00 43 L 7.79 3.96 0.00 1.84 1.62 0.77 0.54 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 44 V 7.74 3.87 2.27 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 1.29 0.00 0.00 1.00 0.00 0.00 45 D 7.82 4.40 0.00 2.87 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 46 E 8.30 4.23 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 2.35 2.42 0.00 47 G 8.16 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 48 A 8.38 4.30 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 49 I 7.84 5.16 1.93 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.09 1.20 0.00 0.00 50 Q 9.81 4.80 0.00 2.18 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.75 0.00 0.00 0.00 0.00 0.00 2.40 2.72 0.00 51 A 8.41 5.26 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 52 K 9.27 4.19 0.00 1.77 1.75 0.00 1.50 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.39 7.81 53 D 8.50 4.66 0.00 2.64 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 54 K 8.23 4.39 0.00 1.85 1.81 0.00 1.58 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.41 7.81 55 K 8.55 4.14 0.00 1.73 1.75 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.24 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.44 7.81 56 G 8.12 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 8.70 4.43 0.00 2.70 2.77 0.00 0.00 7.07 7.57 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 58 S 8.59 4.26 0.00 3.86 3.80 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 59 R 8.55 4.65 0.00 1.84 1.91 0.00 3.13 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 60 G 7.95 3.58 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 0.00 61 R 8.07 3.97 0.00 1.86 2.01 0.00 3.13 0.00 0.00 3.34 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.71 0.00 62 A 7.91 3.99 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 63 R 7.87 3.85 0.00 2.05 1.99 0.00 3.28 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.77 0.00 64 E 7.95 3.92 0.00 2.20 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 2.33 2.33 0.00 65 R 7.75 3.90 0.00 1.87 2.16 0.00 3.12 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.88 0.00 66 Q 8.43 4.02 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.52 0.00 67 K 8.29 3.95 0.00 1.95 1.82 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.69 7.81 68 K 8.05 3.90 0.00 2.06 1.95 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.60 1.67 7.81 69 R 8.57 4.83 0.00 2.08 2.00 0.00 3.15 0.00 0.00 3.29 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.65 0.00 70 A 8.19 4.14 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 71 Y 7.94 4.45 0.00 2.95 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 72 G 8.06 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 73 H 8.83 4.77 0.00 3.35 3.29 0.00 5.96 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 Q 8.64 3.85 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.52 0.00 0.00 0.00 0.00 0.00 2.30 2.42 0.00 75 K 7.89 4.63 0.00 1.68 1.73 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.64 7.81 76 G 8.10 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 A 8.61 3.93 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.04 3.87 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 0.00 0.00 0.00 79 S 8.06 4.64 0.00 3.97 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 80 R 7.33 4.35 0.00 1.92 1.85 0.00 3.10 0.00 0.00 3.15 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.76 0.00 81 K 8.56 4.36 0.00 1.64 1.76 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.30 1.45 7.81 82 G 7.82 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 K 8.34 4.05 0.00 1.84 1.69 0.00 1.62 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.50 7.81 84 A 8.80 4.11 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 85 G 8.03 3.76 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 0.00 0.00 0.00 86 A 7.72 4.34 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 87 R 7.82 4.28 0.00 1.94 2.01 0.00 3.16 0.00 0.00 3.15 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.79 0.00 88 Q 7.43 4.19 0.00 2.03 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 7.07 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 89 N 8.85 4.46 0.00 2.81 2.74 0.00 0.00 6.88 7.63 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 90 S 8.76 4.16 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 91 K 8.17 3.94 0.00 1.87 1.98 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.46 1.60 7.81 92 E 8.43 4.84 0.00 2.23 2.12 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 2.40 2.26 0.00 93 D 8.56 4.39 0.00 2.91 2.86 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 94 W 8.29 4.23 0.00 3.51 3.30 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 95 E 8.32 3.70 0.00 2.27 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 2.46 2.73 0.00 96 S 7.78 3.99 0.00 3.87 4.02 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 97 R 8.07 3.75 0.00 1.75 1.86 0.00 3.36 0.00 0.00 3.11 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.82 0.00 98 I 7.32 3.13 0.56 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.29 0.38 0.00 0.00 99 R 7.65 3.84 0.00 2.10 1.90 0.00 3.24 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 100 A 7.70 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 0.00 101 Q 8.22 3.92 0.00 2.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 102 R 7.61 4.19 0.00 2.01 2.13 0.00 3.07 0.00 0.00 3.26 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 103 T 8.01 4.13 4.39 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 1.22 0.00 0.00 104 K 8.32 3.83 0.00 1.96 1.96 0.00 1.55 0.00 0.00 1.65 0.00 0.00 3.15 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.55 7.81 105 L 8.19 4.15 0.00 2.14 2.13 1.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 106 R 7.97 3.91 0.00 2.19 2.19 0.00 3.11 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 107 E 8.27 3.97 0.00 2.14 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 2.33 2.70 0.00 108 L 8.07 4.20 0.00 1.74 1.77 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 109 R 7.75 3.94 0.00 1.60 1.72 0.00 2.64 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.41 0.00 110 D 7.43 4.28 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 0.00 111 E 8.46 4.02 0.00 1.91 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 0.00 2.31 2.32 0.00 112 G 8.07 4.06 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 0.00 0.00 0.00 113 T 7.86 3.99 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 114 L 7.63 4.83 0.00 1.68 1.64 1.04 1.03 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 0.00 115 S 8.37 4.48 0.00 4.02 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 0.00 116 S 8.36 4.78 0.00 4.02 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 0.00 117 S 7.60 4.82 0.00 4.01 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 0.00 118 Q 8.52 4.11 0.00 2.20 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.85 0.00 0.00 0.00 0.00 0.00 2.42 2.55 0.00 119 Y 8.09 4.13 0.00 3.06 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 0.00 120 R 8.20 3.78 0.00 2.02 2.10 0.00 3.26 0.00 0.00 3.27 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.98 0.00 121 D 8.23 4.39 0.00 2.91 2.91 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 0.00 122 L 8.23 4.22 0.00 2.00 1.84 1.01 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 123 Y 8.62 3.97 0.00 2.38 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 D 8.45 4.39 0.00 2.75 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 K 7.73 3.93 0.00 1.85 1.25 0.00 1.74 0.00 0.00 1.51 0.00 0.00 2.97 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.32 1.55 7.81 126 A 7.95 3.82 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 0.00 127 G 7.76 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 0.00 128 G 7.36 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 0.00 129 G 8.40 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 0.00 0.00 0.00 130 E 8.04 3.83 0.00 1.16 1.12 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 2.13 2.02 0.00 131 F 7.13 5.04 0.00 3.17 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 D 8.98 4.46 0.00 2.72 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 0.00 133 S 7.46 4.91 0.00 3.95 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 0.00 134 V 8.44 3.48 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 0.85 0.00 0.00 0.91 0.00 0.00 135 A 8.07 4.09 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 0.00 136 D 7.86 4.33 0.00 2.80 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 0.00 137 L 7.61 3.22 0.00 1.52 1.69 -0.05 1.23 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 0.00 138 E 8.60 3.87 0.00 2.09 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 2.30 2.59 0.00 139 R 8.00 3.90 0.00 1.97 2.04 0.00 3.19 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 140 Y 7.97 4.17 0.00 3.09 2.91 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 0.00 141 I 7.94 3.75 2.01 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 1.54 0.81 0.90 0.00 0.00 142 D 8.18 4.54 0.00 2.76 2.65 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 0.00 0.00 0.00 0.00 143 A 7.16 3.89 1.23 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 0.00 0.00