NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 H 4.9031 8.4331 117.8351 56.0526 30.0962 172.5781 3 G 3.8360 7.9858 116.9399 44.4902 0.0000 172.7750 4 F 4.5272 8.0190 124.3065 57.4065 40.3327 173.3535 5 T 4.3995 8.3705 113.3889 61.5341 69.7088 174.0678 6 T 4.6272 8.0270 111.6002 59.2414 71.4342 172.2169 7 P 4.6009 0.0000 0.0000 61.6516 32.6304 175.7441 8 S 4.3055 8.5081 114.6702 59.1196 63.7794 174.0922 9 R 5.2287 8.6809 121.7106 54.5334 34.7300 173.6469 10 A 5.2756 8.7996 120.3866 51.2414 23.3724 174.8903 11 I 5.2396 8.7943 117.5642 59.9896 42.0549 173.3560 12 A 5.3369 9.5462 129.1301 48.9859 22.5758 174.9382 13 V 4.7429 8.4767 120.2731 61.0908 34.2337 174.6030 14 L 4.6813 8.6765 127.7874 53.5753 43.7567 176.0347 15 S 4.7643 8.3916 118.2360 58.2293 64.2401 173.0714 16 T 4.7903 8.6050 123.2768 61.2792 72.5081 174.2264 17 E 4.1075 8.9500 121.8658 59.3778 29.5112 178.6250 18 T 4.3861 7.8489 107.0448 61.5562 70.6500 173.7806 19 I 4.8896 7.5317 122.7435 59.4506 40.5183 174.8731 20 R 5.1591 8.7991 124.6258 54.7656 34.6208 174.4344 21 G 4.3287 8.5852 108.2522 45.9137 0.0000 171.6706 22 N 5.6577 8.4065 117.1368 51.2740 42.4099 173.9142 23 I 4.8738 8.9023 123.4926 59.8402 40.8285 174.5543 24 T 5.1081 8.5110 123.4194 61.7336 71.8890 173.3482 25 F 5.3806 9.4052 123.5121 55.9181 42.6769 174.2125 26 T 4.9763 9.0470 113.5384 59.8257 72.0073 173.0396 27 Q 4.5965 8.2104 127.8591 56.3848 30.0174 175.2608 28 V 4.6950 8.6802 118.9328 59.3260 36.0799 174.4372 29 Q 3.8849 8.7205 118.5023 58.6884 28.7796 177.3210 30 D 4.2656 9.5714 120.4304 55.4775 38.2008 174.8409 31 G 3.8973 8.0236 105.5774 45.5478 0.0000 174.5069 32 K 4.4434 7.4963 118.5386 55.7105 34.2179 175.7838 33 V 4.8411 8.5607 120.8327 61.5176 34.3396 173.6659 34 H 5.0583 9.8065 129.1589 55.4749 31.2801 173.7075 35 V 4.5575 8.9239 127.2920 61.3229 33.1409 174.5700 36 Q 5.3400 8.4535 124.8334 53.5959 32.6744 175.5730 37 G 4.2340 6.9470 104.5022 46.1217 0.0000 171.0704 38 G 4.3976 7.6350 105.6938 45.0258 0.0000 172.2945 39 I 5.1063 8.3999 123.4596 59.4029 41.6881 174.5031 40 T 5.2524 9.6239 115.9720 60.6293 71.7968 173.6567 41 G 3.6945 8.1652 111.0213 45.9657 0.0000 173.8188 42 L 4.4229 7.0599 120.4875 51.3470 44.7157 174.3036 43 P 4.1820 0.0000 0.0000 61.3716 31.9504 174.3301 44 P 4.8225 0.0000 0.0000 61.5350 31.8771 177.0878 45 G 3.8383 7.6630 107.3654 45.2445 0.0000 170.3242 46 E 5.2970 7.4756 116.5652 54.8910 32.7422 175.0262 47 Y 4.7972 8.7859 118.0698 56.1179 42.9592 174.7819 48 G 4.1313 9.1884 111.6823 47.0384 0.0000 172.1844 49 F 5.4639 9.3918 126.0370 56.9846 42.6211 173.0600 50 H 5.3721 8.7407 122.1894 54.0917 34.0172 172.5485 51 V 4.4201 8.4902 120.7201 62.5673 32.4551 175.1837 52 H 5.1396 9.2813 125.6664 54.5212 30.6570 176.0490 53 E 3.9933 9.2205 122.1031 58.7527 29.9983 177.1685 54 K 4.5478 8.8337 118.6835 53.8358 35.1554 177.4227 55 G 4.4344 8.1938 111.0599 44.7525 0.0000 174.1738 56 D 4.7025 7.9053 119.0859 52.6352 42.3084 174.7849 57 L 4.7870 8.2158 125.9263 54.4440 42.1161 178.9301 58 S 4.2022 8.6198 116.4067 60.4253 63.0367 175.0806 59 G 4.0729 8.0376 110.3539 44.8610 0.0000 174.8535 60 G 3.8379 7.9045 109.8390 45.6644 0.0000 174.8457 61 C 4.3774 8.6569 114.9997 59.7743 37.7239 175.4669 62 L 3.9212 7.9640 122.1589 57.9892 41.5438 178.3636 63 S 4.4261 7.5261 110.8634 59.8384 63.5373 175.6851 64 T 4.3938 7.1686 115.6345 64.3620 68.7389 175.1760 65 G 3.7231 8.3848 109.4620 45.0651 0.0000 171.1665 66 S 4.8010 8.0900 114.9843 56.9009 66.5237 173.2153 67 H 4.6308 8.4295 116.5198 55.8364 29.3803 175.5651 68 F 4.3769 9.3416 125.8727 58.2499 39.7048 175.1353 69 N 4.8615 7.9336 125.5397 51.7804 38.9587 173.0336 70 P 4.1438 0.0000 0.0000 65.0035 32.1822 177.7666 71 E 4.2427 7.8137 116.2738 55.7806 30.1313 175.1784 