NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3019 8.1627 120.6073 55.3996 32.9959 173.5061 2 K 4.6295 8.0139 124.6504 55.1770 30.8936 167.8218 3 V 4.2481 9.5428 124.7170 61.5516 33.4910 173.7617 4 I 4.7068 8.6735 130.1594 59.7870 39.2102 174.7886 5 L 4.8652 8.8514 127.2522 54.2817 42.6423 175.8523 6 L 4.3446 9.0631 124.8382 57.3335 42.8040 177.5417 7 E 5.3378 8.0934 116.1809 56.6914 30.4725 174.2287 8 P 5.4481 0.0000 0.0000 61.3154 33.5864 175.4001 9 L 5.1832 8.5876 120.1188 56.3591 42.9267 175.5772 10 E 4.2716 8.5342 114.3869 54.1468 26.8450 174.6200 11 N 4.1215 7.5906 115.6353 52.8026 39.3786 174.1550 12 L 5.2943 7.5526 118.4279 55.1220 39.4330 176.5693 13 G 3.8969 7.8116 104.9622 44.2746 0.0000 171.2339 14 D 3.8179 8.5632 116.7607 55.8004 40.2045 172.0479 15 V 3.5930 9.5958 118.6243 62.9055 35.4138 175.1690 16 G 3.9792 9.2247 106.3869 45.6974 0.0000 172.9753 17 Q 4.6998 7.4270 116.7830 54.5494 33.7249 173.9138 18 V 5.2567 8.0031 119.1147 63.0446 34.8164 172.8246 19 V 4.5381 8.2746 125.9423 62.0532 35.8132 172.1354 20 D 5.8500 8.4724 121.4303 51.3557 42.6809 177.5125 21 V 4.2936 7.8195 122.6852 63.5789 31.9511 175.0921 22 K 3.4675 8.2307 114.7018 56.3675 32.9655 175.4677 23 P 3.9641 0.0000 0.0000 64.5346 31.1768 178.3841 24 G 4.0212 10.3546 118.2623 50.6951 0.0000 175.4777 25 Y 2.9583 7.3619 111.6786 59.5481 39.1364 178.4196 26 A 4.1359 9.5848 125.2794 55.9408 21.1267 180.1173 27 R 3.5374 8.7628 107.3742 60.0892 29.2078 176.7437 28 N 4.6130 5.8364 114.9224 54.4703 39.9583 173.6691 29 Y 4.3984 8.2408 114.0169 59.5035 39.4639 176.5336 30 L 4.5636 8.3858 118.1669 55.2282 43.0790 177.1588 31 L 4.6937 7.8172 115.4212 53.6757 43.0989 175.7001 32 P 4.3397 0.0000 0.0000 66.9222 31.1911 179.0827 33 R 2.7579 6.4435 109.9436 53.7460 31.6501 174.5761 34 G 3.2199 7.3510 114.2301 46.0852 0.0000 173.0330 35 L 5.5870 7.3906 116.3300 52.8722 45.1241 177.4533 36 A 4.6692 7.6054 118.4882 51.6591 22.1224 174.9246 37 V 4.5086 8.4237 118.1530 61.4399 35.7482 173.5865 38 L 4.7717 9.2317 125.0955 54.8665 43.5079 176.6786 39 A 3.3606 9.4056 120.2666 50.6024 20.8654 180.1673 40 T 3.6371 9.0820 120.7847 63.6958 68.4986 172.7694 41 E 3.9470 8.6461 121.5317 59.5842 29.3634 179.4023 42 S 4.1193 8.1626 113.8692 61.9548 62.6196 176.4201 43 N 4.3139 7.9613 119.9751 55.4632 38.2821 177.3751 44 L 3.9534 7.7812 119.0289 58.0981 42.0503 178.9747 45 K 3.8548 8.5496 119.0069 59.8000 31.9664 178.8440 46 A 3.8536 8.3687 120.6058 54.8437 18.5859 179.0910 47 L 3.8769 8.1542 118.9054 58.4991 42.0859 179.0451 48 E 3.9243 8.5908 118.4559 59.4371 29.3191 178.7888 49 A 3.9803 8.0613 120.0483 55.8067 18.3665 179.7600 50 R 3.9372 8.4246 115.5128 58.5488 30.1112 179.5667 51 I 3.6763 7.9837 120.3533 64.4827 37.1064 177.9705 52 R 3.8804 8.2907 118.7528 60.1977 29.8769 178.5941 53 A 3.8361 8.2561 119.2111 55.7841 18.3807 179.3476 54 Q 3.8694 8.8096 117.0836 58.9183 29.1546 178.2866 55 A 3.9893 8.1687 122.1042 55.5334 18.3677 179.7471 56 K 3.8838 8.2658 116.2526 59.9750 32.0867 178.8701 57 R 3.8346 8.3656 118.7594 60.0553 29.7273 178.2221 58 L 3.9493 8.6221 117.8936 57.7778 41.7856 179.2150 59 A 3.9680 8.1590 120.6762 55.3994 18.2625 178.8139 60 E 3.8247 8.6052 117.4587 60.1228 29.5692 179.0152 61 R 3.7528 8.1865 117.1232 59.5730 30.0748 178.5356 62 K 3.9031 8.5353 117.5509 59.9185 32.2488 178.6740 63 A 3.9847 8.1192 120.6061 55.6001 18.2589 179.3220 64 E 3.8646 8.4023 116.0492 59.9662 29.5236 178.8859 65 A 3.9017 8.2441 119.9955 55.5404 18.1979 179.0973 66 E 3.8883 8.7702 115.3189 59.6643 29.8663 180.0633 67 R 3.9225 8.0947 117.6176 59.6371 30.1194 179.1839 68 L 4.0520 8.1438 118.7023 57.1688 41.4686 