NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2499 8.3044 120.3344 54.8017 33.3834 174.6669 2 V 3.3999 8.0811 125.4515 62.6718 31.9592 173.6821 3 K 4.5515 9.4047 128.2592 54.5699 36.0563 174.2758 4 E 5.3767 8.5808 119.8902 54.7209 32.9578 175.5501 5 F 4.7806 9.5870 124.3348 56.6486 42.7396 173.1567 6 N 5.5830 8.3134 122.7444 51.9972 42.1067 173.4202 7 T 4.7856 8.9010 116.4537 61.5145 71.8390 171.6407 8 Q 5.1187 8.3901 119.5780 55.7994 31.5431 173.5900 9 T 4.6508 8.8789 113.6743 60.8812 71.4314 171.7757 10 E 4.8899 8.8193 129.2800 55.0339 30.8370 174.7741 11 L 4.9134 9.1262 127.7393 52.6874 44.4477 177.0760 12 S 4.5796 8.9089 119.2797 56.0391 61.7139 173.7431 13 V 4.5572 7.0154 116.0568 59.3984 36.3143 176.1628 14 R 4.4291 8.2682 122.4111 55.0071 31.9767 177.6668 15 L 4.0248 8.3556 125.3319 57.9338 42.2046 179.3681 16 E 4.0517 8.2088 117.6946 59.3960 29.5123 179.0936 17 A 4.0589 7.9765 120.4105 55.0016 18.4703 179.3193 18 L 3.9436 8.0010 118.9544 58.0281 42.1472 179.0094 19 W 4.2696 8.6460 128.4675 60.2251 30.5827 177.6007 20 A 3.8473 8.1735 120.8057 55.4691 17.4441 180.0977 21 V 3.5470 7.6157 110.0332 64.3609 31.4106 178.7251 22 L 3.9262 7.9015 119.4876 57.7317 42.0784 178.4273 23 S 4.3897 7.7342 111.9648 58.8572 63.4452 174.9651 24 K 4.2895 7.9246 118.9986 56.5337 34.7525 176.6569 25 D 4.6481 7.5653 116.3718 53.8113 41.2759 178.1686 26 F 4.3487 7.1984 118.0812 59.9846 37.4474 177.2100 27 I 3.7676 7.1291 119.3715 64.4851 37.3390 177.6801 28 T 4.1733 7.6022 115.5437 66.0779 68.8473 177.2865 29 V 3.5376 7.7903 120.1574 65.4275 31.4175 178.1465 30 V 3.6971 7.9331 118.1556 65.8636 31.2593 176.4361 31 P 4.3926 0.0000 0.0000 65.2604 30.9370 178.5869 32 K 3.9691 7.5394 117.1115 58.9948 32.2059 178.5225 33 V 4.1410 7.7723 110.5961 61.1908 33.4428 176.1967 34 L 4.8944 8.0243 119.3273 53.0985 41.4641 175.9233 35 P 4.4731 0.0000 0.0000 64.6730 32.0208 177.3308 36 H 4.7911 8.0834 114.6212 55.7132 29.3095 174.4556 37 I 4.2973 7.7089 119.2075 62.4507 39.2789 175.1431 38 V 4.7827 7.9463 119.4416 61.2256 32.5053 175.2815 39 K 4.3106 9.3770 130.2875 59.0965 32.5840 176.1766 40 D 4.6113 7.6107 116.7067 52.5788 42.6807 173.9835 41 V 4.4659 8.1280 118.6479 61.1712 33.8652 174.4290 42 Q 4.3544 8.9676 127.8937 54.6134 30.5660 174.6157 43 L 4.5750 8.3535 126.2232 54.2365 42.2366 175.7895 44 I 4.1315 8.6796 128.6496 63.5578 38.2790 176.0430 45 E 4.5207 8.1860 119.6951 56.4167 32.9533 176.1291 46 G 4.2944 9.0371 112.5594 45.2758 0.0000 172.7372 47 D 4.8118 8.6028 115.4957 52.9185 39.5983 177.0481 48 G 4.0241 8.8477 110.4438 45.7468 0.0000 174.4349 49 G 3.8218 7.8465 109.6481 43.6636 0.0000 172.4637 50 V 3.9774 8.2820 119.7928 65.0531 31.6636 177.5104 51 G 4.0371 9.4728 116.0484 45.1434 0.0000 173.6881 52 T 4.3389 7.9784 117.7117 63.6392 69.7618 173.4457 53 I 4.9760 8.6817 126.4196 59.5345 40.1628 174.6734 54 L 5.1863 9.1106 125.8322 52.9064 46.0475 175.4177 55 I 4.7302 8.4685 123.2128 59.5891 40.1120 174.6515 56 F 4.6354 8.9821 126.9644 56.1735 40.2562 174.7613 57 N 4.8323 8.6293 122.6486 52.4474 39.8290 175.4120 58 F 5.4161 8.7561 122.9062 55.9312 41.2274 175.7191 59 L 4.3711 8.8377 120.4749 54.1005 42.0374 177.1284 60 P 4.2357 0.0000 0.0000 65.9290 31.1645 177.3237 61 E 4.1228 8.1691 116.2784 57.3991 30.0648 176.3958 62 V 4.1668 8.0367 120.7770 61.1611 32.7419 174.5083 63 S 4.6113 8.2567 120.5014 55.5644 65.0713 171.7121 64 P 4.3747 0.0000 0.0000 63.3904 31.7665 176.1407 65 S 5.0353 8.8763 114.0844 58.3754 64.5970 172.4633 66 Y 4.5637 7.3345 118.1079 56.4780 41.5677 172.9891 67 Q 4.5480 8.6734 120.0053 54.5778 32.9856 172.9585 68 R 5.1115 9.2315 127.2571 55.0188 32.1885 174.7276 69 E 5.2820 9.4236 124.9270 54.5808 34.3943 