NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2794 8.3044 120.3502 56.6807 33.3443 173.8333 2 E 5.0637 8.0463 120.1356 55.3459 31.4334 175.1292 3 L 4.1895 9.4161 128.9202 54.6288 42.9009 176.2889 4 I 4.4270 8.2931 124.9150 59.5968 38.8677 175.1049 5 R 4.6289 8.3280 124.7604 54.8735 31.6844 175.0519 6 F 4.8945 7.6315 116.7776 55.7982 40.3553 173.7425 7 S 4.4584 8.5441 116.5852 58.1836 63.1608 173.2963 8 I 4.7265 7.7909 123.1531 59.8915 40.9190 174.8217 9 S 4.7103 8.5783 118.8830 56.8283 65.1779 173.8210 10 I 4.6441 8.0149 125.0477 57.7899 40.9259 174.1345 11 P 4.3364 0.0000 0.0000 62.3569 32.9774 177.3432 12 S 4.0767 8.7144 116.7780 61.8073 62.2182 176.7196 13 K 3.9839 8.0814 120.3722 59.5715 31.8646 178.8977 14 L 4.0068 7.8178 120.0204 57.8298 42.0511 178.5569 15 L 4.1429 8.2801 123.1734 58.5241 42.0224 179.3722 16 E 3.9838 8.7222 118.7327 61.2062 29.6311 181.2284 17 K 4.1757 7.8758 121.0619 59.0117 32.1779 178.7367 18 F 4.3203 8.1526 120.8466 61.4817 39.4471 176.7227 19 D 4.1189 8.4890 118.9420 57.4922 40.6841 178.6949 20 Q 3.9463 8.1642 119.8211 59.1485 28.9757 178.6061 21 I 3.7307 7.5194 121.1184 64.3227 37.2876 178.4739 22 I 3.9980 7.4636 113.6154 63.6343 37.1352 177.6618 23 E 3.8953 7.9974 121.6563 59.2978 29.3236 178.1710 24 E 3.9456 7.9423 118.5324 59.4961 29.7685 178.7459 25 I 3.9797 8.0491 119.2668 62.1791 37.2695 176.6400 26 G 3.8514 7.9946 107.4148 45.8927 0.0000 173.0137 27 Y 4.1496 8.2935 117.2594 56.8540 38.7524 175.7047 28 E 4.0997 8.9730 124.7889 59.0171 29.9563 177.2934 29 N 4.8207 7.7131 113.2590 50.8186 41.3361 174.9743 30 R 3.9213 8.5370 118.8120 59.6430 30.0013 179.3126 31 S 4.0953 8.0737 114.1973 61.7239 62.7740 176.4970 32 E 4.0234 8.7906 121.0961 59.2515 29.3026 179.2101 33 A 2.9040 7.7499 120.4840 55.0940 18.4671 179.7505 34 I 3.6840 8.3094 118.4264 64.4729 37.0063 178.7381 35 R 3.9585 8.1755 119.6928 59.4341 29.8746 178.3593 36 D 4.3905 7.9391 118.8706 57.2888 40.8832 178.5579 37 L 4.0111 7.8105 119.2581 57.9904 41.6794 179.6997 38 I 3.7924 7.8414 119.4700 64.4867 36.9979 178.4982 39 R 3.9077 8.3077 119.7295 59.5900 29.9117 178.3329 40 D 4.2629 8.4000 118.8538 57.0501 40.8729 178.3967 41 F 4.2814 8.3566 121.2590 61.4359 39.3118 177.3369 42 I 3.3268 7.8452 119.1866 64.4627 36.9709 178.4307 43 I 3.1481 7.6850 120.7193 64.2744 36.8632 178.6325 44 R 3.9889 7.6323 118.7004 59.0307 29.9589 178.3969 45 H 3.9818 7.7982 117.9421 59.0941 29.7189 177.2731 46 E 3.9270 8.2719 120.6781 59.3349 29.3193 179.4364 47 W 4.5133 7.8489 118.3386 59.9099 28.9045 178.0970 48 E 4.0621 8.1653 118.8204 59.3572 28.7469 179.5207 49 V 3.5584 8.0228 112.8744 64.4769 31.8393 178.0327 50 G 4.2221 8.4238 106.0303 45.1191 0.0000 172.5892 51 N 4.1883 8.1005 117.9295 54.3481 38.1650 173.6901 52 E 4.1711 8.1317 115.4680 56.1588 31.4544 177.2915 53 E 4.4446 8.5441 122.8349 56.0847 29.7352 175.8924 54 V 4.4851 8.6445 120.3913 59.3465 35.5952 174.7581 55 A 4.9665 9.4286 123.3503 49.9450 23.0373 176.8121 56 G 3.8540 7.4898 104.5973 46.4039 0.0000 171.5855 57 T 5.2332 8.0673 109.4973 60.1545 73.0621 173.4564 58 I 4.9249 8.6620 123.7453 60.1487 40.1582 174.5119 59 T 4.9541 8.6833 124.6966 62.2628 70.7401 174.3738 60 I 5.0826 8.8274 125.9081 59.6734 41.6389 174.1906 61 V 4.9946 9.0874 127.8697 61.3015 33.7039 174.0023 62 Y 5.3181 8.5637 125.2829 55.0760 42.4452 173.6288 63 N 4.8713 9.5875 119.7715 53.7436 39.4457 174.6554 64 H 4.1873 9.1672 127.7073 59.8442 29.6260 176.4227 65 D 4.5153 8.4233 116.2894 56.7191 41.1047 177.5634 66 E 4.2871 8.5889 117.6637 58.2965 30.2692 177.0585 67 G 4.0500 8.2020 106.6073 44.8459 0.0000 173.1523 68 D 4.9342 7.9855 119.8189 53.0382 42.0112 178.2801 69 V 3.3431 7.2082 120.7832 65.9287 31.7564 176.6235 70 V 3.5160 7.5274 117.4389 65.8188 31.5643 177.5994 71 K 3.8274 7.9986 118.5511 59.4600 32.1301 178.0246 72 A 3.9691 7.7384 120.6985 55.2870 18.1552 179.3074 73 L 3.8746 8.0595 118.7775 58.4632 41.9753 179.2349 74 L 3.9929 7.8962 117.5284 57.6514 41.7174 179.2196 75 D 4.4922 8.0115 118.6012 57.5180 40.8941 178.6998 76 L 4.2007 7.8974 119.2571 57.9721 