NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.5092 8.1776 115.4162 57.7645 64.6682 174.3821 3 V 3.2908 8.1830 121.6399 64.8334 30.3851 176.9030 4 Y 3.9585 8.5750 118.2139 60.9184 37.9756 179.1473 5 D 4.4331 7.9229 118.8110 57.0922 41.2254 178.3297 6 A 4.0648 8.2020 121.2984 55.0691 18.3841 179.5276 7 A 3.8425 8.0207 119.0892 55.1027 18.2310 179.4222 8 A 4.0815 7.4665 116.6252 54.2993 18.5244 178.8783 9 Q 4.3050 7.7010 115.1795 56.1024 29.9829 176.9572 10 L 4.2068 7.4193 121.5854 53.6614 40.2727 177.0726 11 T 4.1904 7.7082 114.7934 60.3415 71.4469 175.0931 12 A 3.9438 8.4104 122.0610 55.7760 18.2675 179.6299 13 D 4.3355 7.9922 116.5888 57.1338 40.9396 179.1107 14 V 3.4908 7.3510 118.1189 65.8463 31.5713 178.1967 15 K 3.8336 8.0847 118.3108 59.2553 31.8000 179.2000 16 K 3.9496 8.0101 119.8178 59.7749 32.1521 178.6557 17 D 4.6232 8.2930 119.1199 57.2194 40.6068 178.8522 18 L 3.7541 7.9273 119.6800 57.7255 41.5829 179.7387 19 R 4.0384 8.0626 117.9514 59.4518 30.2493 178.8277 20 D 4.5068 8.6211 119.3555 57.4471 40.7589 179.0192 21 S 3.0039 8.2538 114.7250 60.5450 63.0859 176.3349 22 W 4.3022 8.6418 132.1407 60.0684 30.2130 177.5745 23 K 3.4711 7.9804 119.0603 59.3603 31.8168 178.4334 24 V 3.7783 6.9549 115.8030 65.5216 31.6962 178.0450 25 I 3.5400 7.6864 119.8732 64.3339 36.9628 178.2358 26 G 2.2800 7.3307 106.9587 45.9381 0.0000 174.7185 27 S 4.0644 7.2440 116.4001 60.5554 63.1576 174.0411 28 D 4.7277 7.2052 118.3753 51.1178 40.9604 175.7260 29 K 3.8151 8.0418 123.1802 58.6683 32.4395 178.2756 30 K 4.0116 7.9835 119.4042 59.4214 32.2940 178.8684 31 G 3.7468 8.0455 106.6360 47.5982 0.0000 175.2941 32 N 4.4748 8.3408 119.8007 55.3085 38.5743 178.0234 33 G 3.5185 8.1514 107.5717 47.8399 0.0000 176.0999 34 V 3.6849 8.2078 122.1988 64.8676 31.4821 177.9761 35 A 4.0007 7.9286 122.1401 54.2356 18.1822 179.3136 36 L 3.7253 7.8996 118.8376 58.5962 42.2209 179.2423 37 M 3.4954 7.6966 118.4666 58.4095 31.9049 178.9433 38 T 3.9541 7.9013 109.9678 65.0989 68.7511 176.7344 39 T 3.9710 7.7811 118.6501 66.0150 68.3411 176.5495 40 L 3.8177 7.4469 122.3119 58.2927 41.5946 179.2101 41 F 4.5267 7.7687 117.2222 60.1396 38.5238 177.6917 42 A 4.0962 7.7032 120.0113 55.1672 18.5115 179.0120 43 D 4.6187 8.2822 115.9890 55.7073 42.6466 176.9286 44 N 5.2458 8.2999 115.9940 49.2393 39.5598 174.8402 45 Q 4.3655 8.4753 121.7657 57.9706 29.2325 178.1039 46 E 4.1509 8.2981 118.0918 58.7621 29.8274 178.3025 47 T 4.6286 8.2848 110.3066 63.4577 69.3103 176.6389 48 I 3.7917 7.9278 123.3801 64.3905 36.7970 178.2021 49 G 3.5503 8.0225 105.4274 47.8896 0.0000 174.7374 50 Y 4.3412 7.7109 116.9430 59.3590 38.2679 176.2183 51 F 4.9808 8.1478 119.5383 56.6745 40.1669 178.0705 52 K 3.9155 8.3266 122.6027 59.6297 32.1583 179.3916 53 R 3.9550 8.1038 117.6389 59.3272 30.0072 177.4802 54 L 4.1622 7.8252 116.7268 55.8748 42.6509 178.8297 55 G 3.8459 7.7359 105.5246 45.8417 0.0000 176.1010 56 D 4.4691 8.4337 122.8446 53.4615 41.0920 176.6573 57 V 3.6008 8.0774 127.4177 65.3103 31.4508 177.2706 58 S 4.3113 7.9760 112.8369 60.7437 62.6096 175.9802 59 Q 4.1053 8.0229 122.2211 56.4552 28.6957 177.2477 60 G 3.9311 8.5760 108.5637 46.2511 0.0000 176.5292 61 M 3.8627 9.0314 122.4905 58.3401 31.8905 176.9522 62 A 4.0508 7.5404 119.0621 53.5727 18.9680 177.1684 63 N 4.6343 8.2619 115.8555 52.5327 39.5250 175.0542 64 D 4.3815 8.6669 128.9641 57.5504 41.0797 178.9641 65 K 4.0163 8.1096 118.4716 59.2705 32.0562 179.0538 66 L 4.0256 8.3083 120.7668 58.1246 42.0177 