179.3444 69 K 3.8656 8.3009 119.4931 60.5657 32.3290 178.4573 70 K 3.9619 8.2930 123.0614 57.8629 31.9834 178.2471 71 I 3.6749 8.0707 119.4812 64.7209 37.0732 178.4049 72 L 3.9104 7.9517 117.9712 58.0300 41.3940 178.9236 73 E 4.2740 8.4078 118.7511 59.4241 29.2151 178.4155 74 N 4.2482 8.4007 114.8455 56.1977 38.8709 174.8992 75 L 4.1093 6.6858 119.5867 55.5236 43.5607 176.5042 76 T 4.4742 8.1975 113.6377 60.8966 70.5857 174.3821 77 L 4.7237 8.8756 124.7704 54.4233 41.9911 174.6645 78 T 5.1323 8.3744 114.6782 60.1952 70.9084 173.9561 79 I 4.7343 8.7287 124.4560 59.2015 42.1648 172.2761 80 P 5.0972 0.0000 0.0000 61.5521 32.4871 175.3777 81 V 4.5887 8.8448 117.6342 59.4531 35.9787 174.6163 82 R 4.9169 8.1512 119.0556 55.0325 33.0512 175.6434 83 A 3.5679 8.1183 125.2070 52.2775 24.3094 174.3279 84 G 3.4952 8.8768 108.5340 47.1527 0.0000 175.5502 85 E 4.8330 8.4891 118.2453 54.4108 32.3361 174.1863 86 T 4.7192 6.6037 123.7750 64.4476 74.7635 176.2041 87 K 5.4605 8.6990 130.4638 56.8958 32.1727 176.7640 88 I 3.7331 8.1142 124.2418 61.0166 37.8420 176.4688 89 Y 4.2977 7.3181 122.0281 60.7743 37.8505 178.0583 90 G 4.1328 7.9721 107.4061 44.9673 0.0000 170.2302 91 S 3.3664 7.6091 117.4109 57.6530 64.6241 172.1118 92 V 3.9624 8.2419 123.1593 61.7633 30.8987 174.3394 93 T 4.5677 10.7500 122.7476 60.3781 68.1759 175.3729 94 A 3.8216 8.8621 130.9077 55.2366 18.1274 179.3520 95 K 3.8470 8.0627 117.7286 59.7630 32.2589 178.1384 96 D 5.4114 8.5763 121.1200 57.0046 40.7586 178.7716 97 I 3.6118 7.9054 119.0950 64.9241 37.0670 177.4857 98 A 3.8568 8.1646 120.8848 55.5949 18.1706 179.1463 99 E 3.8731 8.4929 115.6421 60.4120 29.7682 178.8281 100 A 3.8563 8.4378 119.1235 55.5420 18.0759 179.2122 101 L 3.8911 8.4770 115.7834 58.5894 40.9567 179.6548 102 S 3.8364 8.1215 108.6660 60.4129 62.3820 174.5513 103 R 4.3751 6.0191 119.1298 56.4138 31.0054 175.1158 104 Q 4.4057 8.0778 116.8034 56.9012 29.8519 176.0114 105 H 4.7126 9.5363 115.2928 55.1402 32.0094 172.1852 106 G 3.9622 7.3990 112.0035 44.9671 0.0000 173.6200 107 V 3.7050 7.8434 118.9167 62.4759 33.0189 175.0513 108 T 4.8441 8.1474 115.1754 60.0486 71.4622 173.1997 109 I 4.6625 7.7352 121.9004 59.5002 41.3012 174.7294 110 D 4.4982 8.5023 123.2038 52.3599 39.5331 174.1782 111 P 4.1690 0.0000 0.0000 65.2177 32.5387 180.5191 112 K 3.9842 7.2196 112.9191 54.8419 33.5423 176.9981 113 R 4.1081 5.8400 116.8216 57.1011 31.5851 177.1166 114 L 4.5899 8.1008 122.1830 55.1738 46.4434 175.7837 115 A 4.1403 8.3442 130.5819 53.0143 19.4279 175.2244 116 L 4.6594 7.6746 120.2004 55.6444 43.8881 174.0889 117 E 4.0677 8.9522 125.9035 58.6857 29.7718 177.4748 118 K 4.7066 7.3727 115.3751 52.9453 35.6675 174.2747 119 P 4.3489 0.0000 0.0000 63.4529 31.5460 175.4275 120 I 4.4375 8.4190 122.3403 59.6816 39.3262 176.6044 121 K 4.4067 8.2126 123.2016 57.8373 33.6305 177.2764 122 E 3.8963 8.3996 122.5568 58.4243 29.6493 177.7222 123 L 4.2450 7.2994 116.0445 55.7115 44.4155 174.3286 124 G 3.9381 8.8815 107.7672 44.3990 0.0000 173.2442 125 E 5.2824 7.7977 121.0257 53.7669 32.9307 174.8094 126 Y 5.0749 8.0244 116.6238 56.7140 42.9254 173.9192 127 V 5.3451 8.5636 122.5159 60.7154 33.6453 174.0768 128 L 4.6949 8.7034 128.7494 53.3955 46.3172 174.2309 129 T 4.6668 7.9079 114.9331 60.6038 68.6843 173.1476 130 Y 5.2983 9.1836 128.5138 54.9921 40.1998 175.9946 131 K 4.4000 8.7215 125.3066 55.9586 32.6546 175.0782 132 P 4.3796 0.0000 0.0000 64.5415 32.0614 175.4959 133 H 4.5461 8.3871 118.8468 54.5541 30.8303 170.5657 134 P 3.4051 0.0000 0.0000 64.8001 30.6672 176.0609 135 E 4.6033 8.9112 117.5410 56.3316 35.6664 175.2803 136 V 4.2337 7.7497 112.9765 58.9061 