41.4777 179.4613 77 Q 4.0881 8.4919 118.1933 58.9361 28.3229 178.5320 78 H 4.3761 8.0119 118.5072 58.8246 30.1881 176.7182 79 E 3.8931 8.0954 118.8587 58.9708 29.9606 179.0516 80 Y 5.0435 8.2175 117.3847 56.8230 39.0235 177.6870 81 L 4.3025 8.0029 123.0180 57.7712 42.4073 177.7733 82 D 4.5440 8.0165 116.7440 57.0983 41.6669 177.6731 83 E 4.8540 8.1544 117.8128 58.9188 29.7024 176.8301 84 I 4.1149 7.6922 122.1622 61.1795 36.6248 175.8858 85 I 4.1224 8.9075 127.8483 63.8473 37.7433 177.1039 86 S 4.7264 7.7992 115.8083 57.1554 67.4630 173.0911 87 S 5.1250 8.6882 117.5270 56.3880 64.9066 172.7153 88 L 4.8740 9.1069 128.5454 53.4798 45.0455 174.3746 89 H 5.4305 8.9312 124.9358 54.4240 32.9720 172.6965 90 V 4.3062 8.6632 124.2612 61.7018 35.0415 173.9097 91 H 4.6056 8.8489 125.4507 54.8786 27.8990 175.3533 92 M 4.1411 8.6425 122.8590 57.4904 32.3112 176.9651 93 D 4.6872 7.3293 115.6337 52.0121 42.1904 174.3038 94 E 3.9808 8.8440 115.5804 59.4110 29.8684 176.8492 95 H 4.8293 9.2267 115.9531 57.1507 31.8051 174.4389 96 N 4.9612 8.3409 115.6675 52.8692 39.8989 174.1813 97 C 5.0196 8.4772 120.3243 57.5925 32.5225 172.7142 98 L 5.1103 8.9317 123.8539 53.2615 44.8570 174.5440 99 E 5.3029 9.7225 128.0150 54.3396 32.3075 174.7060 100 V 5.0623 9.0248 127.1250 59.7693 34.5104 174.5316 101 I 4.9833 8.4868 117.9823 58.9749 40.8862 174.3849 102 V 4.6098 9.1276 125.9361 61.8920 32.8792 175.0007 103 V 5.0294 8.6045 120.7949 59.5760 35.6996 174.7490 104 K 4.7525 9.3746 124.5918 54.1430 35.7779 176.3282 105 G 4.2337 8.1041 114.5261 45.1616 0.0000 170.2323 106 E 4.4725 8.1398 118.2938 55.6485 31.3519 176.7264 107 A 3.9277 8.9737 126.5957 55.4174 18.4247 179.6556 108 K 3.8529 8.1742 117.5268 59.7015 32.2315 179.1500 109 K 4.0637 7.9678 118.0491 59.6523 32.1729 179.2690 110 I 3.6211 7.7690 120.0748 64.2659 36.8791 178.4540 111 K 4.0001 8.5467 120.9037 59.3366 32.0638 178.6541 112 M 3.9776 7.6949 118.5316 58.4981 32.1676 178.2487 113 I 3.3376 7.4245 119.6469 64.2130 37.1615 177.9703 114 A 3.8807 7.8375 121.4448 55.2821 18.0006 179.0001 115 D 4.3701 8.0775 116.3721 58.0111 41.3244 179.4003 116 K 3.9926 7.9117 118.1529 59.5384 31.8749 179.0911 117 L 3.9475 8.0246 118.8327 58.1547 41.4805 179.6726 118 L 4.0041 8.0824 117.5475 56.9739 41.7323 178.9216 119 S 4.3126 7.8045 114.3408 59.4576 63.1265 174.7199 120 L 4.0020 6.8823 121.5671 54.8106 42.1637 176.7144 121 K 4.3024 8.3326 120.9527 57.6989 33.7035 177.4975 122 G 4.0912 8.9764 109.0853 45.8390 0.0000 173.9556 123 V 4.0357 7.1719 120.0852 63.0665 31.9004 175.4681 124 K 4.4680 9.2084 126.8717 58.4995 33.4550 176.3305 125 H 4.7631 7.4619 116.8133 55.2610 33.1133 172.7893 126 G 4.8106 8.0608 108.4396 46.4074 0.0000 172.2656 127 K 4.5815 7.8502 119.9528 55.2212 35.8018 173.5039 128 L 4.9959 8.5167 127.4391 53.5905 43.5967 175.5340 129 V 4.7341 9.0820 127.2055 61.4219 33.9008 174.0245 130 M 5.3361 9.3733 125.4535 53.7917 35.0001 174.1367 131 T 4.9339 8.9600 113.8729 59.7993 71.1928 173.9382 132 S 3.9845 8.4900 117.1196 59.6508 63.4692 174.8956 133 T 4.4525 7.6452 109.3340 61.4722 68.2801 174.0475 134 G 3.9723 8.6275 107.2375 45.2054 0.0000 174.6387 135 K 4.2448 7.8841 120.6942 57.6493 32.5415 176.4537 136 E 4.8473 8.0241 116.1796 54.5547 33.1101 174.9356 137 L 4.8123 8.3926 122.7804 54.3042 43.2707 176.2465 138 V 4.1258 8.8714 118.9508 61.3802 32.0640 176.0101 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.28 0.00 2.00 2.09 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.55 0.00 2 E 8.05 5.06 0.00 2.06 1.86 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 2.06 2.41 0.00 3 L 9.42 4.19 0.00 1.70 1.64 0.94 0.92 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 4 I 8.29 4.43 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 1.33 0.75 1.01 0.00 0.00 5 R 8.33 4.63 0.00 1.76 1.83 0.00 3.26 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 6 F 7.63 4.89 0.00 3.11 2.94 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 7 S 8.54 4.46 0.00 3.88 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 8 I 7.79 4.73 1.81 