NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.5210 8.3193 116.8012 58.5219 63.3966 173.5291 2 S 4.0627 8.8165 120.6946 60.3059 63.4082 172.3266 3 N 5.1709 8.1910 117.9765 50.4403 42.5191 175.5411 4 N 4.4571 8.6656 115.7832 56.1311 39.4042 175.3157 5 N 4.7980 8.0443 114.3794 53.6346 39.3010 174.9029 6 S 4.7565 7.7070 116.4408 58.0318 64.7677 174.8013 7 F 3.9081 9.3626 128.3037 61.7313 39.1600 177.7612 8 S 4.3321 8.1874 114.0552 61.6854 62.5678 176.7081 9 A 4.0272 7.9933 122.6729 55.4634 18.2455 179.6917 10 I 3.7280 7.6112 117.8790 64.4577 37.1532 178.0283 11 Y 3.8406 8.4551 120.8561 60.4646 38.5908 178.1367 12 K 4.0662 8.4732 120.7183 59.5199 32.4603 178.5736 13 E 3.9086 7.9827 118.4699 59.2332 29.4149 179.2132 14 W 3.2320 7.9613 128.3389 60.0918 30.5703 177.2801 15 Y 3.3389 8.3359 120.0747 60.7095 38.0464 178.1457 16 E 3.3201 8.0755 117.8492 58.7495 29.6572 178.7094 17 H 3.9713 7.4262 118.4170 59.0812 29.9625 177.3974 18 K 3.2180 7.3327 119.8959 58.0282 31.2717 179.0830 19 K 3.7610 7.0694 119.4815 58.6274 32.0215 177.6095 20 Q 4.2008 7.1210 115.7025 55.8390 28.9037 175.7664 21 V 3.9307 7.2190 119.5097 64.0357 32.9238 176.1659 22 W 4.7842 7.2466 117.0227 55.6768 30.2894 176.4682 23 S 4.4537 8.5484 115.7770 58.1570 64.0832 175.8050 24 V 3.7777 8.5811 126.1664 65.2705 31.0521 179.0172 25 G 3.6155 8.1263 106.0080 47.3836 0.0000 174.9317 26 Y 4.0311 8.0923 121.2143 60.3736 38.9253 177.6585 27 A 4.1618 8.8840 122.0124 55.5711 18.5129 179.5609 28 T 3.9532 8.2434 114.3316 67.1882 68.6134 176.6588 29 E 4.0393 8.0495 119.2550 58.4461 29.5841 179.0778 30 L 3.6742 8.0456 121.2038 58.0067 42.0094 178.8502 31 A 4.5028 8.1037 122.1386 54.4425 18.1648 179.3750 32 K 3.8758 8.1688 118.5788 60.0105 32.2556 178.9369 33 M 4.1199 8.3189 117.2692 58.0355 31.2244 178.3989 34 F 4.0257 8.2874 121.6148 61.3198 39.7407 176.7902 35 D 4.3739 9.0058 119.5794 57.4908 40.3966 178.3624 36 D 4.2765 8.1709 117.5049 56.9443 41.2714 177.1270 37 D 4.4267 7.7057 117.9269 56.0153 41.7741 178.9848 38 I 3.4542 7.8750 120.5379 63.9060 37.0453 178.2780 39 L 3.9313 7.4826 119.3371 57.5422 41.3439 177.9458 40 P 4.2846 0.0000 0.0000 64.7805 31.2008 177.7087 41 I 4.1744 6.6284 117.3557 62.2283 38.1885 176.4834 42 I 4.5265 8.1400 109.3227 60.0387 39.3008 177.1540 43 G 3.5499 8.0914 111.7951 49.1218 0.0000 175.7539 44 G 3.9800 7.9324 105.8630 45.2050 0.0000 173.4496 45 L 4.4586 7.5886 120.9393 53.4489 43.1231 175.7050 46 E 4.7380 8.4116 119.5277 55.7255 30.2354 178.2265 47 I 4.1558 8.8918 123.8546 63.6834 38.1800 176.5008 48 Q 4.3988 8.1430 119.0301 56.7923 29.3537 175.1153 49 D 4.9633 8.3736 116.1747 54.2325 41.5292 175.1557 50 I 4.1975 7.7205 118.3693 60.0543 38.2418 175.6625 51 E 4.2563 8.7756 124.9901 55.2313 30.4894 176.0873 52 P 4.2337 0.0000 0.0000 66.7357 31.0748 178.7603 53 M 4.1704 7.9792 117.4672 57.6451 31.9812 178.5993 54 Q 3.9487 7.9256 118.7627 58.6712 28.8443 178.1714 55 L 3.9268 7.8083 121.0058 57.9681 42.1325 178.6178 56 L 3.9631 7.8689 120.0869 57.8115 41.8924 178.5180 57 E 3.7132 8.2266 119.6555 58.7624 29.3570 178.9940 58 V 3.4322 7.5188 118.4308 66.0710 31.6685 178.0794 59 I 3.8096 7.5198 119.2041 64.2633 36.8162 178.2780 60 R 3.7334 8.4130 120.0867 59.3607 29.6296 178.2145 61 R 3.6908 7.7662 117.4385 59.6826 30.2965 178.1340 62 F 4.2711 7.8573 116.9160 60.3865 38.9664 177.5378 63 E 3.9836 8.7874 119.3892 59.3723 29.2297 178.3832 64 D 4.3526 8.1770 117.0236 56.8185 41.3442 177.5881 65 R 4.2379 7.6672 116.2667 56.6311 