179.0186 67 R 3.9956 8.3377 118.9656 59.2175 30.0974 178.6851 68 G 3.6564 8.3434 105.7524 47.9220 0.0000 175.8878 69 V 3.7118 7.9638 121.0506 65.6839 31.5462 178.2496 70 S 4.1300 8.4358 115.2726 61.6585 62.5484 176.8399 71 I 3.8980 7.9817 122.4012 64.8395 36.9809 178.6323 72 T 4.0843 7.9814 116.3928 66.5530 68.2137 176.3289 73 L 4.1062 8.3769 122.5945 58.6362 42.0939 179.0720 74 M 4.2894 7.9916 118.5047 58.3260 31.9691 177.7909 75 Y 4.1380 7.9587 115.2409 59.4809 38.1735 177.5063 76 A 3.8551 7.8864 122.6790 54.7435 18.7161 179.6068 77 L 3.6156 7.5142 117.0251 57.5612 41.6935 179.2124 78 Q 3.4627 7.8620 119.6074 58.9542 28.7788 177.8002 79 N 4.2095 7.4999 116.3469 56.7769 39.3331 176.3509 80 F 4.5474 7.5359 118.8496 60.8822 39.0280 177.6704 81 I 3.5155 7.5597 119.2354 64.5747 36.6067 178.2842 82 D 4.4585 8.0365 118.4581 56.6662 41.0247 177.7382 83 Q 4.3926 7.7325 116.8648 55.9563 28.7788 177.3932 84 L 3.9811 7.5115 120.9264 57.7945 41.6257 178.2158 85 D 4.3327 8.0434 117.7602 56.0001 41.2034 175.8381 86 N 4.8032 7.9293 116.8464 50.7622 40.5276 172.6188 87 P 4.1761 0.0000 0.0000 65.8566 31.4725 178.3077 88 D 4.3681 8.2123 117.2951 57.3195 40.7130 178.5473 89 D 4.3751 8.1766 119.0691 56.9401 41.0063 178.2080 90 L 3.8902 8.0931 121.1417 58.1636 41.9816 179.2742 91 V 3.3883 7.9414 118.5001 66.1150 31.4844 177.8259 92 C 4.1427 7.8941 113.7253 61.1845 29.3865 175.9928 93 V 3.7399 7.8136 120.8737 65.5847 31.0512 178.2510 94 V 3.5749 7.9457 118.2115 66.0240 31.4668 177.8976 95 E 3.9224 8.4792 118.7594 59.0661 28.7367 179.2579 96 K 3.9345 7.9780 119.2770 59.6413 32.0756 178.5380 97 F 4.3513 8.5448 120.6673 61.4506 39.1982 176.9478 98 A 4.0159 8.5283 120.6315 54.7831 18.1053 179.5403 99 V 3.5073 7.6610 116.5566 66.6085 31.7125 178.1759 100 N 4.3396 7.5890 116.1604 56.3996 38.2903 177.1818 101 H 4.1987 7.6208 117.7006 58.5018 28.7388 177.8213 102 I 3.7122 8.0954 122.2215 64.6762 36.7075 178.5821 103 T 3.9326 7.7647 115.5009 65.9673 68.2347 175.8035 104 R 4.3334 7.1107 116.7544 54.6773 30.6047 176.1781 105 K 3.8441 8.0370 117.4029 57.3922 30.1473 175.6010 106 I 3.9170 7.6585 119.5400 60.2977 37.9677 177.3818 107 S 4.5498 8.3849 120.5947 57.3466 65.7118 174.9616 108 A 4.0421 8.4344 123.0098 55.1618 17.8291 179.7362 109 A 4.0325 7.9224 118.3423 55.1036 18.8385 179.0628 110 E 4.0898 8.3897 118.0097 59.4957 29.9081 178.7821 111 F 4.1349 8.7784 121.3024 61.1536 39.5601 176.8764 112 G 3.9111 8.3945 104.2649 46.4599 0.0000 175.1678 113 K 4.2154 8.0837 120.7378 58.6189 32.1251 178.2786 114 M 4.0807 7.7861 118.0638 57.5599 32.1049 177.5638 115 N 4.4716 8.0711 116.6465 56.4165 38.6440 177.2763 116 G 3.5585 7.7766 106.4370 47.3581 0.0000 173.7448 117 P 4.2075 0.0000 0.0000 65.1078 31.2827 178.6915 118 I 3.4764 7.7370 118.2752 64.2037 36.9598 178.2904 119 K 3.8983 8.0641 120.3204 59.5194 31.9901 178.9716 120 K 3.9420 8.0984 118.5995 59.4858 31.7882 179.5548 121 V 3.5317 7.6943 117.4679 65.6780 31.5930 177.4661 122 L 4.0427 8.1101 120.0754 58.3175 42.1536 178.9342 123 A 4.2557 8.5194 122.2063 54.4531 18.0505 179.4027 124 S 4.3124 7.9684 111.4990 60.1500 63.1360 175.1769 125 K 4.4087 7.7987 121.2472 56.1975 32.1712 176.0061 126 N 4.2166 7.9549 113.7505 53.8966 35.9647 173.9000 127 F 4.4997 7.9558 117.8272 55.7384 40.5398 175.6952 128 G 4.4284 8.6180 117.6046 44.8078 0.0000 172.4586 129 D 4.4521 9.0740 117.9306 57.7181 40.5806 178.5948 130 K 3.7725 8.2119 119.2280 60.0431 31.9533 178.1650 131 Y 4.1369 8.2058 116.4354 60.8198 37.9155 177.7802 