NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 L 4.4947 8.0385 120.6271 54.2450 43.9013 178.2106 23 A 3.8405 7.9241 124.6131 54.6287 18.8241 178.5605 24 D 4.4773 8.9104 116.7138 56.9033 42.0765 177.4541 25 S 4.1507 8.2299 115.8089 61.6402 62.9052 176.6497 26 K 3.8678 7.7571 120.5458 59.6595 31.8503 179.1874 27 A 4.0123 7.7913 120.4617 55.1146 18.2859 180.1020 28 V 3.7125 8.3770 118.1785 64.8380 31.3691 178.5610 29 L 4.2064 8.4700 120.1024 57.7451 41.5117 179.0406 30 N 4.1511 8.2681 116.9041 56.4419 38.6943 176.4854 31 Q 4.1793 8.7430 121.2324 59.4748 29.1185 178.3472 32 A 4.1926 8.6310 122.0366 55.1612 18.2752 179.5219 33 V 3.5747 8.2403 116.8541 66.2454 31.5739 178.1727 34 A 4.1969 8.3564 120.1410 55.5165 18.3739 179.3326 35 D 4.3899 8.5876 117.7520 57.6562 40.8517 179.1644 36 L 4.3213 8.5149 119.8130 57.6446 41.6310 179.8877 37 S 3.8512 7.5709 115.4275 61.4302 62.6474 176.7670 38 V 3.5858 7.8595 120.7322 65.8529 31.1930 177.7978 39 A 3.9866 8.5146 120.9480 55.3713 18.2535 178.8321 40 H 3.9442 8.4364 116.8993 59.6522 29.9297 177.1259 41 S 4.1088 7.9692 114.4307 61.7059 62.1864 176.3044 42 I 3.7098 7.9438 122.3476 64.2414 36.7297 178.4596 43 L 3.9307 8.0827 120.0937 57.8857 41.4365 178.8667 44 H 3.5225 7.9388 118.1655 58.9705 29.5676 176.9075 45 Q 4.2212 7.7876 121.1442 59.3157 28.9787 178.2984 46 V 3.6105 7.7208 119.0909 66.4737 31.2843 177.1893 47 H 4.1134 8.2040 116.5928 59.3494 29.6833 176.8333 48 W 4.7561 8.1033 119.1722 59.5047 28.9346 177.4566 49 Y 4.3798 8.6927 114.8445 56.8487 37.7761 175.2885 50 M 4.4810 7.6632 120.4546 56.1439 32.8212 175.6387 51 R 4.6506 9.0015 123.6735 55.1624 34.5826 173.7048 52 G 4.2268 8.9799 106.4082 42.9884 0.0000 173.3558 53 R 4.2430 8.3006 119.5147 57.7725 30.5639 177.6889 54 G 4.2111 9.3255 110.6693 45.2168 0.0000 174.7620 55 F 4.1720 8.5549 122.0107 62.0512 38.9788 176.7983 56 M 4.2356 8.2553 116.2319 58.0549 32.5012 177.4068 57 I 3.8219 7.5532 112.6393 62.9489 38.4203 177.8775 58 W 4.2082 8.0375 120.5383 59.1870 28.6854 177.9778 59 H 3.8904 8.1099 118.4518 58.7891 29.5204 175.4297 60 P 4.2440 0.0000 0.0000 65.2478 31.2445 177.9379 61 K 3.5037 7.6362 119.4090 59.7762 31.8464 178.5051 62 M 4.0482 7.8887 118.6202 58.2587 31.7247 178.4811 63 D 4.1365 7.5864 118.7461 57.2854 40.9910 178.5483 64 E 3.8967 7.8116 118.4973 59.6448 29.5054 178.9203 65 Y 4.4667 7.8062 116.6255 61.5224 37.8913 178.5495 66 M 4.1103 8.4405 120.0083 58.2568 31.9920 178.3939 67 E 3.8647 8.3432 119.5873 59.1749 29.9399 178.4959 68 E 3.6084 8.2299 119.2204 59.3781 29.7491 178.8196 69 I 3.8145 8.2819 120.0763 64.5187 37.1007 178.1347 70 D 4.4288 8.4873 120.2185 57.2915 40.6392 179.0972 71 G 3.4496 7.7797 106.2519 47.9010 0.0000 175.4742 72 Y 4.3762 7.3697 118.7035 60.6676 37.9018 178.0627 73 L 4.0083 8.1182 121.3689 58.1668 42.2197 178.6293 74 D 4.2579 8.2152 117.8620 57.4481 41.2871 177.7552 75 E 3.9196 8.2042 119.8037 59.5681 29.5804 178.6193 76 M 4.0129 8.4906 119.3268 57.8859 32.0421 178.8564 77 S 4.1432 8.1311 114.6283 61.5934 63.1549 176.4834 78 E 3.9828 8.3092 122.1954 58.6914 29.2079 179.2578 79 R 3.8117 8.0340 119.1093 59.0826 30.1478 178.0763 80 L 3.9163 7.8331 120.2240 58.4382 42.0003 179.0385 81 I 3.8688 7.9654 119.8281 64.8933 36.8118 178.6323 82 T 3.9090 7.8396 115.5398 66.1034 68.3072 175.7953 83 L 4.4138 7.6408 118.4907 54.6850 41.8680 177.4850 84 G 3.8866 8.2257 107.9554 45.1524 0.0000 174.0257 85 G 3.7913 7.7036 108.7980 44.0509 0.0000 173.7305 86 A 4.4972 7.9710 121.2080 49.0126 19.7813 173.9683 87 P 4.4343 0.0000 0.0000 63.0276 32.1293 176.8910 88 