72 H 4.1298 7.1696 114.3306 55.8086 26.6318 173.7682 73 K 4.5374 7.6576 117.8851 55.4570 35.1193 176.9577 74 D 4.8317 8.2951 120.2232 53.4683 43.2439 175.6787 75 H 4.2251 8.8238 121.1147 56.6173 30.4356 174.9265 76 G 4.2327 8.6973 112.4814 42.2053 0.0000 171.3138 77 H 4.2978 8.8168 118.7520 54.9651 30.2977 175.2840 78 P 4.3962 0.0000 0.0000 65.5531 31.2790 177.2905 79 N 4.5682 8.2770 113.5134 54.7016 38.9641 175.2039 80 D 4.5712 8.0090 118.8064 53.7779 41.6229 176.8119 81 V 3.6290 8.2990 121.9955 65.7418 31.9137 176.0787 82 N 4.6526 7.8741 120.3456 52.0887 37.3925 173.3144 83 R 5.1366 7.4812 117.7634 54.4994 32.7900 175.2677 84 H 4.4774 8.5549 115.7870 55.3886 29.4877 177.0157 85 V 3.5006 8.1486 121.7390 65.9846 31.5485 177.2562 86 G 3.9190 8.1548 106.7827 46.2162 0.0000 173.1486 87 D 4.9728 7.6288 120.6294 53.5974 39.1227 176.1175 88 L 4.3602 8.1221 122.4172 54.7865 43.2980 177.7070 89 G 4.2580 8.4097 104.1252 44.1840 0.0000 172.0262 90 N 5.6312 8.7604 119.5467 51.6380 42.1275 174.5047 91 V 4.3738 8.8906 115.0038 59.7405 34.5253 174.8487 92 V 4.9178 8.0387 123.2752 61.4536 33.6710 174.3664 93 F 4.7193 9.3666 126.8578 56.2587 41.3862 175.5080 94 D 5.1733 8.8796 122.8864 51.9414 41.6052 177.0346 95 E 4.0045 8.9578 117.1792 59.5338 28.0885 177.8554 96 N 4.7982 8.8131 115.5220 53.0019 38.5203 174.9328 97 H 5.2033 8.7083 114.1144 56.2909 27.1985 173.2045 98 Y 5.2440 7.9257 118.4862 55.8135 41.9336 173.9256 99 S 4.2912 7.8843 120.4732 55.0085 65.1418 172.3978 100 R 4.3461 7.9256 127.7916 55.1467 30.9449 175.1272 101 I 4.1370 8.3289 128.5328 60.0919 39.1359 175.0334 102 D 4.9964 8.4716 126.4571 53.8651 42.4409 173.7726 103 L 4.7400 8.9924 125.2934 54.3103 44.5078 174.5189 104 V 4.8892 8.3537 119.7273 61.2040 33.8201 174.0679 105 D 5.0965 9.2005 127.3942 52.3891 43.9616 175.6299 106 D 4.9260 8.8706 123.4135 53.2619 40.1215 176.2358 107 Q 4.4120 8.4869 121.6363 57.8706 30.1567 176.3344 108 I 4.0609 7.8063 109.1541 61.0935 38.3885 174.4365 109 S 4.7005 8.5552 115.0066 57.1206 65.5668 174.5490 110 L 4.2199 7.8204 120.0877 55.7658 41.7858 176.5738 111 S 4.4399 7.6270 111.7622 57.7095 66.3654 173.5791 112 G 3.8394 8.5936 107.8962 44.0557 0.0000 171.8511 113 P 4.5093 0.0000 0.0000 64.9303 31.8729 176.4275 114 H 4.9566 8.2510 116.2233 55.5328 28.8706 174.7159 115 G 3.9365 8.0172 110.5543 45.7855 0.0000 174.0959 116 I 3.8899 8.4729 116.9673 60.2411 38.3294 175.6192 117 I 3.7221 7.3099 123.1413 62.7965 37.5617 176.4131 118 G 3.8313 9.1776 113.8969 45.2347 0.0000 173.3715 119 R 4.7653 7.6179 119.0009 54.8693 33.2043 174.7924 120 A 5.1064 8.0232 120.0020 50.6496 22.5638 175.7840 121 V 4.3937 8.4901 120.8098 61.6777 33.8946 175.0392 122 V 4.7754 8.3589 126.3155 61.0478 34.8455 173.5994 123 L 5.3160 9.0488 130.3777 54.1286 43.8981 175.0686 124 H 5.4657 8.9665 123.0701 53.9268 31.0637 174.5994 125 E 4.3970 9.2157 118.5190 58.6005 30.3406 176.2427 126 K 4.7637 8.5173 118.6744 54.7043 36.5626 175.3799 127 A 4.2911 8.2686 121.1447 51.9754 19.5225 176.2866 128 D 4.7790 8.0480 121.4510 53.8626 42.0744 175.8907 129 D 4.3422 9.0835 124.8610 52.8741 39.8418 176.6678 130 Y 3.7221 9.1265 116.9127 59.3566 35.7771 170.8507 131 G 4.3348 8.7432 105.8810 46.2760 0.0000 175.1436 132 K 4.3946 8.0127 117.2034 55.9142 32.9728 176.4722 133 S 4.7034 7.7671 113.9892 57.0368 65.1780 172.9479 134 D 4.7009 8.3274 117.6262 53.7671 40.4881 176.2875 135 H 4.2094 7.9873 121.0644 55.5846 30.3662 174.2292 136 P 4.2720 0.0000 0.0000 65.6751 31.4873 177.1260 137 D 4.6046 8.1747 115.8931 55.0410 41.7828 177.9920 138 S 4.0448 8.2004 115.2217 61.5500 62.4998 175.8557 139 R 4.3937 8.0051 116.3224 56.8373 30.3706 177.6166 140 K 4.3189 8.0769 117.0742 57.5526 33.5427 177.0900 141 T 4.1099 8.1607 106.1459 60.0568 70.1751 