NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3686 8.3044 118.1904 55.0761 32.5300 174.5918 2 H 4.2013 8.7224 121.7050 55.3679 30.3053 172.9868 3 L 5.0467 8.0344 125.8100 51.1382 46.0614 176.7061 4 T 4.0694 8.5034 112.6627 61.0503 70.8869 173.8400 5 P 4.2150 0.0000 0.0000 65.8018 31.4066 178.4649 6 E 3.9507 8.1509 118.1660 59.3059 29.2331 178.9685 7 E 3.8791 8.1535 118.4476 59.3960 29.5838 179.4144 8 K 3.8594 8.1391 119.7623 59.4154 32.1840 178.7984 9 S 4.0622 8.1887 113.3511 61.2341 62.3009 176.0071 10 A 3.9970 8.2032 123.6883 54.9701 18.1165 179.8354 11 V 3.3831 7.9007 117.0431 66.3957 31.7626 178.4671 12 T 4.0073 8.0948 109.4319 64.6340 68.3596 176.2909 13 A 4.0184 8.0461 122.8848 54.9793 18.7749 179.0875 14 L 3.9645 8.0610 118.8694 58.0179 42.1627 178.9718 15 W 4.4092 8.7954 128.6289 60.3410 30.4558 178.1647 16 G 3.7582 8.1272 104.5331 47.1017 0.0000 175.1332 17 K 4.2518 7.9075 119.1874 56.9049 32.7071 177.3003 18 V 3.6407 6.9584 119.7493 62.0950 32.0507 176.0841 19 N 4.4732 8.2201 125.1821 52.5074 38.4571 175.6162 20 V 3.4438 7.9440 127.7300 65.8159 31.8944 177.1769 21 D 4.3490 7.9876 118.1814 57.2698 40.7509 178.2803 22 E 3.8426 8.2081 119.2374 59.3570 29.8022 178.8461 23 V 3.6237 7.9738 118.6753 65.7795 31.4721 178.2540 24 G 3.7435 8.5868 106.1871 47.7669 0.0000 175.9984 25 G 3.6256 8.1696 108.4521 47.3126 0.0000 175.5072 26 E 3.8980 8.3300 121.4307 59.0469 29.6504 178.8241 27 A 3.9450 8.4319 121.3045 55.3042 18.4415 179.0344 28 Y 3.7101 8.3649 118.3506 60.4975 38.8562 178.2359 29 G 3.6303 8.3238 106.7716 48.0456 0.0000 175.9175 30 R 3.8895 8.1670 120.9081 58.4861 29.9929 178.7815 31 L 3.9096 7.9915 120.4805 58.3886 42.1567 179.2459 32 L 4.0367 7.5341 119.3601 56.5905 41.2287 179.7469 33 V 3.5060 7.2796 117.8507 65.9251 31.7061 178.0332 34 V 3.4746 7.7816 116.8594 64.3910 32.7750 175.6259 35 Y 3.7108 7.2208 115.8981 54.6724 37.7847 174.3035 36 P 4.8795 0.0000 0.0000 63.9537 32.0289 178.3440 37 W 4.3727 8.1684 116.9106 59.3503 27.6130 177.7928 38 T 4.1569 7.7741 110.9252 64.1910 68.0719 175.9812 39 Q 4.4431 8.1929 121.3283 57.9529 28.4319 178.1463 40 R 3.7346 7.6136 117.0505 58.7928 29.2186 177.7961 41 F 4.3426 6.9492 114.5939 57.1579 39.5925 175.6102 42 F 4.5397 7.8072 118.6900 56.5794 39.8284 177.1573 43 E 4.0158 8.5422 122.4794 59.2946 29.4207 178.3884 44 S 4.6934 8.0745 110.3384 58.4549 63.4721 174.4308 45 F 4.5691 8.5619 119.2776 58.1541 39.6682 176.9214 46 G 3.9202 8.1297 106.8015 44.5557 0.0000 173.4137 47 D 4.5025 8.5763 123.8306 54.4673 41.2928 176.1654 48 L 4.9205 8.3685 125.8940 54.4111 43.2190 177.9402 49 S 4.3003 8.6642 117.0898 60.8159 63.3116 174.7651 50 T 4.7493 7.4387 109.4259 58.1453 73.0546 172.7167 51 P 4.2272 0.0000 0.0000 66.0305 31.3334 178.7112 52 D 4.3179 8.0976 116.8705 57.2234 40.5315 178.5590 53 A 3.9895 7.7417 120.3708 54.9921 18.7892 179.5855 54 V 3.7047 7.8230 116.7002 66.6344 31.4728 178.3150 55 M 4.2320 8.1590 117.1773 57.7490 31.8697 178.0812 56 G 3.9579 7.8100 103.2362 43.7293 0.0000 173.2354 57 N 4.5153 7.5286 121.2668 52.5766 39.5570 174.0186 58 P 4.2601 0.0000 0.0000 65.5364 31.3960 178.8773 59 K 3.6605 8.1801 117.5720 58.9349 31.7065 179.5684 60 V 3.7250 7.9110 118.1579 66.0942 31.5686 178.1258 61 K 3.9404 8.1688 117.9726 59.3700 31.8451 179.2587 62 A 3.9471 8.1569 121.2863 55.0257 18.1837 179.4986 63 Q 3.9120 8.2538 118.3580 59.2451 29.0548 178.6816 64 G 3.4740 8.1394 107.0173 47.6242 0.0000 175.8477 65 K 4.0183 8.1631 120.7867 59.1161 32.0510 179.5898 66 K 