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.48 0.89 0.00 0.00 9 S 8.58 4.71 0.00 3.80 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 10 I 8.01 4.64 1.82 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.54 0.82 0.00 0.00 11 P 0.00 4.34 0.00 2.13 1.95 0.00 3.56 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 2.08 2.12 0.00 12 S 8.71 4.08 0.00 3.88 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 13 K 8.08 3.98 0.00 1.88 1.86 0.00 1.60 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.53 1.57 7.81 14 L 7.82 4.01 0.00 1.73 1.77 0.90 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 15 L 8.28 4.14 0.00 1.92 1.86 1.06 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.72 3.98 0.00 1.96 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 2.24 2.19 0.00 17 K 7.88 4.18 0.00 1.95 1.90 0.00 1.66 0.00 0.00 1.59 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.53 7.81 18 F 8.15 4.32 0.00 3.21 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 19 D 8.49 4.12 0.00 2.83 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Q 8.16 3.95 0.00 2.12 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.83 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 21 I 7.52 3.73 1.85 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 0.55 0.94 0.00 0.00 22 I 7.46 4.00 1.71 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 1.23 0.64 0.04 0.00 0.00 23 E 8.00 3.90 0.00 2.06 2.13 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 2.29 2.29 0.00 24 E 7.94 3.95 0.00 2.00 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 0.00 2.33 2.41 0.00 25 I 8.05 3.98 2.04 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.90 0.85 0.00 0.00 26 G 7.99 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 27 Y 8.29 4.15 0.00 3.02 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 28 E 8.97 4.10 0.00 1.99 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 2.34 2.39 0.00 29 N 7.71 4.82 0.00 2.94 2.90 0.00 0.00 6.11 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 30 R 8.54 3.92 0.00 1.90 2.16 0.00 3.15 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 1.88 1.73 0.00 31 S 8.07 4.10 0.00 4.03 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 32 E 8.79 4.02 0.00 2.23 2.16 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 2.81 2.69 0.00 33 A 7.75 2.90 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 I 8.31 3.68 1.95 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 1.31 1.11 0.91 0.00 0.00 35 R 8.18 3.96 0.00 2.07 2.12 0.00 3.14 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 36 D 7.94 4.39 0.00 2.94 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 37 L 7.81 4.01 0.00 1.86 1.69 0.88 0.85 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 38 I 7.84 3.79 2.08 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.03 0.98 0.00 0.00 39 R 8.31 3.91 0.00 1.96 2.07 0.00 3.09 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 1.59 1.64 0.00 40 D 8.40 4.26 0.00 2.91 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 41 F 8.36 4.28 0.00 3.08 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 42 I 7.85 3.33 1.91 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 1.42 0.71 0.78 0.00 0.00 43 I 7.68 3.15 1.43 0.00 0.00 0.70 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 1.06 -0.47 0.00 0.00 44 R 7.63 3.99 0.00 1.82 1.99 0.00 3.21 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.66 0.00 45 H 7.80 3.98 0.00 2.80 3.09 0.00 5.59 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.27 3.93 0.00 1.95 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 0.00 2.26 2.46 0.00 47 W 7.85 4.51 0.00 3.56 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 48 E 8.17 4.06 0.00 2.19 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 2.34 2.49 0.00 49 V 8.02 3.56 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 0.54 0.00 0.00 1.00 0.00 0.00 50 G 8.42 4.22 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 51 N 8.10 4.19 0.00 2.78 2.83 0.00 0.00 7.16 8.35 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 