132 A 4.1856 8.2741 121.3357 55.4787 18.6364 179.3176 133 N 4.3628 8.8344 115.1633 56.1280 38.3362 177.5825 134 A 3.9224 7.7439 122.4501 55.1326 18.5071 179.8229 135 W 3.8088 8.6147 117.3504 59.6738 29.0454 178.6633 136 A 4.1021 8.3175 120.9567 55.0260 17.5334 179.8557 137 K 3.9035 7.6291 116.0140 59.4020 32.3978 179.0495 138 L 3.8876 7.4633 120.5959 58.0487 41.9186 179.1143 139 V 3.6969 8.0898 118.1294 66.0443 31.4689 177.7960 140 A 4.3603 8.1716 121.8427 54.4403 17.8796 179.7934 141 V 3.3766 7.2352 116.2341 66.0997 31.7802 178.1845 142 V 3.4272 7.3721 117.4256 65.9509 31.2771 177.6490 143 Q 3.8254 8.2361 117.8688 59.0582 28.3454 178.9398 144 A 4.0035 7.9393 120.1430 54.1487 18.4536 178.4471 145 A 4.3182 7.6837 117.4164 52.3117 19.5217 177.1189 146 L 4.1170 7.4872 122.4552 54.7150 41.8348 176.5590 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 2 S 8.18 4.51 0.00 4.19 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 3 V 8.18 3.29 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 0.11 0.00 0.00 0.68 0.00 0.00 4 Y 8.57 3.96 0.00 3.09 3.06 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 5 D 7.92 4.43 0.00 2.75 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 6 A 8.20 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 7 A 8.02 3.84 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 8 A 7.47 4.08 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 9 Q 7.70 4.31 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 7.21 0.00 0.00 0.00 0.00 0.00 2.65 2.50 0.00 10 L 7.42 4.21 0.00 1.64 1.52 0.75 0.58 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 11 T 7.71 4.19 4.21 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 1.18 0.00 0.00 12 A 8.41 3.94 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 13 D 7.99 4.34 0.00 2.66 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 14 V 7.35 3.49 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.87 0.00 0.00 15 K 8.08 3.83 0.00 1.95 1.78 0.00 1.66 0.00 0.00 1.50 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.60 7.81 16 K 8.01 3.95 0.00 1.89 1.97 0.00 1.57 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 3.36 0.00 0.00 0.00 0.00 1.47 1.71 7.81 17 D 8.29 4.62 0.00 2.79 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 18 L 7.93 3.75 0.00 1.66 1.24 0.53 -0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.06 4.04 0.00 2.07 2.05 0.00 3.15 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 1.66 1.85 0.00 20 D 8.62 4.51 0.00 2.93 2.93 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 21 S 8.25 3.00 0.00 3.36 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 W 8.64 4.30 0.00 3.80 3.26 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 23 K 7.98 3.47 0.00 1.99 2.03 0.00 1.89 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.48 7.81 24 V 6.95 3.78 2.25 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 1.07 0.00 0.00 1.12 0.00 0.00 25 I 7.69 3.54 1.69 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.93 0.62 0.00 0.00 26 G 7.33 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 S 7.24 4.06 0.00 3.90 3.82 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 28 D 7.21 4.73 0.00 2.65 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 K 8.04 3.82 0.00 1.75 1.72 0.00 1.32 0.00 0.00 0.62 0.00 0.00 2.19 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.27 1.39 7.81 30 K 7.98 4.01 0.00 1.83 1.79 0.00 1.73 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.51 7.81 31 G 8.05 