3.9726 8.0025 118.7680 59.4182 31.9624 179.5987 67 V 3.6071 7.8702 118.4963 66.1305 31.5615 177.9004 68 L 4.3338 8.4646 120.1674 57.6087 41.8935 179.0273 69 G 3.7592 8.5097 106.1578 47.7812 0.0000 175.6111 70 A 4.1265 8.2474 123.3767 54.7161 18.1918 179.3709 71 F 4.1752 8.4363 118.4120 61.6330 39.9017 176.8499 72 S 4.1124 8.8933 113.0443 61.7107 62.3776 175.8827 73 D 4.4942 8.4578 121.5937 57.3817 40.4728 179.0920 74 G 3.5182 8.0347 106.0105 47.2845 0.0000 175.2236 75 L 3.8553 7.1931 119.0250 56.1499 41.6175 178.0476 76 A 4.3068 7.4691 119.4497 52.6569 19.1720 176.7708 77 H 4.8971 8.1396 115.6367 55.0786 30.0562 175.8300 78 L 3.9296 8.0852 120.9459 57.6471 41.6587 178.4051 79 D 4.5305 7.9261 116.3910 55.8792 41.7786 176.5189 80 N 5.0160 8.1370 117.8830 51.6214 40.3509 174.5398 81 L 4.0993 7.8952 122.8392 57.3860 42.0884 179.0159 82 K 4.0731 8.0610 117.3688 59.5899 31.8528 179.1279 83 G 3.6788 8.2570 105.3870 48.0060 0.0000 175.5286 84 T 3.6724 7.7833 114.5117 63.9164 67.4924 175.3232 85 F 4.7222 7.9265 117.3607 57.0522 39.3211 177.3252 86 A 4.0846 7.6414 122.3888 55.6479 18.2055 180.3484 87 T 3.8512 7.8546 113.6718 66.8969 68.5408 176.8446 88 L 4.1707 7.9828 120.3527 57.4842 41.6948 179.3361 89 S 4.4286 8.4190 115.1206 61.1130 62.4357 176.1075 90 E 3.9253 8.3504 121.2353 59.1086 29.1536 179.0801 91 L 3.9020 7.9978 120.4060 58.7195 42.1742 178.9536 92 H 4.2182 8.6146 116.1772 58.7344 28.7212 177.3541 93 C 3.5066 7.7901 120.7398 62.3665 31.1596 175.3491 94 D 4.4124 8.3071 120.0167 56.1771 40.5946 177.7939 95 K 4.2006 7.7206 117.8328 57.8871 33.4601 177.4718 96 L 4.2088 7.7574 116.6026 54.1895 42.5618 176.1103 97 H 4.1607 7.3569 113.9176 56.7075 26.6233 175.2667 98 V 3.9020 7.8755 118.7729 60.8462 32.3818 174.8206 99 D 4.3611 8.8021 127.3208 53.9301 41.6333 175.2786 100 P 3.1568 0.0000 0.0000 64.3847 31.8141 177.9118 101 E 3.8861 8.3494 119.2008 59.1934 29.2483 178.3238 102 N 4.2359 7.9453 116.6450 56.3532 38.5158 177.2140 103 F 4.4554 7.3962 119.0733 60.6272 38.9663 177.9754 104 R 3.9686 7.9438 117.3371 59.0741 29.9734 178.7968 105 L 3.7244 7.8099 118.8262 57.6649 41.5664 179.3571 106 L 4.0046 8.1086 120.3718 57.9876 42.0354 179.0851 107 G 3.6998 8.2313 105.7010 47.9843 0.0000 175.2990 108 N 4.4044 8.2158 118.9990 56.0541 38.5076 177.6949 109 V 3.6094 7.9143 119.5605 65.8650 31.5397 177.7177 110 L 3.8855 8.3342 120.5432 58.1289 41.8767 179.0598 111 V 3.5964 7.9145 118.0733 66.3416 31.4075 177.7594 112 C 4.0957 8.1054 116.3897 62.7939 27.8628 176.3378 113 V 3.5252 8.0618 120.1537 65.9513 31.0323 178.1372 114 L 3.8498 8.0068 118.8564 57.4968 41.3380 179.3199 115 A 3.7095 7.2768 120.7100 55.3190 18.1010 179.1525 116 H 4.1432 8.0908 115.8223 59.6362 29.9759 176.6484 117 H 4.0830 8.1307 119.2157 58.6012 30.1658 176.5090 118 F 4.5410 8.5878 118.3419 57.0366 39.5872 177.2302 119 G 3.8156 8.8195 108.5128 46.0955 0.0000 177.0250 120 K 3.9231 8.9448 121.4275 59.1990 32.0211 177.6709 121 E 4.0734 8.0380 118.2574 58.4621 30.0238 177.1536 122 F 4.5179 8.0873 123.3531 57.1079 37.8654 175.0742 123 T 4.2086 7.2977 115.8765 60.1866 71.4350 173.5609 124 P 4.1878 0.0000 0.0000 65.3729 31.2938 177.2310 125 P 4.2540 0.0000 0.0000 65.6273 31.3324 178.6978 126 V 3.5151 7.4597 118.0375 65.7008 31.4225 177.6672 127 Q 3.5570 7.8696 119.4982 59.0317 28.8207 178.1984 128 A 4.0103 8.0480 121.4355 55.0601 18.4149 179.3685 129 A 3.8731 7.9687 119.1968 55.7256 18.4219 179.5437 130 Y 3.8512 8.2194 115.1192 61.1595 37.9308 178.7658 131 Q 4.1259 8.8675 