30.4778 177.2762 66 G 3.9564 8.3406 107.5214 45.1855 0.0000 175.3268 67 A 4.3509 7.6263 122.4273 51.4272 16.3777 177.3675 68 M 3.9639 8.0440 122.8289 58.4727 32.8336 177.3044 69 E 3.9736 8.0960 118.2619 59.5861 29.6396 179.4737 70 R 3.7389 7.8944 117.3588 58.7193 30.1932 178.7672 71 A 3.8919 8.1347 120.9186 55.3331 18.4161 179.5264 72 N 4.3258 8.2298 114.9858 56.1800 38.4713 177.6714 73 K 4.0458 8.2977 121.4110 59.0241 32.2218 178.7772 74 A 3.9285 8.0352 121.6672 55.1621 18.2706 179.3133 75 R 3.8999 7.8396 117.0129 59.8035 29.9777 178.5750 76 R 3.9783 8.4145 117.9420 59.7840 30.1091 179.3829 77 R 3.9614 8.5307 117.8445 59.1423 30.0823 179.0104 78 C 4.4806 8.9037 117.3069 63.0283 28.1904 176.4165 79 G 4.0538 8.5677 107.4371 47.7832 0.0000 175.2855 80 E 3.9785 8.4549 121.9267 59.1827 29.5650 179.1745 81 V 3.0506 7.6084 118.6536 65.5828 31.4895 177.8775 82 F 4.1809 8.4499 117.9966 60.6550 38.7806 177.5493 83 R 3.9293 8.5126 118.5863 59.7134 29.8961 177.9100 84 Y 3.9316 8.0425 119.0770 60.6593 38.7436 177.9359 85 A 4.0699 8.4300 121.9760 55.0935 18.0140 179.7162 86 I 4.5868 7.6796 119.8795 63.9404 36.9216 178.8165 87 V 3.5460 7.5641 118.5880 65.9796 31.5011 177.4394 88 T 4.0460 7.7552 110.3401 62.0459 67.6356 173.9422 89 G 3.7736 7.6240 107.0976 47.6726 0.0000 174.8765 90 R 4.3539 8.7111 119.4202 56.3302 31.9226 177.3554 91 A 4.8078 7.6864 119.4552 50.1786 21.7705 176.2331 92 K 4.1875 8.8238 122.6281 57.3836 33.2156 176.1957 93 Y 4.8528 7.8938 118.1665 55.2888 41.5766 173.7636 94 N 4.6632 7.5353 123.2310 50.0063 39.8720 173.2978 95 P 4.9644 0.0000 0.0000 62.4634 32.2672 178.9208 96 A 3.7324 7.3694 123.1238 55.7028 18.3673 178.2409 97 P 4.2987 0.0000 0.0000 66.1638 31.4198 178.3492 98 D 4.3855 7.8946 118.1883 56.7677 40.6678 178.0649 99 L 3.9051 7.8263 120.8883 58.2455 42.0414 179.0243 100 A 3.9670 7.5973 119.1483 55.1743 18.2988 179.1398 101 D 4.2546 8.1115 116.4371 57.3589 41.3058 178.3652 102 A 4.0482 8.5667 121.7887 55.3742 18.1785 179.3135 103 M 4.0026 8.0881 115.9601 58.4810 32.0444 178.1630 104 K 4.2288 8.3621 120.1299 59.4548 32.5507 178.8727 105 G 3.7764 8.6410 105.2558 46.6923 0.0000 174.8036 106 Y 4.1816 8.0837 121.8956 60.2203 38.5604 177.1936 107 R 4.1830 7.5214 115.9895 57.2167 30.2387 177.5685 108 K 4.2328 7.7592 117.9696 56.5115 32.5431 177.0103 109 K 4.0648 7.4665 119.9395 58.0490 32.8856 177.0242 110 N 4.4884 7.0686 118.8152 51.8529 36.9808 174.8792 111 L 4.1970 7.7846 122.5105 54.2869 42.8113 176.8792 112 E 4.4351 8.3315 119.4666 56.0440 31.4435 176.2701 113 H 4.5726 8.5663 114.2964 56.9712 30.2618 174.9741 114 H 4.7884 7.7816 114.2194 54.3295 32.4748 172.2169 115 H 5.2955 8.3784 118.5811 54.1689 30.9333 174.2981 116 H 4.6560 8.6063 115.3596 56.4059 29.0127 174.5601 117 H 5.2151 7.8494 115.4559 54.1944 32.1867 173.3622 118 H 4.4624 8.5826 116.2847 56.2510 29.4791 173.8276 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 S 8.32 4.52 0.00 3.91 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 2 S 8.82 4.06 0.00 4.08 4.01 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 3 N 8.19 5.17 0.00 2.77 2.78 0.00 0.00 7.25 6.42 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 4 N 8.67 4.46 0.00 2.71 2.86 0.00 0.00 6.90 7.82 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 5 N 8.04 4.80 0.00 2.91 2.86 0.00 0.00 7.22 7.68 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 6 S 7.71 4.76 0.00 3.96 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 7 F 9.36 3.91 0.00 3.00 3.21 