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 32 N 8.34 4.47 0.00 2.77 2.74 0.00 0.00 7.00 7.11 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 33 G 8.15 3.52 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 0.00 34 V 8.21 3.68 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 1.11 0.00 0.00 0.95 0.00 0.00 35 A 7.93 4.00 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 36 L 7.90 3.73 0.00 1.97 1.62 0.78 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 37 M 7.70 3.50 0.00 1.69 1.92 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.72 0.00 38 T 7.90 3.95 4.25 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 1.30 0.00 0.00 39 T 7.78 3.97 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 1.18 0.00 0.00 40 L 7.45 3.82 0.00 1.50 1.24 0.89 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.77 4.53 0.00 3.10 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 42 A 7.70 4.10 1.35 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 43 D 8.28 4.62 0.00 2.72 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 44 N 8.30 5.25 0.00 2.96 2.89 0.00 0.00 7.11 8.65 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 45 Q 8.48 4.37 0.00 2.09 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.91 0.00 0.00 0.00 0.00 0.00 2.62 2.27 0.00 46 E 8.30 4.15 0.00 2.19 2.25 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 2.47 2.39 0.00 47 T 8.28 4.63 4.73 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 1.47 0.00 0.00 48 I 7.93 3.79 1.90 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 1.03 0.81 0.70 0.00 0.00 49 G 8.02 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 50 Y 7.71 4.34 0.00 2.87 2.56 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 51 F 8.15 4.98 0.00 3.09 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 52 K 8.33 3.92 0.00 1.81 1.87 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.82 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.67 7.81 53 R 8.10 3.96 0.00 1.79 2.03 0.00 3.26 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 54 L 7.83 4.16 0.00 1.96 1.76 1.11 1.17 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 55 G 7.74 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 56 D 8.43 4.47 0.00 2.74 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 57 V 8.08 3.60 1.74 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 0.85 0.00 0.00 0.47 0.00 0.00 58 S 7.98 4.31 0.00 4.10 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 59 Q 8.02 4.11 0.00 2.06 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.81 0.00 0.00 0.00 0.00 0.00 2.60 2.52 0.00 60 G 8.58 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 61 M 9.03 3.86 0.00 1.96 2.13 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.62 0.00 62 A 7.54 4.05 1.35 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 63 N 8.26 4.63 0.00 2.77 2.87 0.00 0.00 7.04 9.28 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 64 D 8.67 4.38 0.00 2.74 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 65 K 8.11 4.02 0.00 1.96 1.90 0.00 1.75 0.00 0.00 1.78 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.56 1.51 7.81 66 L 8.31 4.03 0.00 1.82 1.85 1.04 1.00 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 67 R 8.34 4.00 0.00 2.10 2.04 0.00 3.16 0.00 0.00 3.40 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 68 G 8.34 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 69 V 7.96 3.71 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 1.09 0.00 0.00 70 S 8.44 