119.4712 58.8924 28.7376 178.9651 132 K 3.9261 8.0565 119.4451 59.5151 32.0723 179.5488 133 V 3.4945 7.7651 118.2228 66.1955 31.4116 178.5437 134 V 3.8453 8.3713 112.3645 64.2645 31.2513 178.4744 135 A 4.0971 8.2583 120.8643 55.1292 18.1821 179.9440 136 G 3.4986 8.3772 104.5597 47.8032 0.0000 176.1728 137 V 3.3329 8.1994 120.8117 65.6003 31.5828 177.9448 138 A 3.8653 8.1457 120.6996 55.3101 17.9996 179.3732 139 N 4.3085 8.2250 113.8726 56.3547 39.0014 177.2325 140 A 4.1701 8.1876 122.3581 55.2064 18.1024 179.7510 141 L 3.8906 8.1083 117.4881 57.2554 41.6120 178.8280 142 A 4.2694 8.0269 119.5530 53.5330 18.5084 178.7459 143 H 4.2763 8.0188 116.5371 58.6662 30.0400 175.8685 144 K 4.3798 8.1803 117.5033 56.4292 32.2793 176.6207 145 Y 4.1432 7.9921 117.6368 58.5745 38.4239 175.7875 146 H 4.4111 8.3181 116.9543 56.2977 28.1038 173.4720 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 4.37 0.00 2.12 2.12 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 2.42 2.63 0.00 2 H 8.72 4.20 0.00 3.21 3.23 0.00 5.67 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.03 5.05 0.00 1.52 1.42 0.81 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.50 4.07 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 1.26 0.00 0.00 5 P 0.00 4.22 0.00 2.26 2.31 0.00 3.68 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.03 0.00 6 E 8.15 3.95 0.00 2.05 2.02 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 2.39 2.45 0.00 7 E 8.15 3.88 0.00 2.21 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 2.29 2.28 0.00 8 K 8.14 3.86 0.00 1.74 1.74 0.00 1.57 0.00 0.00 1.52 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.35 7.81 9 S 8.19 4.06 0.00 3.95 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 A 8.20 4.00 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 11 V 7.90 3.38 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 0.67 0.00 0.00 0.46 0.00 0.00 12 T 8.09 4.01 4.28 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 1.22 0.00 0.00 13 A 8.05 4.02 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 14 L 8.06 3.96 0.00 1.96 2.02 -0.01 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.80 4.41 0.00 3.85 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.13 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.91 4.25 0.00 2.12 2.09 0.00 1.66 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.63 7.81 18 V 6.96 3.64 1.19 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 -0.03 0.00 0.00 0.86 0.00 0.00 19 N 8.22 4.47 0.00 2.67 2.54 0.00 0.00 6.84 7.71 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 20 V 7.94 3.44 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 1.33 0.00 0.00 0.89 0.00 0.00 21 D 7.99 4.35 0.00 2.70 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 22 E 8.21 3.84 0.00 1.95 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 2.28 0.00 23 V 7.97 3.62 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 0.91 0.00 0.00 0.70 0.00 0.00 24 G 8.59 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.17 3.63 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 0.00 26 E 8.33 3.90 0.00 2.13 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 2.26 2.34 0.00 27 A 8.43 3.95 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 28 Y 8.36 3.71 0.00 3.29 2.97 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 29 G 8.32 3.63 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 0.00 30 R 8.17 3.89 0.00 1.99 1.91 0.00 3.10 0.00 0.00 3.03 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.72 