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 8 S 8.19 4.33 0.00 4.00 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 9 A 7.99 4.03 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 10 I 7.61 3.73 1.61 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 1.42 0.74 0.90 0.00 0.00 11 Y 8.46 3.84 0.00 2.84 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 12 K 8.47 4.07 0.00 2.06 2.03 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.12 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.61 1.64 7.81 13 E 7.98 3.91 0.00 2.21 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 0.00 2.37 2.59 0.00 14 W 7.96 3.23 0.00 2.40 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 8.34 3.34 0.00 2.42 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 16 E 8.08 3.32 0.00 1.76 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 2.15 2.53 0.00 17 H 7.43 3.97 0.00 3.21 2.95 0.00 5.58 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 K 7.33 3.22 0.00 0.79 0.74 0.00 0.61 0.00 0.00 0.87 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.30 0.21 7.81 19 K 7.07 3.76 0.00 1.08 1.50 0.00 1.65 0.00 0.00 1.34 0.00 0.00 2.61 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.24 1.29 7.81 20 Q 7.12 4.20 0.00 1.90 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.89 6.38 0.00 0.00 0.00 0.00 0.00 2.18 2.25 0.00 21 V 7.22 3.93 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 0.58 0.00 0.00 0.62 0.00 0.00 22 W 7.25 4.78 0.00 3.56 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 23 S 8.55 4.45 0.00 3.98 3.84 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 24 V 8.58 3.78 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 0.83 0.00 0.00 0.96 0.00 0.00 25 G 8.13 3.62 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 0.00 0.00 0.00 26 Y 8.09 4.03 0.00 3.06 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 27 A 8.88 4.16 1.63 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 0.00 0.00 28 T 8.24 3.95 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 29 E 8.05 4.04 0.00 1.96 1.96 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 2.33 2.44 0.00 30 L 8.05 3.67 0.00 0.81 1.57 -0.06 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 31 A 8.10 4.50 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.17 3.88 0.00 1.95 1.92 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.46 7.81 33 M 8.32 4.12 0.00 2.38 2.44 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.58 0.00 34 F 8.29 4.03 0.00 3.35 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 35 D 9.01 4.37 0.00 2.90 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 36 D 8.17 4.28 0.00 2.77 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 37 D 7.71 4.43 0.00 2.30 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 0.00 0.00 0.00 38 I 7.87 3.45 1.16 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.01 0.37 0.00 0.00 39 L 7.48 3.93 0.00 1.95 1.68 0.94 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.28 0.00 1.90 2.04 0.00 3.54 0.00 0.00 3.70 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 41 I 6.63 4.17 1.79 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.63 0.93 0.00 0.00 42 I 8.14 4.53 1.65 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.30 0.79 0.00 0.00 43 G 8.09 3.55 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 0.00 0.00 0.00 44 G 7.93 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 45 L 7.59 4.46 0.00 1.89 1.63 0.92 0.96 