F 4.7560 8.4938 120.7071 59.0541 39.3099 176.5541 89 S 4.7269 8.7377 118.1463 57.0530 63.6361 174.8318 90 T 4.4957 6.9135 110.0203 59.9336 72.9658 173.7391 91 L 3.9983 8.1188 121.6790 57.5449 41.7022 179.5548 92 K 3.8157 7.8721 119.2504 59.5372 32.1750 178.4384 93 E 3.6280 7.7988 118.5877 59.3220 29.3476 179.0858 94 F 4.4437 7.5070 117.6336 61.0319 38.8506 177.7050 95 S 4.1319 8.2200 111.4555 61.5823 62.2871 175.7683 96 E 4.1138 8.0287 120.0612 58.6892 29.3565 178.1517 97 N 4.5314 7.7338 115.1823 53.7853 39.4020 175.8362 98 S 4.4970 7.6133 114.8510 58.3927 62.9401 173.8952 99 Q 4.2511 8.6121 124.7517 56.4536 29.1372 176.2494 100 L 4.0264 7.2970 118.9460 53.8321 42.4200 176.2627 101 K 4.5680 8.2747 121.7871 54.5950 34.3497 175.4608 102 E 4.6544 8.4811 121.6657 54.6843 31.7090 175.4277 103 V 4.4963 7.7416 113.8420 58.8718 35.3714 175.4390 104 L 4.0842 8.1569 120.6711 54.3433 41.9971 177.8597 105 G 2.4233 7.9312 110.7780 45.3353 0.0000 173.0028 106 D 4.3951 7.4165 121.4354 52.7423 43.3776 175.6139 107 Y 4.7036 8.6760 124.3522 60.0550 38.0896 176.8374 108 N 4.6546 8.5469 116.1516 54.0649 39.1182 175.7715 109 V 3.7269 7.2897 119.6022 62.6298 32.2492 176.4492 110 T 4.2271 8.9437 117.9128 61.2860 70.7553 175.6988 111 I 3.6711 8.3308 122.9022 65.0099 37.1883 178.5916 112 E 3.8723 8.0562 118.4973 59.1636 29.3244 179.0751 113 E 3.9806 8.2332 118.9692 59.1446 29.4657 179.2711 114 Q 3.9045 8.1229 118.3359 59.0225 28.7432 178.8771 115 L 3.6786 7.9022 119.8062 57.5350 41.5589 179.3958 116 A 3.8634 7.8928 120.7960 55.0806 18.1803 179.7061 117 R 3.7528 7.8094 117.2765 59.3734 30.0828 178.8477 118 V 3.1655 7.6521 118.1124 65.7981 31.3768 178.0028 119 V 3.5393 7.8289 120.5200 66.7274 31.2916 178.5234 120 E 3.9849 8.1270 117.8544 60.9613 29.5324 180.8387 121 V 3.7993 7.8894 119.7432 66.1075 31.5151 178.1525 122 F 4.4556 8.5061 117.7432 60.7506 38.6311 177.9469 123 R 3.9290 8.5712 118.1554 59.2848 29.8756 178.3775 124 Y 3.9012 8.0382 119.3179 60.6631 38.8093 178.1609 125 L 3.4184 8.1559 119.6103 57.5393 41.6617 179.2800 126 A 3.8102 7.9987 120.6533 55.1771 18.2860 179.6040 127 A 3.7794 7.9242 119.3115 54.9931 18.4043 179.5594 128 L 3.5865 7.6504 119.2337 58.3003 42.0293 179.3437 129 F 4.5229 8.1990 118.0224 60.3684 38.7403 177.4531 130 Q 4.0074 8.3653 121.9162 59.8179 28.8378 179.2222 131 K 4.0236 8.1274 124.8311 59.5041 31.6890 180.8700 132 G 2.5372 7.9610 107.2305 47.2439 0.0000 175.5062 133 F 4.1103 8.1771 123.6177 60.9773 39.3859 176.9001 134 D 4.3489 8.3478 118.5602 57.3598 40.6586 178.9694 135 V 3.5294 7.8196 118.9017 66.0644 31.7056 178.2199 136 S 4.4480 7.9644 115.3354 60.8263 62.8741 175.8408 137 D 4.1213 8.2356 124.3948 57.7110 40.7319 178.7139 138 E 3.9824 7.9832 117.4165 61.1170 29.8575 180.0859 139 E 4.4789 8.0034 116.5811 56.0857 29.7596 177.7584 140 G 3.8298 7.5390 106.7916 46.4138 0.0000 175.0755 141 D 4.5940 7.6359 121.2063 52.8808 39.2839 176.6105 142 S 4.0922 8.0845 120.2392 60.5672 63.4782 176.5019 143 V 3.5084 7.6889 121.3869 66.2720 31.3551 177.8554 144 T 3.6934 7.7471 115.4764 66.5188 68.2909 175.8420 145 N 4.6536 7.9670 120.0646 56.2494 38.9026 176.2959 146 D 4.3800 8.3623 119.4850 57.4354 41.4220 178.1758 147 I 3.5192 7.5723 120.2252 64.4462 37.0477 178.4627 148 F 3.9337 7.8272 118.5266 60.3910 38.7356 177.3383 149 N 4.3668 8.3580 116.7899 56.4976 38.9030 177.1636 150 V 3.5351 7.9265 119.5492 65.9537 31.6512 177.9376 151 A 3.4989 7.3661 121.3508 54.1218 17.9702 179.4261 152 K 4.0319 8.3539 118.3832 59.5876 32.3925 178.5968 153 A 3.9733 7.9616 120.9647 55.4795 18.2382 179.6679 