175.4344 142 G 3.6694 8.1100 110.7910 44.8918 0.0000 173.0412 143 N 4.0537 7.5761 115.3447 54.4059 37.7956 174.4230 144 A 4.4594 6.9255 118.5251 51.2376 20.1099 179.3012 145 G 4.0437 7.9529 103.0546 44.3831 0.0000 172.8536 146 G 3.9375 8.8536 108.0977 46.3428 0.0000 172.8188 147 R 4.8344 8.3837 118.6112 54.7160 30.9120 176.9326 148 V 4.0916 8.9864 118.4327 63.1158 32.7385 176.3531 149 A 4.7406 7.6744 119.6575 51.3138 22.2926 174.0393 150 C 5.3410 8.6420 113.0846 54.4213 46.2563 173.4411 151 G 4.3932 8.8101 106.0227 44.5974 0.0000 172.4036 152 V 4.1884 8.3783 123.0870 62.6494 33.1914 175.0853 153 I 4.2159 8.9398 129.5281 61.0826 37.7784 175.4709 154 G 4.3995 9.2873 115.1935 44.0790 0.0000 171.9398 155 I 4.2322 8.2049 121.6295 61.0176 37.7119 176.1733 156 L 4.3320 8.3631 128.7236 55.1167 41.5660 175.9897 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 H 8.43 4.90 0.00 3.15 3.30 0.00 5.63 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 3 G 7.99 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 F 8.02 4.53 0.00 3.12 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 5 T 8.37 4.40 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 1.26 0.00 0.00 6 T 8.03 4.63 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 1.31 0.00 0.00 7 P 0.00 4.60 0.00 2.22 2.13 0.00 3.80 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 8 S 8.51 4.31 0.00 3.82 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 9 R 8.68 5.23 0.00 1.76 1.94 0.00 3.13 0.00 0.00 3.37 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 10 A 8.80 5.28 1.20 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 0.00 0.00 11 I 8.79 5.24 1.95 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 1.23 1.44 1.02 0.00 0.00 12 A 9.55 5.34 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 13 V 8.48 4.74 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 0.94 0.00 0.00 1.03 0.00 0.00 14 L 8.68 4.68 0.00 1.80 1.60 0.98 0.60 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 15 S 8.39 4.76 0.00 3.85 3.73 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 16 T 8.60 4.79 4.37 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 1.26 0.00 0.00 17 E 8.95 4.11 0.00 1.94 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 2.31 2.25 0.00 18 T 7.85 4.39 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 19 I 7.53 4.89 1.85 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.83 0.93 0.00 0.00 20 R 8.80 5.16 0.00 1.72 1.77 0.00 3.34 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.73 0.00 21 G 8.59 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 0.00 0.00 0.00 22 N 8.41 5.66 0.00 2.59 2.69 0.00 0.00 7.17 6.71 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 23 I 8.90 4.87 1.98 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 1.31 0.50 0.62 0.00 0.00 24 T 8.51 5.11 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 1.16 0.00 0.00 25 F 9.41 5.38 0.00 2.90 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 26 T 9.05 4.98 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 1.24 0.00 0.00 27 Q 8.21 4.60 0.00 2.17 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.65 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 28 V 8.68 4.70 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 0.93 0.00 0.00 0.97 0.00 0.00 29 Q 8.72 3.88 0.00 2.15 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.28 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 30 D 9.57 4.27 0.00 2.83 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 31 G 8.02 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 32 K 7.50 4.44 0.00 1.80 1.90 0.00 1.61 0.00 0.00 1.58 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.47 1.40 7.81 33 V 8.56 4.84 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 