0.00 31 L 7.99 3.91 0.00 1.61 1.53 0.86 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.53 4.04 0.00 1.84 1.66 0.74 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.28 3.51 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 0.71 0.00 0.00 0.94 0.00 0.00 34 V 7.78 3.47 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.72 0.00 0.00 35 Y 7.22 3.71 0.00 2.60 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 36 P 0.00 4.88 0.00 2.31 2.27 0.00 3.68 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 1.91 0.00 37 W 8.17 4.37 0.00 3.54 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 38 T 7.77 4.16 4.35 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 1.05 0.00 0.00 39 Q 8.19 4.44 0.00 2.27 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.79 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 40 R 7.61 3.73 0.00 1.63 1.94 0.00 3.03 0.00 0.00 2.73 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.50 0.00 41 F 6.95 4.34 0.00 1.73 2.39 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 42 F 7.81 4.54 0.00 2.91 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 0.00 0.00 0.00 0.00 43 E 8.54 4.02 0.00 1.96 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 2.26 2.22 0.00 44 S 8.07 4.69 0.00 4.11 4.08 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 0.00 0.00 0.00 0.00 45 F 8.56 4.57 0.00 3.28 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 46 G 8.13 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 8.58 4.50 0.00 2.66 2.63 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 48 L 8.37 4.92 0.00 1.67 1.64 1.04 1.06 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 49 S 8.66 4.30 0.00 4.00 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 50 T 7.44 4.75 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 1.21 0.00 0.00 51 P 0.00 4.23 0.00 2.15 2.11 0.00 3.59 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 52 D 8.10 4.32 0.00 2.68 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 53 A 7.74 3.99 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.82 3.70 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 1.02 0.00 0.00 0.99 0.00 0.00 55 M 8.16 4.23 0.00 2.01 2.10 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 2.61 2.87 0.00 56 G 7.81 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 57 N 7.53 4.52 0.00 3.04 2.86 0.00 0.00 7.13 7.32 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 58 P 0.00 4.26 0.00 2.12 2.03 0.00 3.61 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.14 0.00 59 K 8.18 3.66 0.00 1.47 0.74 0.00 1.63 0.00 0.00 1.10 0.00 0.00 2.77 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.10 1.21 7.81 60 V 7.91 3.73 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 1.08 0.00 0.00 61 K 8.17 3.94 0.00 1.82 1.82 0.00 1.89 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.45 7.81 62 A 8.16 3.95 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 63 Q 8.25 3.91 0.00 2.38 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 1.85 1.22 0.00 64 G 8.14 3.47 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 0.00 0.00 0.00 0.00 65 K 8.16 4.02 0.00 1.96 1.88 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.57 1.68 7.81 66 K 8.00 3.97 0.00 1.99 1.88 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.58 7.81 67 V 7.87 3.61 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 1.25 0.00 0.00 0.89 0.00 0.00 68 L 8.46 4.33 0.00 1.97 1.81 0.80 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.51 