32.2098 172.8370 137 P 5.0464 0.0000 0.0000 61.1988 33.1564 174.7622 138 I 4.4569 8.5408 121.1128 59.6989 39.7832 174.0383 139 Q 5.3706 8.7444 128.0600 54.3389 30.9126 174.9375 140 L 4.8129 9.2396 122.7603 53.1207 47.1216 175.7285 141 K 4.5147 8.8182 121.8049 56.4077 33.2115 174.7986 142 V 4.9628 8.9301 127.6108 61.2366 33.9891 174.3642 143 S 5.5973 9.4156 122.1460 55.6143 66.4703 173.3383 144 V 5.2904 8.1074 121.0975 59.3789 35.0727 174.2362 145 V 4.7479 7.9499 119.3473 61.1250 35.7268 173.2341 146 A 4.5393 8.5516 126.6743 51.8701 18.9086 178.2709 147 Q 3.9883 8.9301 119.8764 56.5562 28.7983 176.4317 148 E 4.1223 7.9618 124.1798 57.2598 30.0578 174.0492 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 8.16 4.30 0.00 2.12 1.98 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.76 0.00 2 K 8.01 4.63 0.00 1.96 1.70 0.00 1.76 0.00 0.00 1.78 0.00 0.00 2.82 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.50 1.50 7.81 3 V 9.54 4.25 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.02 0.00 0.00 4 I 8.67 4.71 1.90 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.67 0.91 0.00 0.00 5 L 8.85 4.87 0.00 1.68 1.75 0.93 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 6 L 9.06 4.34 0.00 1.73 1.63 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 7 E 8.09 5.34 0.00 2.02 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 2.25 0.00 8 P 0.00 5.45 0.00 2.03 1.96 0.00 3.77 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 1.98 2.02 0.00 9 L 8.59 5.18 0.00 1.61 1.57 1.01 1.01 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 10 E 8.53 4.27 0.00 2.03 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.28 0.00 11 N 7.59 4.12 0.00 2.96 3.03 0.00 0.00 5.78 6.67 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 12 L 7.55 5.29 0.00 1.63 1.66 0.93 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 13 G 7.81 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 14 D 8.56 3.82 0.00 2.87 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 15 V 9.60 3.59 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 1.04 0.00 0.00 0.97 0.00 0.00 16 G 9.22 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 17 Q 7.43 4.70 0.00 1.96 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 18 V 8.00 5.26 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 0.79 0.00 0.00 0.96 0.00 0.00 19 V 8.27 4.54 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 0.91 0.00 0.00 0.93 0.00 0.00 20 D 8.47 5.85 0.00 2.52 2.49 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 21 V 7.82 4.29 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 22 K 8.23 3.47 0.00 0.79 0.74 0.00 1.53 0.00 0.00 1.45 0.00 0.00 2.61 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.90 0.52 7.81 23 P 0.00 3.96 0.00 2.35 1.53 0.00 3.30 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.13 0.00 24 G 10.35 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 0.00 0.00 0.00 25 Y 7.36 2.96 0.00 3.38 2.59 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 26 A 9.58 4.14 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 27 R 8.76 3.54 0.00 2.28 1.92 0.00 3.33 0.00 0.00 3.16 7.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 28 N 5.84 4.61 0.00 2.73 2.43 0.00 0.00 7.18 7.58 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 29 Y 8.24 4.40 0.00 3.20 3.03 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 30 L 8.39 4.56 0.00 1.89 1.76 0.98 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 31 L 7.82 4.69 0.00 1.74 1.69 1.02 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.34 0.00 2.12 2.30 0.00 3.72 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.20 0.00 33 R 6.44 2.76 0.00 1.92 1.79 0.00 3.38 0.00 0.00 3.25 7.