1.02 0.00 0.00 34 H 9.81 5.06 0.00 3.21 3.17 0.00 5.63 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 V 8.92 4.56 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 0.69 0.00 0.00 1.03 0.00 0.00 36 Q 8.45 5.34 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.66 0.00 0.00 0.00 0.00 0.00 1.90 1.97 0.00 37 G 6.95 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 38 G 7.63 4.40 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 0.00 39 I 8.40 5.11 1.65 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.42 1.10 0.00 0.00 40 T 9.62 5.25 4.39 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 1.47 0.00 0.00 41 G 8.17 3.69 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 0.00 0.00 0.00 42 L 7.06 4.42 0.00 0.27 0.39 -0.46 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 43 P 0.00 4.18 0.00 2.17 2.01 0.00 3.52 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.94 0.00 44 P 0.00 4.82 0.00 2.25 2.26 0.00 3.45 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.97 0.00 45 G 7.66 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 7.48 5.30 0.00 1.91 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 2.01 2.14 0.00 47 Y 8.79 4.80 0.00 3.10 3.07 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 0.00 0.00 0.00 48 G 9.19 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 F 9.39 5.46 0.00 2.97 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 50 H 8.74 5.37 0.00 3.15 3.09 0.00 5.68 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.49 4.42 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 0.84 0.00 0.00 0.92 0.00 0.00 52 H 9.28 5.14 0.00 3.05 3.39 0.00 5.69 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 E 9.22 3.99 0.00 2.08 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 2.35 2.46 0.00 54 K 8.83 4.55 0.00 1.78 1.65 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.84 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.37 1.50 7.81 55 G 8.19 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 D 7.91 4.70 0.00 2.58 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 57 L 8.22 4.79 0.00 1.76 1.63 0.90 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 58 S 8.62 4.20 0.00 3.97 3.99 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 0.00 0.00 0.00 59 G 8.04 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 60 G 7.90 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 C 8.66 4.38 0.00 2.96 3.11 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 62 L 7.96 3.92 0.00 1.68 1.67 0.93 0.98 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 63 S 7.53 4.43 0.00 4.32 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 64 T 7.17 4.39 4.36 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 1.22 0.00 0.00 65 G 8.38 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 0.00 0.00 0.00 66 S 8.09 4.80 0.00 3.80 3.99 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 0.00 0.00 0.00 67 H 8.43 4.63 0.00 2.87 3.22 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 68 F 9.34 4.38 0.00 3.01 2.99 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 0.00 0.00 0.00 69 N 7.93 4.86 0.00 2.60 2.46 0.00 0.00 6.94 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 70 P 0.00 4.14 0.00 2.08 1.93 0.00 3.04 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.28 0.00 71 E 7.81 4.24 0.00 1.91 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 2.14 2.23 0.00 72 H 7.17 4.13 0.00 3.32 3.36 0.00 5.60 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 73 K 7.66 4.54 0.00 1.77 1.75 0.00 1.93 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.43 7.81 74 D 8.30 4.83 0.00 2.71 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 H 8.82 4.23 0.00 3.19 3.32 0.00 5.93 