NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.3642 8.3344 115.4137 58.0866 64.2841 172.5068 3 S 4.3434 8.2116 115.8615 55.5968 63.1787 172.0629 4 Q 4.2731 8.3126 120.3215 57.2154 30.0268 176.2867 5 I 4.0389 7.6075 110.9256 61.7648 38.8131 176.1057 6 R 3.9518 7.6190 119.1377 56.1561 29.9548 175.2330 7 Q 4.2458 8.6797 125.2360 56.4389 30.9686 172.6937 8 N 4.1939 9.0378 124.3446 54.9201 36.7182 173.2801 9 Y 4.5895 7.7194 118.5883 54.6864 39.5028 174.4691 10 S 4.1988 7.9985 123.1393 58.1893 65.2433 175.1487 11 T 3.8713 8.3317 114.7839 64.4562 68.5634 176.6145 12 D 4.2363 7.7960 122.0594 57.2441 40.8996 178.4389 13 V 3.4386 7.0639 117.3738 65.7979 31.4964 177.3196 14 E 4.0176 7.7807 120.0848 58.7754 29.4101 178.9094 15 A 3.9712 7.8247 119.7095 54.9882 18.4126 179.4847 16 A 3.9763 8.0202 119.3455 54.8695 18.2573 180.2072 17 V 3.4956 8.0840 117.4330 66.4449 31.6077 177.9469 18 N 4.1861 8.0349 116.1390 56.5343 38.3012 177.5177 19 S 4.1890 8.0832 116.4062 61.1270 62.9303 176.3815 20 L 3.9813 7.9725 123.2784 57.9063 41.7485 179.1403 21 V 3.7935 8.1573 118.6589 66.2250 31.5399 177.6409 22 N 4.3528 8.0174 116.8166 56.3090 38.6841 176.7176 23 L 3.9686 7.9233 122.1019 58.3564 42.2290 178.6020 24 Y 4.2567 8.4513 117.0772 61.0905 37.8341 178.2432 25 L 4.0014 8.2831 120.1371 57.8070 41.5839 179.4530 26 Q 4.0906 8.3801 119.3190 58.9891 29.0096 177.8706 27 A 3.9143 8.2310 122.0002 55.2611 18.4083 179.4232 28 S 4.3448 8.8851 111.9547 61.8474 62.5395 175.7193 29 Y 4.4511 8.2093 122.0627 61.2198 38.5697 178.0119 30 T 3.8569 8.3375 116.9785 67.1458 68.4892 176.1615 31 Y 4.1245 8.0160 118.3952 60.8588 37.9171 178.3167 32 L 4.1299 8.3799 121.5780 58.2987 42.2207 179.0795 33 S 4.3489 8.2949 113.0504 61.3182 62.1597 175.8888 34 L 3.3674 7.5945 120.8552 57.5722 41.4272 179.5318 35 G 3.9144 8.4450 105.5725 48.1684 0.0000 175.8707 36 F 4.2921 8.2831 120.5992 59.6250 38.9707 177.2790 37 Y 4.0917 8.2750 119.8973 60.6362 38.6423 177.4173 38 F 4.4195 8.2767 117.0133 58.9127 38.9658 176.0204 39 D 4.6943 7.6121 116.4871 53.6659 41.8796 176.3899 40 R 4.1235 7.3256 118.8860 56.5237 30.6627 177.4861 41 D 4.1404 8.7019 121.6120 56.1536 39.4634 177.1158 42 D 4.5109 7.9520 117.1384 54.2352 40.2082 176.7659 43 V 3.8481 7.6026 117.9579 64.5490 32.9924 175.3484 44 A 3.8391 8.4586 120.1405 53.3110 16.2503 177.6448 45 L 4.8157 8.3925 122.0261 50.7980 42.9049 177.1953 46 E 4.0138 8.5108 122.8095 59.4071 29.8584 178.2474 47 G 3.4984 7.9450 104.9411 47.7290 0.0000 175.7488 48 V 3.1996 7.4781 120.4562 65.4218 31.5648 177.6497 49 S 4.2392 8.2683 113.2994 61.9217 62.2081 175.7022 50 H 4.1408 8.4339 120.9174 59.0768 29.6935 176.7986 51 F 4.5480 7.7559 123.6908 60.8995 39.0748 177.2448 52 F 4.0285 7.6272 117.0850 60.4916 38.3325 178.0543 53 R 4.0038 8.0798 117.5980 58.8411 29.7068 179.1414 54 E 3.8238 7.8533 118.7066 59.4060 29.4605 179.0456 55 L 3.6237 7.1982 118.2636 57.7022 41.4364 179.4345 56 A 4.1215 8.0708 120.9722 55.2386 18.1953 179.1993 57 E 3.9877 7.7816 117.0958 58.9402 29.7234 178.6767 58 E 3.8645 8.1437 118.9939 59.3142 29.4971 179.4733 59 K 4.0855 8.4669 118.9590 59.3423 31.9187 179.4333 60 R 3.3677 7.7577 118.7366 59.3211 30.0978 178.4935 61 E 3.8814 8.4269 118.7300 58.6812 29.2361 179.5346 62 G 3.2005 7.5697 106.4369 47.8644 0.0000 175.3798 63 Y 4.4630 7.6079 120.4590 58.9050 38.1347 177.6492 64 E 4.1242 7.4780 121.0870 59.1917 29.4853 178.9217 65 R 4.0502 7.9682 118.4938 59.0637 30.1250 178.6050 66 L 4.2330 8.0895 118.7762 58.0296 41.7444 179.4536 67 L 4.1622 8.1186 118.8949 57.5410 41.6318 179.5961 68 K 3.9165 8.0783 119.7242 59.7625 32.2191 178.6028 69 M 3.8271 8.2683 118.7196 58.3211 32.1101 177.6011 70 Q 3.8036 8.4273 120.1273 59.6316 28.9638 178.6499 71 N 4.3353 7.8319 115.5989 56.2768 38.5849 177.1704 