154 S 4.0486 7.9536 110.9311 61.5470 62.5332 176.1846 155 I 3.4620 7.9065 122.5477 64.4974 36.7950 178.2901 156 E 4.0529 8.3734 119.3874 59.1690 29.3054 179.1242 157 K 4.2794 8.0683 119.4643 60.0841 32.2620 178.5941 158 H 4.4579 8.4369 116.6283 58.8001 28.5152 177.7856 159 I 3.8483 8.0198 121.8016 64.0735 36.8739 178.0764 160 W 4.3418 8.4332 129.0507 60.9779 30.5982 177.8721 161 M 3.3179 7.8074 118.3606 58.1419 31.3439 178.8128 162 L 4.0448 8.5323 119.3915 57.9787 41.7122 179.6472 163 Q 3.9985 8.4233 117.9233 58.7446 28.6140 178.6448 164 A 4.0176 8.3392 122.2103 55.1051 18.2237 178.9396 165 E 4.0024 7.9845 116.5564 59.7185 29.7172 178.6480 166 L 4.3317 7.6831 114.6273 54.1569 41.7771 176.9317 167 G 3.9930 8.2230 106.6490 46.6857 0.0000 174.0490 168 Q 4.5438 8.2905 115.7898 53.3753 33.0192 175.4370 169 A 4.3969 8.3696 122.9318 51.3566 19.3098 176.3511 170 P 4.4155 0.0000 0.0000 64.4007 31.6842 177.7871 171 K 3.8623 8.0316 114.5946 57.3633 29.2919 175.3750 172 L 4.1853 7.9791 122.5015 55.1784 41.5469 177.5365 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 22 L 8.04 4.49 0.00 1.76 1.75 0.91 0.54 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 23 A 7.92 3.84 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 24 D 8.91 4.48 0.00 3.00 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 25 S 8.23 4.15 0.00 3.90 3.98 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 0.00 0.00 0.00 26 K 7.76 3.87 0.00 1.97 1.85 0.00 1.65 0.00 0.00 1.79 0.00 0.00 3.09 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.68 7.81 27 A 7.79 4.01 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 28 V 8.38 3.71 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 1.07 0.00 0.00 0.73 0.00 0.00 29 L 8.47 4.21 0.00 1.90 1.79 0.93 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 30 N 8.27 4.15 0.00 2.67 2.39 0.00 0.00 6.89 6.22 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 31 Q 8.74 4.18 0.00 2.37 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.48 2.79 0.00 32 A 8.63 4.19 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 0.00 0.00 0.00 0.00 0.00 33 V 8.24 3.57 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 1.27 0.00 0.00 1.01 0.00 0.00 34 A 8.36 4.20 1.62 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 0.00 0.00 35 D 8.59 4.39 0.00 2.95 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 36 L 8.51 4.32 0.00 1.79 1.80 1.17 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.57 3.85 0.00 3.31 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 V 7.86 3.59 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 0.99 0.00 0.00 0.97 0.00 0.00 39 A 8.51 3.99 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 40 H 8.44 3.94 0.00 3.37 3.49 0.00 5.80 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 41 S 7.97 4.11 0.00 4.02 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.94 3.71 1.96 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.84 0.84 0.00 0.00 43 L 8.08 3.93 0.00 1.72 1.64 1.07 0.91 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 44 H 7.94 3.52 0.00 3.03 2.39 0.00 5.60 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 7.79 4.22 0.00 2.22 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.52 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 46 V 7.72 3.61 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 0.93 0.00 0.00 0.90 0.00 0.00 47 H 8.20 4.11 0.00 3.03 3.30 0.00 6.00 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 48 W 8.10 4.76 0.00 3.75 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 49 Y 