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 8.25 4.13 1.56 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 71 F 8.44 4.18 0.00 3.08 3.41 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 72 S 8.89 4.11 0.00 4.62 4.33 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 73 D 8.46 4.49 0.00 2.89 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 74 G 8.03 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 75 L 7.19 3.86 0.00 1.43 1.42 0.05 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.47 4.31 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.14 4.90 0.00 3.12 3.12 0.00 5.63 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.09 3.93 0.00 1.54 1.64 0.76 0.93 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 79 D 7.93 4.53 0.00 2.64 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.14 5.02 0.00 2.62 2.60 0.00 0.00 7.07 6.56 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 81 L 7.90 4.10 0.00 1.76 1.84 0.89 0.91 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 82 K 8.06 4.07 0.00 1.66 1.76 0.00 1.65 0.00 0.00 1.37 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.46 7.81 83 G 8.26 3.68 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 0.00 0.00 0.00 84 T 7.78 3.67 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 0.55 0.00 0.00 85 F 7.93 4.72 0.00 3.25 2.95 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 86 A 7.64 4.08 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 87 T 7.85 3.85 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 1.22 0.00 0.00 88 L 7.98 4.17 0.00 1.89 1.86 1.11 0.91 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 89 S 8.42 4.43 0.00 4.17 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 90 E 8.35 3.93 0.00 2.06 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.44 0.00 91 L 8.00 3.90 0.00 1.88 1.93 0.91 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.61 4.22 0.00 3.73 3.77 0.00 5.86 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.79 3.51 0.00 1.23 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 D 8.31 4.41 0.00 2.69 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 7.72 4.20 0.00 1.68 1.83 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.30 1.47 7.81 96 L 7.76 4.21 0.00 1.71 1.58 0.67 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.36 4.16 0.00 3.53 3.42 0.00 5.64 0.00 0.00 0.00 0.00 8.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.88 3.90 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 0.16 0.00 0.00 0.39 0.00 0.00 99 D 8.80 4.36 0.00 2.78 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 3.16 0.00 1.94 1.91 0.00 3.35 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.57 0.00 101 E 8.35 3.89 0.00 2.02 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 2.31 2.39 0.00 102 N 7.95 4.24 0.00 2.53 2.73 0.00 0.00 6.89 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 F 7.40 4.46 0.00 3.12 2.87 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 0.00 104 R 7.94 3.97 0.00 1.93 1.97 0.00 3.31 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.73 0.00 105 L 7.81 3.72 0.00 1.64 1.22 0.66 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.11 4.00 0.00 1.71 1.84 0.85 1.05 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 0.00 107 G 8.23 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 0.00 0.00 0.00 108 N 8.22 4.40 0.00 2.94 2.95 0.00 0.00 6.70 7.08 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 0.00 109 V 7.91 3.61 