72 Q 4.0446 7.5324 118.5103 58.9646 28.9726 178.6992 73 R 3.8013 7.6685 119.1771 58.1746 29.8261 177.8275 74 G 3.9009 7.4218 103.5020 45.1493 0.0000 174.0324 75 G 4.4956 7.4222 108.0894 44.8384 0.0000 172.9181 76 R 4.4862 8.3169 117.3102 53.6165 32.5518 176.0450 77 A 3.9402 8.6225 126.3405 52.0828 18.7671 176.4973 78 L 4.5255 9.3507 124.0659 52.9512 44.3804 176.1064 79 F 4.8327 8.6903 122.3663 55.8181 40.8520 175.1907 80 Q 4.7746 8.2965 121.9223 53.4637 31.8654 175.0877 81 D 4.4486 8.5214 118.6792 55.0474 41.2666 176.7024 82 I 4.3032 8.0437 122.6175 59.4777 37.7547 176.0998 83 K 4.1295 8.6484 126.3811 55.7223 32.3631 177.4715 84 K 3.7562 8.5554 123.1598 55.9652 32.6928 174.9255 85 P 4.2738 0.0000 0.0000 62.4830 31.7286 177.5512 86 A 4.0562 8.4304 123.5344 53.9940 18.4522 176.9761 87 E 4.3205 7.0660 112.8702 54.5896 33.4992 174.7438 88 D 4.8074 8.0296 117.7557 54.2368 43.3738 176.6846 89 E 4.4186 7.3585 116.8137 54.3852 32.9921 175.0910 90 W 4.3576 6.8288 121.3020 55.7640 30.5505 177.5539 91 G 3.7775 7.2123 108.0656 47.3747 0.0000 176.0120 92 K 4.7706 9.1294 124.9449 54.5221 35.2485 176.8618 93 T 4.1837 8.7438 117.2868 67.0516 68.3366 174.6975 94 P 4.3679 0.0000 0.0000 65.6791 31.3325 178.4002 95 D 4.4171 8.2336 116.8922 57.4992 40.9318 178.4920 96 A 4.1967 8.2344 121.1319 55.4689 18.3385 179.3708 97 M 4.3207 8.7781 117.1880 58.8961 32.3168 178.6735 98 K 4.0576 8.5005 118.5466 59.1687 32.0868 179.2833 99 A 4.0438 8.2017 120.9843 55.2136 18.3260 179.5077 100 A 3.9464 8.2055 119.3435 55.4112 18.4823 179.3094 101 M 4.0220 8.4740 116.6833 58.8521 32.2078 178.2829 102 A 3.9744 8.2073 120.6669 55.2897 18.6780 179.3047 103 L 3.8725 8.1552 118.9275 58.4480 41.9908 179.1001 104 E 4.1301 8.6734 118.8813 59.2374 29.4148 179.3976 105 K 4.0558 8.2281 118.7399 59.0185 32.0480 179.3967 106 K 3.9199 8.3840 120.4225 59.6142 32.1919 179.0008 107 L 3.8855 7.9864 119.2561 57.4681 41.3470 178.9864 108 N 4.2978 8.4455 117.5954 56.6322 38.9099 176.5711 109 Q 3.9049 8.2216 120.6577 59.3603 29.1910 177.9689 110 A 4.1634 7.8808 121.6201 55.3702 18.1940 179.7327 111 L 3.9116 7.8673 117.1890 58.0352 41.7822 179.6579 112 L 4.0161 8.2073 119.1490 57.7473 41.3892 179.4560 113 D 4.3239 8.5625 119.3203 57.4191 40.8627 178.5799 114 L 3.9519 8.0688 120.8040 58.2647 41.9178 178.5116 115 H 4.1119 8.5948 118.3669 58.9919 29.8181 176.8983 116 A 4.0166 8.1070 122.6375 55.4062 18.2865 179.3165 117 L 4.0049 8.3763 118.9961 58.1304 42.0538 179.6147 118 G 3.5298 8.1389 105.6892 48.0110 0.0000 175.9110 119 S 4.1734 8.3755 118.2649 60.9264 62.5464 176.7101 120 A 3.9915 7.8854 122.6723 55.2876 18.3240 179.2840 121 R 4.1102 7.7766 112.8418 55.5616 31.3219 176.6901 122 T 3.4003 7.4668 108.3938 63.2374 67.7814 173.7905 123 D 4.8563 7.8182 121.3381 51.7939 41.4628 173.9382 124 P 4.3348 0.0000 0.0000 65.5455 31.3118 177.9878 125 H 4.1061 8.2946 117.5746 59.1648 29.8168 176.9218 126 L 4.1189 8.2352 121.6153 58.3175 41.8642 178.2663 127 C 3.9995 8.0111 116.6519 62.7559 28.0289 175.2577 128 D 4.3684 8.4995 119.4930 57.4624 40.8033 178.2983 129 F 4.2419 8.5390 121.1539 61.5845 39.3464 177.2072 130 L 4.2846 8.0599 118.4570 57.6348 41.2237 179.2027 131 E 4.0374 8.3230 118.1139 59.7706 29.4875 179.2820 132 T 4.0067 8.0577 114.7521 66.2459 68.7978 175.9841 133 H 4.4793 7.8157 114.5504 55.4028 30.0086 175.1283 134 F 4.6863 7.7377 117.3920 58.7331 41.2587 176.4801 135 L 3.9680 8.1392 120.2787 58.8769 41.2848 179.2576 136 D 4.3856 7.9872 116.8653 57.3806 41.5109 178.2782 137 E 3.9487 8.1422 118.8459 59.3542 29.4993 179.0547 138 E 4.0594 8.4013 118.6218 59.2609 29.5722 179.2217 139 V 3.6009 7.6021 117.9472 66.2514 31.6846 178.2585 140 K 3.9745 8.3232 118.2112 59.3547 31.8542 179.1883 141 L 4.0669 7.8533 120.3124 58.1476 42.0283 179.1090 