4.13 0.00 4.03 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 71 I 7.98 3.90 1.97 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.01 1.15 0.00 0.00 72 T 7.98 4.08 4.47 0.00 0.00 0.00 0.00 0.00 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 73 L 8.38 4.11 0.00 1.92 1.93 0.96 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 74 M 7.99 4.29 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.94 0.00 75 Y 7.96 4.14 0.00 3.24 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 76 A 7.89 3.86 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 77 L 7.51 3.62 0.00 1.48 1.23 0.99 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 7.86 3.46 0.00 2.43 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.78 0.00 0.00 0.00 0.00 0.00 2.53 2.51 0.00 79 N 7.50 4.21 0.00 2.85 2.69 0.00 0.00 7.31 6.64 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 80 F 7.54 4.55 0.00 2.99 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 81 I 7.56 3.52 1.59 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.31 0.83 0.00 0.00 82 D 8.04 4.46 0.00 2.80 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 83 Q 7.73 4.39 0.00 2.09 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.74 2.57 0.00 84 L 7.51 3.98 0.00 1.55 1.67 0.76 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 85 D 8.04 4.33 0.00 2.66 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 86 N 7.93 4.80 0.00 2.73 2.66 0.00 0.00 7.10 7.23 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 87 P 0.00 4.18 0.00 2.19 2.07 0.00 3.64 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.15 0.00 88 D 8.21 4.37 0.00 2.92 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 89 D 8.18 4.38 0.00 2.84 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 90 L 8.09 3.89 0.00 1.86 1.74 0.73 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 91 V 7.94 3.39 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 0.69 0.00 0.00 0.76 0.00 0.00 92 C 7.89 4.14 0.00 3.20 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 93 V 7.81 3.74 2.31 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 1.27 0.00 0.00 1.10 0.00 0.00 94 V 7.95 3.57 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.36 0.00 0.00 95 E 8.48 3.92 0.00 2.08 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 2.25 2.29 0.00 96 K 7.98 3.93 0.00 1.99 2.10 0.00 1.56 0.00 0.00 1.60 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.57 7.81 97 F 8.54 4.35 0.00 3.40 3.45 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 98 A 8.53 4.02 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 99 V 7.66 3.51 2.24 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 1.01 0.00 0.00 0.97 0.00 0.00 100 N 7.59 4.34 0.00 2.74 2.68 0.00 0.00 7.11 8.04 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 0.00 101 H 7.62 4.20 0.00 3.14 3.32 0.00 5.82 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 I 8.10 3.71 1.99 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.85 0.89 0.00 0.00 103 T 7.76 3.93 4.34 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 1.18 0.00 0.00 104 R 7.11 4.33 0.00 1.85 1.83 0.00 3.11 0.00 0.00 3.08 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.85 0.00 105 K 8.04 3.84 0.00 1.93 1.93 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.41 7.81 106 I 7.66 3.92 1.94 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.67 0.94 0.00 0.00 107 S 8.38 4.55 0.00 4.08 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 0.00 108 A 8.43 4.04 