173.9838 70 E 5.1283 9.1367 123.3557 54.2622 33.0343 174.9901 71 I 4.5468 8.9091 128.4499 61.9685 37.3441 176.3860 72 T 4.4271 9.0311 118.8543 62.3544 69.8627 174.8241 73 E 4.9484 8.0610 118.6397 54.9606 33.6286 174.6843 74 F 4.9768 8.6643 123.1896 57.7778 42.2316 173.1271 75 D 4.7231 9.4902 127.1732 52.5096 42.8174 175.5747 76 E 4.0326 9.3548 126.7518 59.4720 29.8273 180.2340 77 S 3.9554 8.1248 111.7789 60.5111 63.3067 174.8373 78 S 4.2534 7.7286 112.4341 57.3328 64.0368 173.0781 79 H 2.0000 6.7183 117.6551 56.7933 26.2777 173.7580 80 E 5.2408 7.7359 119.6275 54.4047 33.2009 175.1969 81 I 5.1286 9.2542 126.3709 59.3889 41.6949 173.7045 82 G 4.6322 9.3523 116.6677 43.5607 0.0000 171.8127 83 L 5.3646 9.2657 123.9924 52.7985 45.2793 175.1205 84 Q 4.9456 9.0921 125.5350 54.2057 31.4298 174.5008 85 V 4.3505 8.7638 127.6677 62.8884 31.5170 175.4848 86 I 4.4262 8.6955 121.3707 61.4651 39.6129 175.2944 87 E 4.5109 8.2812 121.8468 56.3693 33.2401 176.7026 88 G 3.1626 8.7699 113.7014 46.0038 0.0000 174.0648 89 G 3.5542 7.4376 109.3350 46.5669 0.0000 176.5304 90 Y 4.2312 8.8925 119.8774 60.9223 37.7025 177.8120 91 L 4.6785 7.6594 116.2310 55.7023 41.6047 177.4975 92 S 4.7467 8.3707 114.8704 58.3696 63.4046 174.7346 93 Q 5.0813 7.8437 117.6258 54.8230 29.5367 176.5244 94 G 4.1734 8.4126 106.0120 46.1119 0.0000 174.1444 95 L 4.6131 7.8291 120.5840 54.7097 42.3677 177.3131 96 S 4.7320 8.7665 116.9680 59.1876 64.6093 173.6799 97 Y 4.8054 7.8543 121.5866 56.5970 42.3896 172.7926 98 Y 5.0422 7.8084 126.3110 56.4331 42.7129 173.0130 99 K 5.0155 8.4906 126.9853 55.2671 36.6366 174.4936 100 T 4.9180 9.1919 123.4468 62.0048 71.5782 172.9783 101 T 5.0464 8.9972 123.3061 61.7709 71.5371 173.0388 102 F 5.3359 9.3027 125.5238 55.7331 41.6511 174.7959 103 K 5.0924 9.1383 123.8578 54.7217 35.2863 174.6096 104 L 5.4210 8.8989 127.7850 53.1778 44.0194 176.0591 105 S 4.6830 8.8642 116.3513 56.5658 67.0181 172.7297 106 E 4.4952 8.7334 122.6276 56.0464 30.2658 175.9540 107 I 4.1472 8.7097 127.5194 62.8027 38.3190 175.2092 108 E 4.7580 7.5235 116.9716 54.0130 33.4428 175.5890 109 E 3.9024 8.9059 119.6771 59.2822 29.4296 178.0490 110 D 4.9750 8.0401 115.9635 52.5817 40.0210 174.8598 111 K 4.8947 8.0832 118.6781 55.7423 36.0611 175.4108 112 T 4.9688 9.0984 121.1810 61.5614 72.1693 172.8732 113 L 4.5832 8.7690 129.2066 54.6084 43.8132 175.4364 114 V 4.8198 8.8374 126.5620 61.3302 33.8416 173.9880 115 N 5.0414 9.1697 126.6167 52.4601 40.4488 174.5153 116 V 4.6901 9.0129 123.1639 60.9791 34.6298 173.8588 117 K 4.9192 8.9366 129.9697 53.9372 34.5491 174.5215 118 I 4.7570 8.8533 128.8808 59.7253 39.6457 174.6451 119 S 5.4619 8.6583 123.7205 57.0720 65.3048 172.9567 120 Y 5.5466 8.6625 121.3011 56.4279 41.6450 172.9451 121 D 4.8268 9.1877 118.7746 53.4931 45.2936 173.4452 122 H 5.4085 8.7255 119.4372 54.0762 31.7723 173.6396 123 D 4.7981 8.9169 122.3260 53.3818 41.6118 177.4529 124 S 4.3395 9.0005 121.0087 60.4040 63.3055 174.4785 125 D 4.6434 8.5887 120.2274 54.6249 41.2477 176.1509 126 I 4.3960 7.3284 120.8499 59.5107 38.6639 175.5392 127 E 4.0457 8.8343 126.1941 58.9154 30.2392 177.0492 128 E 3.9633 8.0627 119.4093 56.1905 30.1219 175.4235 129 K 4.4751 8.2316 125.6968 54.5152 33.0617 174.2883 130 V 4.0331 8.1198 124.9772 61.3785 32.5861 176.2976 131 T 4.2942 7.9977 118.1562 60.2279 71.5454 173.9605 132 P 4.1004 0.0000 0.0000 65.1333 31.1668 178.7574 133 T 3.4445 7.4639 115.5944 66.3657 68.2462 176.0402 134 K 3.8223 7.7183 121.4781 59.6767 32.3287 179.0243 135 T 3.7537 7.5475 110.3669 64.7013 68.6671 176.6236 136 S 4.0880 7.9818 117.5896 61.2735 62.7953 176.5517 137 Q 4.0786 7.8230 121.1569 58.9084 28.4117 178.9616 138 S 4.1957 7.8708 116.3624 