142 I 3.8224 8.4205 120.2884 64.1446 37.0508 178.2859 143 K 3.9397 8.3075 120.7034 59.3107 32.0458 178.7764 144 K 3.8798 7.9657 119.4377 59.8576 32.0724 178.7410 145 M 4.3000 8.3059 119.1491 58.2134 31.8430 178.8775 146 G 3.6823 8.2746 105.9706 48.0325 0.0000 175.3909 147 D 4.3497 8.0901 121.4819 57.4075 40.7466 178.6752 148 H 4.1822 8.0857 116.6076 58.6573 28.6107 177.8864 149 L 4.0116 8.2515 121.0131 58.3132 41.6723 179.6666 150 T 3.8912 8.0209 115.5621 66.7685 68.1990 176.5137 151 N 4.3879 8.2989 118.3800 56.1657 38.3652 177.4989 152 L 4.0016 8.0663 119.8319 58.0985 41.8099 178.7415 153 H 4.2319 8.2180 117.0872 59.2069 30.0830 176.7944 154 R 4.1243 7.9597 120.0989 59.3556 29.5562 177.9602 155 L 4.6247 7.5553 116.4652 54.9428 41.8850 177.2803 156 G 3.7028 8.0066 114.3999 45.7049 0.0000 173.7351 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 S 8.33 4.36 0.00 4.01 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 3 S 8.21 4.34 0.00 4.06 3.80 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 4 Q 8.31 4.27 0.00 2.19 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.70 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 5 I 7.61 4.04 1.83 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 1.26 0.60 0.88 0.00 0.00 6 R 7.62 3.95 0.00 1.79 1.96 0.00 3.16 0.00 0.00 3.36 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 7 Q 8.68 4.25 0.00 2.14 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.44 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 8 N 9.04 4.19 0.00 2.91 2.95 0.00 0.00 6.98 7.54 0.00 0.00 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 Y 7.72 4.59 0.00 2.97 2.83 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 10 S 8.00 4.20 0.00 3.96 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 11 T 8.33 3.87 4.19 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 1.18 0.00 0.00 12 D 7.80 4.24 0.00 2.65 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 13 V 7.06 3.44 1.66 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 0.96 0.00 0.00 0.79 0.00 0.00 14 E 7.78 4.02 0.00 2.04 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 2.32 2.46 0.00 15 A 7.82 3.97 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 16 A 8.02 3.98 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 17 V 8.08 3.50 2.34 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 1.15 0.00 0.00 1.10 0.00 0.00 18 N 8.03 4.19 0.00 2.90 2.87 0.00 0.00 7.14 7.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.08 4.19 0.00 3.88 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 20 L 7.97 3.98 0.00 1.90 1.91 0.80 0.85 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 21 V 8.16 3.79 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 1.09 0.00 0.00 1.12 0.00 0.00 22 N 8.02 4.35 0.00 2.78 2.82 0.00 0.00 6.90 6.54 0.00 0.00 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 L 7.92 3.97 0.00 1.98 1.77 0.89 0.86 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 24 Y 8.45 4.26 0.00 3.40 3.28 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 25 L 8.28 4.00 0.00 1.86 1.62 0.82 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.38 4.09 0.00 2.20 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 27 A 8.23 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.89 4.34 0.00 4.21 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 0.00 29 Y 8.21 4.45 0.00 3.23 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 30 T 8.34 3.86 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 1.12 0.00 0.00 31 Y 8.02 4.12 0.00 3.30 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 32 L 8.38 4.13 0.00 2.07 2.21 1.30 0.83 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 33 S 8.29 4.35 0.00 4.09 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 