52 E 8.13 4.17 0.00 1.78 1.78 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 2.71 2.78 0.00 53 E 8.54 4.44 0.00 1.90 1.80 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 2.23 2.32 0.00 54 V 8.64 4.49 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 -0.03 0.00 0.00 0.85 0.00 0.00 55 A 9.43 4.97 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 56 G 7.49 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 57 T 8.07 5.23 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 1.21 0.00 0.00 58 I 8.66 4.92 1.86 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 1.21 0.80 0.90 0.00 0.00 59 T 8.68 4.95 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 1.25 0.00 0.00 60 I 8.83 5.08 2.08 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 1.14 0.70 1.07 0.00 0.00 61 V 9.09 4.99 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 0.98 0.00 0.00 0.96 0.00 0.00 62 Y 8.56 5.32 0.00 3.16 3.02 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 63 N 9.59 4.87 0.00 2.82 2.86 0.00 0.00 7.22 8.50 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 64 H 9.17 4.19 0.00 3.14 3.38 0.00 6.00 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 65 D 8.42 4.52 0.00 2.93 2.75 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 66 E 8.59 4.29 0.00 2.03 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 2.29 2.33 0.00 67 G 8.20 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 68 D 7.99 4.93 0.00 2.61 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 V 7.21 3.34 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 0.94 0.00 0.00 0.21 0.00 0.00 70 V 7.53 3.52 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 1.02 0.00 0.00 0.91 0.00 0.00 71 K 8.00 3.83 0.00 1.88 1.88 0.00 1.67 0.00 0.00 1.81 0.00 0.00 3.04 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.56 7.81 72 A 7.74 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 73 L 8.06 3.87 0.00 1.73 1.85 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 74 L 7.90 3.99 0.00 1.79 1.73 0.92 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 75 D 8.01 4.49 0.00 2.97 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 76 L 7.90 4.20 0.00 1.92 1.85 0.86 1.22 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 77 Q 8.49 4.09 0.00 2.30 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.76 0.00 0.00 0.00 0.00 0.00 2.42 2.60 0.00 78 H 8.01 4.38 0.00 3.13 3.44 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 E 8.10 3.89 0.00 1.51 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 2.27 2.59 0.00 80 Y 8.22 5.04 0.00 3.05 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 81 L 8.00 4.30 0.00 1.78 1.70 1.00 1.31 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 82 D 8.02 4.54 0.00 2.70 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 83 E 8.15 4.85 0.00 2.34 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 2.52 2.40 0.00 84 I 7.69 4.11 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.50 0.93 0.00 0.00 85 I 8.91 4.12 1.96 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 1.23 0.66 0.91 0.00 0.00 86 S 7.80 4.73 0.00 3.73 3.70 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.69 5.13 0.00 3.85 3.72 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 88 L 9.11 4.87 0.00 1.76 1.60 0.94 0.74 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 89 H 8.93 5.43 0.00 3.27 3.13 0.00 5.73 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 90 V 8.66 4.31 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 0.88 0.00 0.00 0.91 0.00 0.00 91 H 8.85 4.61 0.00 3.07 3.21 0.00 5.76 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 M 8.64 4.14 0.00 2.01 2.18 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 93 D 7.33 4.69 0.00 2.67 2.60 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 94 E 8.84 3.98 0.00 1.94 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 2.12 1.71 0.00 95 H 9.23 4.83 0.00 3.11 3.32 0.00 5.61 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 N 8.34 4.96 0.00 2.70 2.66 0.00 0.00 6.86 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 