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 76 G 8.70 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 77 H 8.82 4.30 0.00 3.00 3.33 0.00 5.80 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 P 0.00 4.40 0.00 2.04 2.21 0.00 2.93 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 1.87 2.23 0.00 79 N 8.28 4.57 0.00 2.65 2.83 0.00 0.00 6.95 8.06 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 80 D 8.01 4.57 0.00 2.72 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 81 V 8.30 3.63 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 0.75 0.00 0.00 0.92 0.00 0.00 82 N 7.87 4.65 0.00 2.78 2.69 0.00 0.00 6.71 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 R 7.48 5.14 0.00 1.98 1.89 0.00 2.94 0.00 0.00 4.01 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.57 0.00 84 H 8.55 4.48 0.00 3.52 3.41 0.00 5.64 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.15 3.50 1.55 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 0.78 0.00 0.00 0.44 0.00 0.00 86 G 8.15 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 87 D 7.63 4.97 0.00 2.77 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 L 8.12 4.36 0.00 1.85 1.91 1.05 1.09 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 89 G 8.41 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 0.00 0.00 0.00 0.00 90 N 8.76 5.63 0.00 2.70 2.77 0.00 0.00 6.63 7.68 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 91 V 8.89 4.37 1.73 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 0.33 0.00 0.00 0.89 0.00 0.00 92 V 8.04 4.92 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 1.08 0.00 0.00 0.95 0.00 0.00 93 F 9.37 4.72 0.00 3.31 3.11 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 94 D 8.88 5.17 0.00 2.79 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 95 E 8.96 4.00 0.00 2.04 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 2.37 2.33 0.00 96 N 8.81 4.80 0.00 3.11 2.88 0.00 0.00 6.88 7.77 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 97 H 8.71 5.20 0.00 3.46 3.45 0.00 5.76 0.00 0.00 0.00 0.00 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Y 7.93 5.24 0.00 3.13 3.11 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 99 S 7.88 4.29 0.00 2.72 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 0.00 100 R 7.93 4.35 0.00 1.79 1.72 0.00 3.43 0.00 0.00 3.16 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 101 I 8.33 4.14 1.64 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.40 0.74 0.00 0.00 102 D 8.47 5.00 0.00 2.61 2.52 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 0.00 103 L 8.99 4.74 0.00 1.79 1.70 0.99 0.48 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 0.00 104 V 8.35 4.89 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 0.81 0.00 0.00 0.86 0.00 0.00 105 D 9.20 5.10 0.00 2.80 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 0.00 106 D 8.87 4.93 0.00 2.83 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 0.00 107 Q 8.49 4.41 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.96 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 108 I 7.81 4.06 1.95 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.83 1.05 0.00 0.00 109 S 8.56 4.70 0.00 3.90 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 0.00 110 L 7.82 4.22 0.00 1.80 1.70 0.99 0.77 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 0.00 111 S 7.63 4.44 0.00 3.91 3.81 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 0.00 112 G 8.59 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.51 0.00 2.26 2.23 0.00 3.75 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 1.97 1.99 0.00 114 H 8.25 4.96 0.00 3.26 3.50 0.00 5.64 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 G 8.02 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 0.00 116 I 