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 46 E 8.41 4.74 0.00 2.10 1.93 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 2.44 2.34 0.00 47 I 8.89 4.16 1.90 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.65 1.04 0.00 0.00 48 Q 8.14 4.40 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.16 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 49 D 8.37 4.96 0.00 2.64 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 I 7.72 4.20 2.08 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 1.45 1.05 0.95 0.00 0.00 51 E 8.78 4.26 0.00 2.14 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 2.35 2.36 0.00 52 P 0.00 4.23 0.00 2.27 2.33 0.00 3.71 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.10 0.00 53 M 7.98 4.17 0.00 2.10 2.16 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 2.71 2.67 0.00 54 Q 7.93 3.95 0.00 2.31 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.79 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 55 L 7.81 3.93 0.00 1.79 1.80 0.99 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 56 L 7.87 3.96 0.00 1.81 1.77 0.57 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 57 E 8.23 3.71 0.00 2.16 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 2.21 2.23 0.00 58 V 7.52 3.43 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 0.87 0.00 0.00 0.81 0.00 0.00 59 I 7.52 3.81 1.95 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 1.40 0.47 0.88 0.00 0.00 60 R 8.41 3.73 0.00 1.96 1.87 0.00 2.80 0.00 0.00 2.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.53 0.00 61 R 7.77 3.69 0.00 1.70 1.89 0.00 3.13 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.15 0.00 62 F 7.86 4.27 0.00 3.03 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 63 E 8.79 3.98 0.00 2.06 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 2.31 2.33 0.00 64 D 8.18 4.35 0.00 2.72 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 65 R 7.67 4.24 0.00 1.98 1.96 0.00 3.13 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.79 0.00 66 G 8.34 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 0.00 0.00 0.00 67 A 7.63 4.35 1.44 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 0.00 0.00 0.00 68 M 8.04 3.96 0.00 2.15 2.08 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.70 0.00 69 E 8.10 3.97 0.00 2.04 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 2.40 2.40 0.00 70 R 7.89 3.74 0.00 1.79 1.61 0.00 3.22 0.00 0.00 3.40 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 71 A 8.13 3.89 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.23 4.33 0.00 2.87 2.87 0.00 0.00 7.01 7.16 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 73 K 8.30 4.05 0.00 1.97 1.80 0.00 1.58 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.51 7.81 74 A 8.04 3.93 1.16 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 0.00 0.00 75 R 7.84 3.90 0.00 1.93 2.15 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 1.67 1.72 0.00 76 R 8.41 3.98 0.00 2.05 2.06 0.00 3.22 0.00 0.00 3.24 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.96 0.00 77 R 8.53 3.96 0.00 2.06 1.95 0.00 3.58 0.00 0.00 3.32 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.04 0.00 78 C 8.90 4.48 0.00 3.28 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 79 G 8.57 4.05 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 0.00 0.00 0.00 80 E 8.45 3.98 0.00 2.22 1.93 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 2.72 2.08 0.00 81 V 7.61 3.05 1.63 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 