34 L 7.59 3.37 0.00 1.34 0.97 -0.06 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 35 G 8.45 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 0.00 0.00 0.00 36 F 8.28 4.29 0.00 3.37 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 Y 8.28 4.09 0.00 3.27 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 38 F 8.28 4.42 0.00 3.40 3.31 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.61 4.69 0.00 2.63 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 40 R 7.33 4.12 0.00 1.78 1.92 0.00 3.18 0.00 0.00 2.77 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 41 D 8.70 4.14 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 42 D 7.95 4.51 0.00 2.80 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 43 V 7.60 3.85 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 0.78 0.00 0.00 0.30 0.00 0.00 44 A 8.46 3.84 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.39 4.82 0.00 1.92 1.57 1.19 0.72 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 46 E 8.51 4.01 0.00 2.03 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 0.00 2.35 2.39 0.00 47 G 7.95 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 48 V 7.48 3.20 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.66 0.00 0.00 49 S 8.27 4.24 0.00 4.05 4.06 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 50 H 8.43 4.14 0.00 3.33 3.38 0.00 5.67 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 F 7.76 4.55 0.00 2.80 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 52 F 7.63 4.03 0.00 3.17 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 53 R 8.08 4.00 0.00 1.79 1.93 0.00 2.78 0.00 0.00 3.05 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.93 0.00 54 E 7.85 3.82 0.00 1.97 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 2.11 2.33 0.00 55 L 7.20 3.62 0.00 0.99 0.49 -0.05 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.07 4.12 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 57 E 7.78 3.99 0.00 2.05 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 2.25 2.33 0.00 58 E 8.14 3.86 0.00 2.13 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 2.23 2.44 0.00 59 K 8.47 4.09 0.00 1.99 2.27 0.00 2.19 0.00 0.00 1.95 0.00 0.00 3.03 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.83 2.11 7.81 60 R 7.76 3.37 0.00 2.04 1.99 0.00 3.10 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 1.34 1.70 0.00 61 E 8.43 3.88 0.00 2.04 1.82 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 2.21 2.34 0.00 62 G 7.57 3.20 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 0.00 63 Y 7.61 4.46 0.00 3.37 3.40 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 64 E 7.48 4.12 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 1.95 0.00 65 R 7.97 4.05 0.00 2.03 2.21 0.00 2.68 0.00 0.00 2.76 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.70 0.00 66 L 8.09 4.23 0.00 2.10 1.85 1.16 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 67 L 8.12 4.16 0.00 2.01 1.87 1.41 0.83 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 68 K 8.08 3.92 0.00 2.14 2.08 0.00 1.54 0.00 0.00 1.59 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.50 7.81 69 M 8.27 3.83 0.00 1.69 1.37 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.14 0.00 70 Q 8.43 3.80 0.00 2.22 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 71 N 7.83 4.34 0.00 2.71 2.83 0.00 0.00 7.16 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 72 Q 7.53 4.04 0.00 2.12 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.01 0.00 0.00 0.00 0.00 0.00 2.35 2.58 0.00 73 R 7.67 3.80 0.00 0.89 0.66 0.00 2.93 0.00 0.00 2.89 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.16 0.00 74 G 7.42 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 75 G 7.42 4.50 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 