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 0.00 109 A 7.92 4.03 1.35 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 0.00 110 E 8.39 4.09 0.00 2.16 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 2.18 2.43 0.00 111 F 8.78 4.13 0.00 3.32 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 0.00 112 G 8.39 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 0.00 113 K 8.08 4.22 0.00 1.96 1.89 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.76 7.81 114 M 7.79 4.08 0.00 1.92 1.76 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.46 0.00 115 N 8.07 4.47 0.00 3.00 2.88 0.00 0.00 6.71 7.59 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 0.00 116 G 7.78 3.56 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 0.00 117 P 0.00 4.21 0.00 2.18 2.17 0.00 3.66 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.11 0.00 118 I 7.74 3.48 1.95 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.74 0.60 0.00 0.00 119 K 8.06 3.90 0.00 1.91 2.05 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.53 7.81 120 K 8.10 3.94 0.00 1.95 1.81 0.00 1.70 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.56 7.81 121 V 7.69 3.53 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 0.67 0.00 0.00 0.88 0.00 0.00 122 L 8.11 4.04 0.00 2.08 1.79 0.59 1.40 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 0.00 123 A 8.52 4.26 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 0.00 124 S 7.97 4.31 0.00 4.03 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 0.00 125 K 7.80 4.41 0.00 2.09 1.96 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.55 1.52 7.81 126 N 7.95 4.22 0.00 2.66 2.65 0.00 0.00 6.75 6.73 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 0.00 127 F 7.96 4.50 0.00 3.16 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 0.00 128 G 8.62 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 D 9.07 4.45 0.00 2.82 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 0.00 130 K 8.21 3.77 0.00 1.73 1.68 0.00 1.57 0.00 0.00 1.43 0.00 0.00 2.89 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.89 1.33 7.81 131 Y 8.21 4.14 0.00 3.47 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 0.00 132 A 8.27 4.19 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 0.00 133 N 8.83 4.36 0.00 2.90 2.89 0.00 0.00 6.92 7.80 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 0.00 134 A 7.74 3.92 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 0.00 135 W 8.61 3.81 0.00 3.60 3.36 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 0.00 136 A 8.32 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 0.00 137 K 7.63 3.90 0.00 1.86 1.81 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.68 1.53 7.81 138 L 7.46 3.89 0.00 1.41 1.66 0.57 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 139 V 8.09 3.70 2.33 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 1.29 0.00 0.00 1.15 0.00 0.00 140 A 8.17 4.36 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 0.00 141 V 7.24 3.38 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 0.56 0.00 0.00 0.79 0.00 0.00 142 V 7.37 3.43 1.83 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 0.45 0.00 0.00 0.43 0.00 0.00 143 Q 8.24 3.83 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.65 2.71 0.00 144 A 7.94 4.00 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 0.00 145 A 7.68 4.32 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 L 7.49 4.12 0.00 1.72 1.53 0.57 0.77 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