0.16 0.00 0.00 0.08 0.00 0.00 82 F 8.45 4.18 0.00 3.27 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 83 R 8.51 3.93 0.00 2.06 2.22 0.00 3.18 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 1.69 1.74 0.00 84 Y 8.04 3.93 0.00 3.24 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 85 A 8.43 4.07 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 0.00 0.00 86 I 7.68 4.59 2.04 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 1.61 0.81 0.93 0.00 0.00 87 V 7.56 3.55 1.93 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 0.62 0.00 0.00 0.97 0.00 0.00 88 T 7.76 4.05 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 1.28 0.00 0.00 89 G 7.62 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 90 R 8.71 4.35 0.00 1.91 2.01 0.00 3.14 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.57 0.00 91 A 7.69 4.81 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 92 K 8.82 4.19 0.00 1.77 1.91 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.45 7.81 93 Y 7.89 4.85 0.00 2.86 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 94 N 7.54 4.66 0.00 2.01 2.73 0.00 0.00 5.88 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 95 P 0.00 4.96 0.00 2.14 2.21 0.00 2.89 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.96 0.00 96 A 7.37 3.73 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 0.00 0.00 0.00 0.00 0.00 97 P 0.00 4.30 0.00 2.31 2.33 0.00 3.51 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.10 0.00 98 D 7.89 4.39 0.00 2.86 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 99 L 7.83 3.91 0.00 1.76 1.88 0.92 0.84 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 0.00 100 A 7.60 3.97 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 0.00 101 D 8.11 4.25 0.00 2.84 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 0.00 102 A 8.57 4.05 1.38 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 0.00 103 M 8.09 4.00 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.56 0.00 104 K 8.36 4.23 0.00 1.93 2.04 0.00 1.69 0.00 0.00 1.66 0.00 0.00 3.10 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.46 7.81 105 G 8.64 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 0.00 106 Y 8.08 4.18 0.00 3.28 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 0.00 107 R 7.52 4.18 0.00 1.99 1.96 0.00 3.23 0.00 0.00 3.27 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 108 K 7.76 4.23 0.00 1.81 1.79 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.40 7.81 109 K 7.47 4.06 0.00 1.44 1.24 0.00 1.73 0.00 0.00 1.55 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.14 1.25 7.81 110 N 7.07 4.49 0.00 2.56 2.74 0.00 0.00 7.05 8.05 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 0.00 111 L 7.78 4.20 0.00 1.56 1.58 0.90 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 112 E 8.33 4.44 0.00 2.07 1.93 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 2.40 2.38 0.00 113 H 8.57 4.57 0.00 3.07 3.27 0.00 5.84 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 H 7.78 4.79 0.00 3.02 3.08 0.00 5.87 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 0.00 115 H 8.38 5.30 0.00 3.10 3.19 0.00 5.74 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 0.00 116 H 8.61 4.66 0.00 3.01 3.33 0.00 5.64 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 7.85 5.22 0.00 3.09 3.18 0.00 5.66 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 0.00 118 H 8.58 4.46 0.00 3.10 3.16 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00