76 R 8.32 4.49 0.00 1.78 1.81 0.00 3.34 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 77 A 8.62 3.94 1.02 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 78 L 9.35 4.53 0.00 1.36 1.49 0.88 0.79 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 79 F 8.69 4.83 0.00 3.01 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 80 Q 8.30 4.77 0.00 2.03 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.94 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 81 D 8.52 4.45 0.00 2.69 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 82 I 8.04 4.30 1.92 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.52 1.09 0.00 0.00 83 K 8.65 4.13 0.00 1.77 1.77 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.44 7.81 84 K 8.56 3.76 0.00 1.68 1.78 0.00 1.54 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.38 1.40 7.81 85 P 0.00 4.27 0.00 2.34 2.21 0.00 3.20 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.73 0.00 86 A 8.43 4.06 1.16 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 87 E 7.07 4.32 0.00 1.16 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 0.00 0.00 0.00 1.47 1.47 0.00 88 D 8.03 4.81 0.00 2.48 2.61 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 0.00 0.00 0.00 0.00 89 E 7.36 4.42 0.00 1.71 1.67 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 2.39 2.30 0.00 90 W 6.83 4.36 0.00 2.65 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 91 G 7.21 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 0.00 0.00 0.00 92 K 9.13 4.77 0.00 2.07 1.87 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.56 7.81 93 T 8.74 4.18 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 1.17 0.00 0.00 94 P 0.00 4.37 0.00 2.24 2.18 0.00 3.66 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.25 0.00 95 D 8.23 4.42 0.00 3.19 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 96 A 8.23 4.20 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 0.00 0.00 0.00 0.00 0.00 97 M 8.78 4.32 0.00 2.35 2.29 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.70 0.00 98 K 8.50 4.06 0.00 2.09 1.92 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.78 7.81 99 A 8.20 4.04 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 A 8.21 3.95 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 M 8.47 4.02 0.00 2.35 2.24 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.68 0.00 102 A 8.21 3.97 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 0.00 103 L 8.16 3.87 0.00 1.69 1.78 0.86 0.74 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 0.00 104 E 8.67 4.13 0.00 2.25 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.67 0.00 105 K 8.23 4.06 0.00 2.01 1.88 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.66 7.81 106 K 8.38 3.92 0.00 1.88 2.01 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.46 7.81 107 L 7.99 3.89 0.00 1.83 1.42 0.94 0.05 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 0.00 108 N 8.45 4.30 0.00 3.00 3.03 0.00 0.00 6.79 7.17 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 0.00 109 Q 8.22 3.90 0.00 2.34 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.50 0.00 0.00 0.00 0.00 0.00 2.35 2.62 0.00 110 A 7.88 4.16 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 0.00 111 L 7.87 3.91 0.00 1.94 1.75 1.12 0.52 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 0.00 112 L 8.21 4.02 0.00 1.83 1.73 0.96 1.38 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 0.00 113 D 8.56 4.32 0.00 2.88 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 0.00 114 L 8.07 3.95 0.00 1.84 1.83 0.91 0.85 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 0.00 115 H 8.59 4.11 0.00 3.38 3.47 0.00 5.65 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 A 8.11 