61.8116 62.8574 176.9117 139 T 4.1223 7.8830 118.2544 66.6912 68.1753 176.8085 140 L 4.1231 8.5106 121.4039 58.0052 41.5680 179.3322 141 M 4.0540 8.1711 118.2381 58.6132 32.2064 177.5250 142 Y 4.2936 8.1717 119.7080 60.9661 38.9178 178.1498 143 L 3.7190 8.0755 119.6976 57.8902 41.6836 179.8222 144 R 3.9279 8.2926 118.0834 59.3262 29.8895 179.3651 145 R 3.9898 8.2367 117.9909 59.1427 30.0313 179.1068 146 L 3.9398 7.8928 118.9422 57.5134 41.4439 178.9556 147 E 3.9258 8.3615 119.5639 59.4770 29.3509 179.0311 148 R 3.9207 7.9686 117.2850 59.5155 30.2373 177.3239 149 Y 4.2434 8.1793 118.7225 60.5771 38.8911 177.5431 150 L 4.2278 8.0811 117.2485 55.6597 42.1433 177.5597 151 S 4.4993 7.5681 119.9515 58.5040 63.2365 173.5637 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 4.25 0.00 1.92 1.96 0.00 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 2 V 8.08 3.40 1.72 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 0.37 0.00 0.00 0.14 0.00 0.00 3 K 9.40 4.55 0.00 0.79 1.36 0.00 1.60 0.00 0.00 1.58 0.00 0.00 2.34 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.19 1.32 7.81 4 E 8.58 5.38 0.00 1.81 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 2.21 2.24 0.00 5 F 9.59 4.78 0.00 3.14 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 6 N 8.31 5.58 0.00 2.54 2.61 0.00 0.00 6.51 7.05 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 7 T 8.90 4.79 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 1.36 0.00 0.00 8 Q 8.39 5.12 0.00 2.19 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.44 0.00 0.00 0.00 0.00 0.00 2.24 2.37 0.00 9 T 8.88 4.65 4.29 0.00 0.00 0.00 0.00 0.00 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 10 E 8.82 4.89 0.00 2.03 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 2.24 2.34 0.00 11 L 9.13 4.91 0.00 1.58 1.54 0.97 0.65 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 12 S 8.91 4.58 0.00 3.94 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 13 V 7.02 4.56 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 0.75 0.00 0.00 0.95 0.00 0.00 14 R 8.27 4.43 0.00 1.91 1.85 0.00 3.47 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.83 0.00 15 L 8.36 4.02 0.00 1.67 1.61 0.78 0.74 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 16 E 8.21 4.05 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.37 0.00 17 A 7.98 4.06 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 18 L 8.00 3.94 0.00 1.83 1.87 0.88 1.01 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 19 W 8.65 4.27 0.00 3.34 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 A 8.17 3.85 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 7.62 3.55 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 0.95 0.00 0.00 1.05 0.00 0.00 22 L 7.90 3.93 0.00 1.56 1.60 0.35 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 23 S 7.73 4.39 0.00 2.93 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 24 K 7.92 4.29 0.00 1.81 1.70 0.00 1.62 0.00 0.00 1.71 0.00 0.00 3.16 0.00 0.00 3.34 0.00 0.00 0.00 0.00 1.35 1.35 7.81 25 D 7.57 4.65 0.00 2.64 2.57 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 0.00 0.00 0.00 0.00 26 F 7.20 4.35 0.00 3.37 3.42 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 27 I 7.13 3.77 1.73 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.70 0.90 0.00 0.00 28 T 7.60 4.17 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 1.21 0.00 0.00 29 V 7.79 3.54 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 0.54 0.00 0.00 0.87 0.00 0.00 30 V 7.93 3.70 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 1.11 0.00 0.00 1.11 0.00 0.00 31 P 0.00 4.39 0.00 2.21 2.35 0.00 3.78 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.18 0.00 32 