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.76 0.00 34 G 7.35 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 0.00 0.00 0.00 35 L 7.39 5.59 0.00 1.54 1.64 0.98 1.10 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 36 A 7.61 4.67 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 37 V 8.42 4.51 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.94 0.00 0.00 38 L 9.23 4.77 0.00 1.71 1.55 0.95 1.11 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 39 A 9.41 3.36 1.11 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 0.00 0.00 40 T 9.08 3.64 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 41 E 8.65 3.95 0.00 2.01 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 0.00 2.40 2.37 0.00 42 S 8.16 4.12 0.00 4.04 4.15 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 43 N 7.96 4.31 0.00 3.18 2.90 0.00 0.00 7.12 7.91 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 44 L 7.78 3.95 0.00 1.61 1.75 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.55 3.85 0.00 1.96 2.03 0.00 1.55 0.00 0.00 1.65 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.52 7.81 46 A 8.37 3.85 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 47 L 8.15 3.88 0.00 1.76 1.86 0.92 0.93 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 48 E 8.59 3.92 0.00 2.12 1.99 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 2.45 2.48 0.00 49 A 8.06 3.98 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 50 R 8.42 3.94 0.00 1.87 1.99 0.00 3.13 0.00 0.00 3.17 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 51 I 7.98 3.68 2.06 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.88 0.91 0.00 0.00 52 R 8.29 3.88 0.00 2.18 2.01 0.00 3.16 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 53 A 8.26 3.84 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 54 Q 8.81 3.87 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.67 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 55 A 8.17 3.99 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 56 K 8.27 3.88 0.00 1.96 1.87 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.45 7.81 57 R 8.37 3.83 0.00 2.05 2.01 0.00 3.25 0.00 0.00 3.17 7.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 58 L 8.62 3.95 0.00 1.73 1.73 0.93 1.18 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 59 A 8.16 3.97 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 60 E 8.61 3.82 0.00 2.09 2.26 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 2.31 2.53 0.00 61 R 8.19 3.75 0.00 1.92 1.82 0.00 3.34 0.00 0.00 3.14 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.86 0.00 62 K 8.54 3.90 0.00 2.01 1.94 0.00 1.82 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.55 1.70 7.81 63 A 8.12 3.98 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 64 E 8.40 3.86 0.00 2.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.50 0.00 65 A 8.24 3.90 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.77 3.89 0.00 2.23 2.06 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 2.36 2.45 0.00 67 R 8.09 3.92 0.00 2.00 1.99 0.00 3.17 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 68 L 8.14 4.05 0.00 1.81 1.70 0.91 0.71 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 69 K 8.30 3.87 0.00 2.05 2.23 0.00 1.34 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.83 7.81 70 K 8.29 3.96 0.00 1.88 1.97 0.00 1.61 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.40 7.81 71 I 8.07 3.67 1.85 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 1.52 0.60 0.89 0.00 0.00 72 L 7.95 3.91 0.00 1.58 1.68 0.88 0.93 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 