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 0.00 117 L 8.38 4.00 0.00 1.74 1.83 0.89 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 118 G 8.14 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.38 4.17 0.00 4.04 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 0.00 120 A 7.89 3.99 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 R 7.78 4.11 0.00 1.78 1.94 0.00 3.43 0.00 0.00 3.25 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.71 0.00 122 T 7.47 3.40 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 1.27 0.00 0.00 123 D 7.82 4.86 0.00 2.78 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 0.00 124 P 0.00 4.33 0.00 2.34 2.33 0.00 3.83 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.06 0.00 125 H 8.29 4.11 0.00 3.26 3.51 0.00 5.67 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 0.00 126 L 8.24 4.12 0.00 2.08 1.88 1.03 1.00 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 0.00 127 C 8.01 4.00 0.00 3.18 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 0.00 128 D 8.50 4.37 0.00 2.90 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 0.00 129 F 8.54 4.24 0.00 3.19 3.35 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 0.00 130 L 8.06 4.28 0.00 1.94 1.83 1.03 0.92 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 0.00 131 E 8.32 4.04 0.00 2.18 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 2.45 2.70 0.00 132 T 8.06 4.01 4.14 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 0.99 0.00 0.00 133 H 7.82 4.48 0.00 2.19 2.63 0.00 5.59 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 0.00 134 F 7.74 4.69 0.00 3.14 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 0.00 135 L 8.14 3.97 0.00 1.85 1.74 0.98 0.99 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 0.00 136 D 7.99 4.39 0.00 2.74 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.14 3.95 0.00 2.15 1.95 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 2.32 2.33 0.00 138 E 8.40 4.06 0.00 2.23 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 2.61 2.62 0.00 139 V 7.60 3.60 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 1.02 0.00 0.00 140 K 8.32 3.97 0.00 1.98 1.85 0.00 1.71 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.84 7.81 141 L 7.85 4.07 0.00 1.92 1.96 1.02 1.00 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 0.00 142 I 8.42 3.82 2.12 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 1.48 0.69 0.95 0.00 0.00 143 K 8.31 3.94 0.00 1.87 2.03 0.00 1.62 0.00 0.00 1.57 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.48 7.81 144 K 7.97 3.88 0.00 2.02 2.03 0.00 1.73 0.00 0.00 1.77 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.41 7.81 145 M 8.31 4.30 0.00 2.27 2.32 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.07 2.87 0.00 146 G 8.27 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 0.00 147 D 8.09 4.35 0.00 2.86 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 H 8.09 4.18 0.00 3.28 3.19 0.00 5.62 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 0.00 149 L 8.25 4.01 0.00 1.91 1.75 0.98 1.05 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 0.00 150 T 8.02 3.89 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 1.21 0.00 0.00 151 N 8.30 4.39 0.00 2.95 2.84 0.00 0.00 7.00 6.02 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 0.00 152 L 8.07 4.00 0.00 1.81 1.77 0.94 0.96 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 0.00 153 H 8.22 4.23 0.00 3.26 3.48 0.00 5.77 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 0.00 154 R 7.96 4.12 0.00 2.07 2.17 0.00 3.14 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 155 L 7.56 4.62 0.00 1.75 1.67 0.91 0.80 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 0.00 156 G 8.01 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