8.47 3.89 1.58 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.14 0.90 0.00 0.00 117 I 7.31 3.72 1.79 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 1.25 0.41 0.90 0.00 0.00 118 G 9.18 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 0.00 0.00 0.00 119 R 7.62 4.77 0.00 1.58 1.83 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.29 0.00 120 A 8.02 5.11 1.20 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 0.00 0.00 121 V 8.49 4.39 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 0.48 0.00 0.00 1.02 0.00 0.00 122 V 8.36 4.78 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 0.66 0.00 0.00 0.65 0.00 0.00 123 L 9.05 5.32 0.00 2.01 1.70 1.15 0.77 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 0.00 124 H 8.97 5.47 0.00 3.27 3.49 0.00 5.71 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 E 9.22 4.40 0.00 2.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.30 0.00 126 K 8.52 4.76 0.00 1.72 1.91 0.00 1.29 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.46 1.50 7.81 127 A 8.27 4.29 1.10 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 0.00 0.00 128 D 8.05 4.78 0.00 2.78 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 0.00 129 D 9.08 4.34 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 0.00 130 Y 9.13 3.72 0.00 3.26 3.14 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 0.00 0.00 0.00 131 G 8.74 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 0.00 0.00 0.00 132 K 8.01 4.39 0.00 1.98 1.90 0.00 1.91 0.00 0.00 1.83 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.57 7.81 133 S 7.77 4.70 0.00 3.98 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 0.00 134 D 8.33 4.70 0.00 2.78 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 0.00 135 H 7.99 4.21 0.00 3.22 3.20 0.00 5.60 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.27 0.00 2.01 2.06 0.00 3.13 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.03 0.00 137 D 8.17 4.60 0.00 2.79 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 0.00 138 S 8.20 4.04 0.00 3.99 3.89 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 0.00 0.00 0.00 139 R 8.01 4.39 0.00 1.90 1.96 0.00 3.33 0.00 0.00 3.58 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.61 0.00 140 K 8.08 4.32 0.00 1.69 1.80 0.00 1.69 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.39 7.81 141 T 8.16 4.11 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 1.11 0.00 0.00 142 G 8.11 3.67 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 0.00 0.00 0.00 143 N 7.58 4.05 0.00 2.68 2.82 0.00 0.00 7.02 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 0.00 144 A 6.93 4.46 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 G 7.95 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 0.00 146 G 8.85 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 0.00 147 R 8.38 4.83 0.00 1.67 1.81 0.00 3.28 0.00 0.00 3.17 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.67 0.00 148 V 8.99 4.09 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 0.64 0.00 0.00 0.90 0.00 0.00 149 A 7.67 4.74 1.20 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 0.00 0.00 150 C 8.64 5.34 0.00 2.95 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 0.00 151 G 8.81 4.39 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 0.00 152 V 8.38 4.19 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 0.97 0.00 0.00 0.97 0.00 0.00 153 I 8.94 4.22 1.80 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.55 0.52 0.00 0.00 154 G 9.29 4.40 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 0.00 155 I 8.20 4.23 1.87 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 1.22 0.56 0.92 0.00 0.00 156 L 8.36 4.33 0.00 1.71 1.62 0.95 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00