73 E 8.41 4.27 0.00 2.00 2.04 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 2.36 2.45 0.00 74 N 8.40 4.25 0.00 2.94 2.87 0.00 0.00 7.17 7.10 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 75 L 6.69 4.11 0.00 1.77 1.51 1.00 0.92 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 76 T 8.20 4.47 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 1.22 0.00 0.00 77 L 8.88 4.72 0.00 1.67 1.80 0.91 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.37 5.13 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 1.22 0.00 0.00 79 I 8.73 4.73 1.86 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 1.21 0.69 0.91 0.00 0.00 80 P 0.00 5.10 0.00 1.93 1.98 0.00 3.61 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.09 0.00 81 V 8.84 4.59 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 0.74 0.00 0.00 0.99 0.00 0.00 82 R 8.15 4.92 0.00 1.86 2.04 0.00 3.27 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 1.85 1.65 0.00 83 A 8.12 3.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 G 8.88 3.50 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 0.00 85 E 8.49 4.83 0.00 1.88 1.85 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 2.21 2.38 0.00 86 T 6.60 4.72 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 87 K 8.70 5.46 0.00 1.70 1.67 0.00 1.79 0.00 0.00 2.36 0.00 0.00 2.91 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.57 1.55 7.81 88 I 8.11 3.73 1.85 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.86 1.05 0.00 0.00 89 Y 7.32 4.30 0.00 2.97 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 90 G 7.97 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 0.00 0.00 0.00 91 S 7.61 3.37 0.00 4.17 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 92 V 8.24 3.96 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 0.98 0.00 0.00 0.98 0.00 0.00 93 T 10.75 4.57 4.27 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 1.33 0.00 0.00 94 A 8.86 3.82 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 95 K 8.06 3.85 0.00 1.85 1.83 0.00 1.76 0.00 0.00 1.83 0.00 0.00 3.10 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.79 1.50 7.81 96 D 8.58 5.41 0.00 2.85 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 I 7.91 3.61 1.97 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 1.57 0.72 0.77 0.00 0.00 98 A 8.16 3.86 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 99 E 8.49 3.87 0.00 2.19 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 100 A 8.44 3.86 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 L 8.48 3.89 0.00 1.81 1.89 0.88 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 102 S 8.12 3.84 0.00 4.04 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 R 6.02 4.38 0.00 1.84 1.88 0.00 3.30 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 104 Q 8.08 4.41 0.00 2.33 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.54 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 105 H 9.54 4.71 0.00 3.04 3.33 0.00 5.81 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 G 7.40 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 0.00 107 V 7.84 3.71 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.91 0.00 0.00 108 T 8.15 4.84 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 1.23 0.00 0.00 109 I 7.74 4.66 1.81 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 1.44 0.39 0.89 0.00 0.00 110 D 8.50 4.50 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 0.00 111 P 0.00 4.17 0.00 2.21 2.16 0.00 3.78 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 112 K 7.22 3.98 0.00 2.06 1.76 0.00 1.66 0.00 0.00 1.90 0.00 0.00 3.13 