8.69 4.38 0.00 3.08 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 50 M 7.66 4.48 0.00 2.34 2.37 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.98 0.00 51 R 9.00 4.65 0.00 1.90 1.79 0.00 3.33 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.83 0.00 52 G 8.98 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 53 R 8.30 4.24 0.00 1.87 1.95 0.00 3.38 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 54 G 9.33 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 0.00 0.00 0.00 0.00 55 F 8.55 4.17 0.00 3.36 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 56 M 8.26 4.24 0.00 2.08 2.22 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.70 0.00 57 I 7.55 3.82 1.20 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.22 0.66 0.00 0.00 58 W 8.04 4.21 0.00 3.57 3.23 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 59 H 8.11 3.89 0.00 1.77 2.56 0.00 5.95 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 60 P 0.00 4.24 0.00 2.18 2.23 0.00 3.60 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.97 0.00 61 K 7.64 3.50 0.00 1.59 1.91 0.00 0.92 0.00 0.00 1.13 0.00 0.00 2.62 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.13 0.69 7.81 62 M 7.89 4.05 0.00 2.02 2.18 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 3.02 0.00 63 D 7.59 4.14 0.00 2.78 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 7.81 3.90 0.00 1.91 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 2.32 2.26 0.00 65 Y 7.81 4.47 0.00 3.23 3.13 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 66 M 8.44 4.11 0.00 1.87 2.13 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.24 0.00 67 E 8.34 3.86 0.00 2.15 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 68 E 8.23 3.61 0.00 2.17 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 1.87 2.07 0.00 69 I 8.28 3.81 1.97 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.08 1.04 0.00 0.00 70 D 8.49 4.43 0.00 2.95 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 71 G 7.78 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 0.00 0.00 0.00 72 Y 7.37 4.38 0.00 3.25 2.85 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 73 L 8.12 4.01 0.00 1.86 1.91 0.88 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 74 D 8.22 4.26 0.00 2.84 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 75 E 8.20 3.92 0.00 2.17 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 2.20 2.30 0.00 76 M 8.49 4.01 0.00 1.99 2.13 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.08 0.00 77 S 8.13 4.14 0.00 4.10 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 78 E 8.31 3.98 0.00 2.14 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 2.33 2.39 0.00 79 R 8.03 3.81 0.00 1.94 1.82 0.00 3.11 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 80 L 7.83 3.92 0.00 1.85 1.92 0.93 1.05 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 81 I 7.97 3.87 2.02 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.51 0.91 0.00 0.00 82 T 7.84 3.91 4.38 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 1.19 0.00 0.00 83 L 7.64 4.41 0.00 1.73 1.68 0.94 0.76 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 84 G 8.23 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 0.00 0.00 0.00 85 G 7.70 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 7.97 4.50 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.43 0.00 2.26 2.07 0.00 3.80 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 88 F 8.49 4.76 0.00 3.33 3.01 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 0.00 89 S 8.74 4.73 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 90 T 6.91 4.50 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 91 L 8.12 4.00 0.00 1.70 1.81 1.