K 7.54 3.97 0.00 1.92 1.84 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.19 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.60 1.60 7.81 33 V 7.77 4.14 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 0.55 0.00 0.00 1.16 0.00 0.00 34 L 8.02 4.89 0.00 1.77 1.62 0.84 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 35 P 0.00 4.47 0.00 2.05 2.16 0.00 3.44 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 36 H 8.08 4.79 0.00 3.19 3.38 0.00 5.64 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 I 7.71 4.30 1.89 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 1.23 0.74 0.76 0.00 0.00 38 V 7.95 4.78 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 0.92 0.00 0.00 1.14 0.00 0.00 39 K 9.38 4.31 0.00 1.80 1.98 0.00 1.91 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.40 7.81 40 D 7.61 4.61 0.00 2.73 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 41 V 8.13 4.47 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 0.06 0.00 0.00 0.85 0.00 0.00 42 Q 8.97 4.35 0.00 1.81 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.61 0.00 0.00 0.00 0.00 0.00 2.18 2.32 0.00 43 L 8.35 4.57 0.00 1.63 1.55 0.97 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 44 I 8.68 4.13 1.93 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.89 0.87 0.00 0.00 45 E 8.19 4.52 0.00 1.99 1.72 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 2.26 2.28 0.00 46 G 9.04 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.60 4.81 0.00 2.69 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 48 G 8.85 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 49 G 7.85 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 50 V 8.28 3.98 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 0.86 0.00 0.00 1.08 0.00 0.00 51 G 9.47 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 0.00 0.00 0.00 52 T 7.98 4.34 4.32 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 1.32 0.00 0.00 53 I 8.68 4.98 1.86 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 1.35 1.06 0.91 0.00 0.00 54 L 9.11 5.19 0.00 1.45 1.01 0.63 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 55 I 8.47 4.73 1.72 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 1.20 0.66 0.78 0.00 0.00 56 F 8.98 4.64 0.00 2.62 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 57 N 8.63 4.83 0.00 2.74 2.68 0.00 0.00 6.56 7.41 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 58 F 8.76 5.42 0.00 3.00 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 59 L 8.84 4.37 0.00 1.70 1.63 1.09 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 60 P 0.00 4.24 0.00 2.20 2.22 0.00 3.80 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 61 E 8.17 4.12 0.00 1.99 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 2.33 2.25 0.00 62 V 8.04 4.17 2.29 0.00 0.00 0.00 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 0.87 0.00 0.00 63 S 8.26 4.61 0.00 3.82 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 64 P 0.00 4.37 0.00 2.01 1.83 0.00 3.65 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.04 0.00 65 S 8.88 5.04 0.00 4.03 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 0.00 66 Y 7.33 4.56 0.00 3.02 3.05 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 67 Q 8.67 4.55 0.00 2.09 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.83 0.00 0.00 0.00 0.00 0.00 2.17 2.16 0.00 68 R 9.23 5.11 0.00 2.07 2.00 0.00 3.13 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 69 E 9.42 5.28 0.00 2.13 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 2.23 2.29 0.00 70 E 9.14 5.13 0.00 1.99 1.77 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 2.22 2.41 0.00 71 I 8.91 4.55 2.12 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 