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.55 7.81 113 R 5.84 4.11 0.00 2.02 1.98 0.00 3.24 0.00 0.00 3.54 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 2.03 0.00 114 L 8.10 4.59 0.00 1.80 1.67 0.99 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 115 A 8.34 4.14 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.67 4.66 0.00 1.69 1.65 1.03 1.13 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 0.00 117 E 8.95 4.07 0.00 1.96 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 2.28 2.36 0.00 118 K 7.37 4.71 0.00 1.62 1.69 0.00 1.61 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.37 7.81 119 P 0.00 4.35 0.00 2.19 2.10 0.00 3.75 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 120 I 8.42 4.44 1.93 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 1.59 1.51 1.10 0.00 0.00 121 K 8.21 4.41 0.00 2.02 2.03 0.00 1.68 0.00 0.00 1.83 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.45 7.81 122 E 8.40 3.90 0.00 2.34 2.15 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 2.37 2.16 0.00 123 L 7.30 4.24 0.00 1.75 1.99 0.94 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 124 G 8.88 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 0.00 125 E 7.80 5.28 0.00 1.83 1.76 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 2.11 2.11 0.00 126 Y 8.02 5.07 0.00 2.92 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 0.00 127 V 8.56 5.35 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 1.00 0.00 0.00 0.98 0.00 0.00 128 L 8.70 4.69 0.00 1.65 0.62 0.81 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 129 T 7.91 4.67 4.62 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 1.08 0.00 0.00 130 Y 9.18 5.30 0.00 2.97 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 0.00 131 K 8.72 4.40 0.00 1.86 1.87 0.00 1.50 0.00 0.00 1.78 0.00 0.00 3.14 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.41 1.49 7.81 132 P 0.00 4.38 0.00 2.23 2.25 0.00 3.71 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.01 0.00 133 H 8.39 4.55 0.00 3.17 3.21 0.00 5.77 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 3.41 0.00 2.04 2.43 0.00 3.97 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 2.03 2.13 0.00 135 E 8.91 4.60 0.00 1.74 1.89 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 2.20 2.27 0.00 136 V 7.75 4.23 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 0.88 0.00 0.00 1.07 0.00 0.00 137 P 0.00 5.05 0.00 2.19 2.04 0.00 3.75 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 1.94 1.94 0.00 138 I 8.54 4.46 1.92 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 1.23 1.53 1.10 0.00 0.00 139 Q 8.74 5.37 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.50 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 140 L 9.24 4.81 0.00 1.65 1.52 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 141 K 8.82 4.51 0.00 1.84 2.01 0.00 1.47 0.00 0.00 1.76 0.00 0.00 2.86 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.50 1.44 7.81 142 V 8.93 4.96 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 0.90 0.00 0.00 1.14 0.00 0.00 143 S 9.42 5.60 0.00 3.78 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 0.00 144 V 8.11 5.29 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 0.88 0.00 0.00 0.97 0.00 0.00 145 V 7.95 4.75 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 0.99 0.00 0.00 0.88 0.00 0.00 146 A 8.55 4.54 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 0.00 147 Q 8.93 3.99 0.00 2.16 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 5.96 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 148 E 7.96 4.12 0.00 2.18 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 2.24 2.46 0.00