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 92 K 7.87 3.82 0.00 1.75 1.71 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.49 7.81 93 E 7.80 3.63 0.00 1.88 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 2.15 2.22 0.00 94 F 7.51 4.44 0.00 3.26 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 95 S 8.22 4.13 0.00 4.01 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 96 E 8.03 4.11 0.00 1.95 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.42 0.00 97 N 7.73 4.53 0.00 2.53 2.85 0.00 0.00 6.96 7.56 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 98 S 7.61 4.50 0.00 3.95 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 8.61 4.25 0.00 1.92 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.60 0.00 0.00 0.00 0.00 0.00 2.41 2.64 0.00 100 L 7.30 4.03 0.00 1.51 1.45 0.88 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.27 4.57 0.00 1.63 1.64 0.00 1.64 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.30 1.44 7.81 102 E 8.48 4.65 0.00 1.91 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 2.19 2.27 0.00 103 V 7.74 4.50 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 0.70 0.00 0.00 0.85 0.00 0.00 104 L 8.16 4.08 0.00 1.55 1.50 0.90 0.85 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 0.00 105 G 7.93 2.42 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 0.00 0.00 0.00 106 D 7.42 4.40 0.00 2.58 2.35 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 0.00 107 Y 8.68 4.70 0.00 3.14 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 0.00 108 N 8.55 4.65 0.00 2.92 2.91 0.00 0.00 6.91 7.24 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 0.00 109 V 7.29 3.73 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 0.80 0.00 0.00 0.95 0.00 0.00 110 T 8.94 4.23 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 111 I 8.33 3.67 1.89 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.00 0.84 0.00 0.00 112 E 8.06 3.87 0.00 1.97 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 2.33 2.37 0.00 113 E 8.23 3.98 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 2.30 2.32 0.00 114 Q 8.12 3.90 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.61 2.58 0.00 115 L 7.90 3.68 0.00 1.38 1.30 -0.17 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 116 A 7.89 3.86 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 7.81 3.75 0.00 1.87 2.07 0.00 3.08 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 118 V 7.65 3.17 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 -0.05 0.00 0.00 0.80 0.00 0.00 119 V 7.83 3.54 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.88 0.00 0.00 120 E 8.13 3.98 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.19 0.00 121 V 7.89 3.80 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.93 0.00 0.00 122 F 8.51 4.46 0.00 3.19 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 0.00 123 R 8.57 3.93 0.00 2.00 2.00 0.00 3.15 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.93 0.00 124 Y 8.04 3.90 0.00 3.12 3.13 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 0.00 125 L 8.16 3.42 0.00 1.65 0.97 1.06 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 126 A 8.00 3.81 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 0.00 127 A 7.92 3.78 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 0.00 128 L 7.65 3.59 0.00 1.01 1.32 0.88 1.13 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 0.00 129 F 8.20 4.52 0.00 3.12 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 0.00 130 Q 8.37 4.01 0.00 2.10 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.80 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 131 K 8.13 4.02 0.00 1.81 1.80 0.00 1.88 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.37 1.33 7.81 132 G 7.96 2.