2.23 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 1.11 0.00 0.00 1.14 0.00 0.00 110 L 8.33 3.89 0.00 1.72 1.78 0.95 0.39 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 0.00 111 V 7.91 3.60 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 1.32 0.00 0.00 1.18 0.00 0.00 112 C 8.11 4.10 0.00 3.19 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 0.00 113 V 8.06 3.53 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 1.03 0.00 0.00 0.96 0.00 0.00 114 L 8.01 3.85 0.00 0.97 1.18 0.69 0.99 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 0.00 115 A 7.28 3.71 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 0.00 116 H 8.09 4.14 0.00 3.17 3.44 0.00 5.95 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 0.00 117 H 8.13 4.08 0.00 3.00 2.90 0.00 5.99 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.59 4.54 0.00 3.28 3.08 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 0.00 0.00 0.00 0.00 119 G 8.82 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 0.00 0.00 0.00 120 K 8.94 3.92 0.00 1.80 1.95 0.00 1.78 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.48 7.81 121 E 8.04 4.07 0.00 2.06 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 2.31 2.27 0.00 122 F 8.09 4.52 0.00 3.05 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 0.00 123 T 7.30 4.21 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 1.30 0.00 0.00 124 P 0.00 4.19 0.00 2.15 2.14 0.00 3.57 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 125 P 0.00 4.25 0.00 2.22 2.27 0.00 3.55 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 2.03 1.99 0.00 126 V 7.46 3.52 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 0.88 0.00 0.00 0.88 0.00 0.00 127 Q 7.87 3.56 0.00 1.68 2.10 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 2.42 2.60 0.00 128 A 8.05 4.01 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 0.00 129 A 7.97 3.87 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 0.00 130 Y 8.22 3.85 0.00 3.38 3.33 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 0.00 131 Q 8.87 4.13 0.00 2.22 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.75 2.63 0.00 132 K 8.06 3.93 0.00 2.00 1.84 0.00 1.85 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.63 7.81 133 V 7.77 3.49 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 0.92 0.00 0.00 0.72 0.00 0.00 134 V 8.37 3.85 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 0.94 0.00 0.00 1.12 0.00 0.00 135 A 8.26 4.10 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 0.00 136 G 8.38 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 0.00 137 V 8.20 3.33 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 0.58 0.00 0.00 0.77 0.00 0.00 138 A 8.15 3.87 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 0.00 139 N 8.23 4.31 0.00 2.83 2.90 0.00 0.00 7.04 8.16 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 0.00 140 A 8.19 4.17 1.47 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 0.00 0.00 0.00 141 L 8.11 3.89 0.00 1.09 0.66 -0.05 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.03 4.27 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 0.00 143 H 8.02 4.28 0.00 3.40 3.55 0.00 5.75 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.18 4.38 0.00 1.85 1.85 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.53 1.78 7.81 145 Y 7.99 4.14 0.00 3.14 2.96 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 0.00 146 H 8.32 4.41 0.00 3.23 3.25 0.00 5.75 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