1.32 0.69 1.19 0.00 0.00 72 T 9.03 4.43 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 1.29 0.00 0.00 73 E 8.06 4.95 0.00 2.08 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 0.00 2.44 2.32 0.00 74 F 8.66 4.98 0.00 3.17 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 75 D 9.49 4.72 0.00 2.71 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 E 9.35 4.03 0.00 2.17 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 0.00 2.97 2.55 0.00 77 S 8.12 3.96 0.00 3.91 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 78 S 7.73 4.25 0.00 3.90 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 79 H 6.72 2.00 0.00 3.20 2.62 0.00 5.75 0.00 0.00 0.00 0.00 8.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.74 5.24 0.00 1.98 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 0.00 2.26 2.42 0.00 81 I 9.25 5.13 1.86 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.86 1.08 0.00 0.00 82 G 9.35 4.63 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 83 L 9.27 5.36 0.00 1.68 1.59 1.04 0.68 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 84 Q 9.09 4.95 0.00 2.05 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.02 0.00 0.00 0.00 0.00 0.00 2.15 2.24 0.00 85 V 8.76 4.35 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 0.89 0.00 0.00 1.10 0.00 0.00 86 I 8.70 4.43 1.89 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 1.24 0.85 1.01 0.00 0.00 87 E 8.28 4.51 0.00 2.09 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 88 G 8.77 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 G 7.44 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 90 Y 8.89 4.23 0.00 2.72 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 7.66 4.68 0.00 1.82 1.73 1.04 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 92 S 8.37 4.75 0.00 3.87 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 93 Q 7.84 5.08 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.50 0.00 0.00 0.00 0.00 0.00 2.27 2.44 0.00 94 G 8.41 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 L 7.83 4.61 0.00 1.90 1.73 1.07 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 96 S 8.77 4.73 0.00 3.92 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 97 Y 7.85 4.81 0.00 3.12 2.90 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 98 Y 7.81 5.04 0.00 3.21 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 99 K 8.49 5.02 0.00 1.65 1.56 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.55 7.81 100 T 9.19 4.92 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 0.65 0.00 0.00 101 T 9.00 5.05 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 0.00 102 F 9.30 5.34 0.00 3.08 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 0.00 103 K 9.14 5.09 0.00 1.87 1.64 0.00 1.58 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.33 1.44 7.81 104 L 8.90 5.42 0.00 1.49 1.54 1.14 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.86 4.68 0.00 3.82 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 E 8.73 4.50 0.00 1.92 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.49 0.00 107 I 8.71 4.15 1.97 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 1.38 0.99 0.91 0.00 0.00 108 E 7.52 4.76 0.00 1.96 1.81 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 2.28 2.27 0.00 109 E 8.91 3.90 0.00 1.99 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 2.39 2.34 0.00 110 D 8.04 4.97 0.00 2.91 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 0.00 111 K 8.08 4.89 0.00 1.77 1.79 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.35 1.40 7.81 112 T 9.10 4.97 4.26 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 1.30 0.00 0.00 113 L 8.77 4.58 0.00 1.80 1.54 0.94 0.51 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 0.00 114 V 8.84 4.82 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 1.00 0.00 0.00 115 N 9.17 5.04 0.00 2.79 2.72 0.00 0.00 5.98 8.52 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 0.00 116 V 9.01 4.69 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 0.88 0.00 0.00 0.99 0.00 0.00 117 K 8.94 4.92 0.00 1.87 1.61 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.86 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.33 1.37 7.81 118 I 8.85 4.76 2.