97 C 8.48 5.02 0.00 1.27 2.21 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 98 L 8.93 5.11 0.00 1.56 1.39 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 99 E 9.72 5.30 0.00 2.31 1.91 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 2.24 2.31 0.00 100 V 9.02 5.06 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 0.92 0.00 0.00 0.94 0.00 0.00 101 I 8.49 4.98 1.87 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 1.27 0.84 0.92 0.00 0.00 102 V 9.13 4.61 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 0.93 0.00 0.00 103 V 8.60 5.03 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 0.60 0.00 0.00 0.95 0.00 0.00 104 K 9.37 4.75 0.00 1.72 1.57 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.84 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.29 1.34 7.81 105 G 8.10 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 0.00 0.00 0.00 0.00 106 E 8.14 4.47 0.00 2.31 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 107 A 8.97 3.93 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 0.00 108 K 8.17 3.85 0.00 2.16 1.81 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.50 7.81 109 K 7.97 4.06 0.00 2.06 2.03 0.00 1.88 0.00 0.00 1.87 0.00 0.00 3.18 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.68 1.80 7.81 110 I 7.77 3.62 1.95 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 1.36 0.62 0.86 0.00 0.00 111 K 8.55 4.00 0.00 1.84 2.00 0.00 1.86 0.00 0.00 1.58 0.00 0.00 3.12 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.59 1.45 7.81 112 M 7.69 3.98 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.77 0.00 113 I 7.42 3.34 1.83 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.08 0.75 0.00 0.00 114 A 7.84 3.88 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 0.00 115 D 8.08 4.37 0.00 2.77 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 K 7.91 3.99 0.00 1.95 1.79 0.00 1.70 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.60 7.81 117 L 8.02 3.95 0.00 1.67 1.70 0.87 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 118 L 8.08 4.00 0.00 1.64 1.72 0.91 0.95 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 0.00 119 S 7.80 4.31 0.00 3.99 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 0.00 120 L 6.88 4.00 0.00 1.92 1.54 0.90 0.71 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 0.00 121 K 8.33 4.30 0.00 1.94 1.93 0.00 1.48 0.00 0.00 1.83 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.43 7.81 122 G 8.98 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 V 7.17 4.04 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 0.87 0.00 0.00 1.00 0.00 0.00 124 K 9.21 4.47 0.00 1.74 1.88 0.00 1.82 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.42 7.81 125 H 7.46 4.76 0.00 3.17 3.12 0.00 5.72 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 0.00 126 G 8.06 4.81 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 0.00 0.00 0.00 127 K 7.85 4.58 0.00 1.77 1.60 0.00 1.74 0.00 0.00 1.78 0.00 0.00 2.99 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.42 7.81 128 L 8.52 5.00 0.00 1.67 1.57 0.92 0.87 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 0.00 129 V 9.08 4.73 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 1.07 0.00 0.00 0.97 0.00 0.00 130 M 9.37 5.34 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.66 0.00 131 T 8.96 4.93 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 1.19 0.00 0.00 132 S 8.49 3.98 0.00 2.87 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 0.00 133 T 7.65 4.45 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 1.25 0.00 0.00 134 G 8.63 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 0.00 135 K 7.88 4.24 0.00 1.79 1.94 0.00 1.78 0.00 0.00 1.76 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.51 7.81 136 E 8.02 4.85 0.00 2.54 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 2.46 2.29 0.00 137 L 8.39 4.81 0.00 1.60 1.61 0.97 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 138 V 8.87 4.13 2.13 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 0.71 0.00 0.00 1.09 0.00 0.00