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.48 0.44 0.00 0.00 119 S 8.66 5.46 0.00 3.94 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 Y 8.66 5.55 0.00 3.11 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 0.00 121 D 9.19 4.83 0.00 2.68 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 0.00 122 H 8.73 5.41 0.00 3.12 3.25 0.00 5.94 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 D 8.92 4.80 0.00 2.78 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 0.00 124 S 9.00 4.34 0.00 4.03 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.59 4.64 0.00 2.81 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 0.00 126 I 7.33 4.40 1.90 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 1.20 0.56 0.96 0.00 0.00 127 E 8.83 4.05 0.00 1.91 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 2.29 2.35 0.00 128 E 8.06 3.96 0.00 2.04 1.81 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 2.47 2.29 0.00 129 K 8.23 4.48 0.00 1.62 1.61 0.00 1.41 0.00 0.00 1.31 0.00 0.00 2.79 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.23 1.36 7.81 130 V 8.12 4.03 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 0.57 0.00 0.00 0.93 0.00 0.00 131 T 8.00 4.29 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 132 P 0.00 4.10 0.00 1.39 1.29 0.00 3.66 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.19 0.00 133 T 7.46 3.44 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 1.20 0.00 0.00 134 K 7.72 3.82 0.00 1.77 1.80 0.00 1.46 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.38 7.81 135 T 7.55 3.75 3.86 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 0.00 0.00 136 S 7.98 4.09 0.00 4.01 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 0.00 137 Q 7.82 4.08 0.00 2.23 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.84 0.00 0.00 0.00 0.00 0.00 2.54 2.52 0.00 138 S 7.87 4.20 0.00 4.03 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 0.00 139 T 7.88 4.12 4.46 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 1.42 0.00 0.00 140 L 8.51 4.12 0.00 1.84 1.78 1.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 141 M 8.17 4.05 0.00 2.34 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 2.64 2.62 0.00 142 Y 8.17 4.29 0.00 3.05 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 0.00 143 L 8.08 3.72 0.00 1.93 1.71 1.16 0.65 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 0.00 144 R 8.29 3.93 0.00 2.02 2.00 0.00 3.16 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.89 0.00 145 R 8.24 3.99 0.00 2.06 2.03 0.00 3.35 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.98 0.00 146 L 7.89 3.94 0.00 1.65 1.59 0.31 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 147 E 8.36 3.93 0.00 2.02 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 0.00 2.32 2.34 0.00 148 R 7.97 3.92 0.00 1.88 2.00 0.00 3.36 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 1.70 1.66 0.00 149 Y 8.18 4.24 0.00 3.04 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 L 8.08 4.23 0.00 1.75 1.71 0.97 0.82 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 0.00 151 S 7.57 4.50 0.00 3.79 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