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 F 8.18 4.11 0.00 3.25 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 0.00 134 D 8.35 4.35 0.00 2.84 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 0.00 135 V 7.82 3.53 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 1.04 0.00 0.00 0.92 0.00 0.00 136 S 7.96 4.45 0.00 4.31 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 0.00 137 D 8.24 4.12 0.00 2.26 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 0.00 138 E 7.98 3.98 0.00 2.10 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 2.26 2.23 0.00 139 E 8.00 4.48 0.00 1.92 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 2.32 2.30 0.00 140 G 7.54 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 0.00 141 D 7.64 4.59 0.00 2.82 2.56 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 0.00 142 S 8.08 4.09 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 0.00 143 V 7.69 3.51 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 1.01 0.00 0.00 0.90 0.00 0.00 144 T 7.75 3.69 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 1.32 0.00 0.00 145 N 7.97 4.65 0.00 2.76 2.87 0.00 0.00 6.43 8.43 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 0.00 146 D 8.36 4.38 0.00 2.87 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 0.00 147 I 7.57 3.52 1.59 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 1.51 0.88 0.47 0.00 0.00 148 F 7.83 3.93 0.00 3.41 3.25 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 0.00 149 N 8.36 4.37 0.00 3.27 2.99 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 0.00 150 V 7.93 3.54 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 0.98 0.00 0.00 1.02 0.00 0.00 151 A 7.37 3.50 -0.24 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 0.00 0.00 152 K 8.35 4.03 0.00 2.03 1.96 0.00 1.62 0.00 0.00 1.54 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.51 7.81 153 A 7.96 3.97 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 0.00 154 S 7.95 4.05 0.00 4.00 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 0.00 155 I 7.91 3.46 1.87 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.08 0.68 0.00 0.00 156 E 8.37 4.05 0.00 2.18 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.56 0.00 157 K 8.07 4.28 0.00 1.98 2.00 0.00 1.74 0.00 0.00 1.88 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.77 1.94 7.81 158 H 8.44 4.46 0.00 3.36 3.43 0.00 5.68 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 0.00 159 I 8.02 3.85 2.18 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.96 1.00 0.00 0.00 160 W 8.43 4.34 0.00 3.40 3.44 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 0.00 161 M 7.81 3.32 0.00 1.96 2.01 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.35 0.00 162 L 8.53 4.04 0.00 1.65 1.61 0.87 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 163 Q 8.42 4.00 0.00 2.37 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.52 2.75 0.00 164 A 8.34 4.02 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 0.00 165 E 7.98 4.00 0.00 2.24 2.24 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 2.38 2.49 0.00 166 L 7.68 4.33 0.00 1.78 1.64 0.83 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 167 G 8.22 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 0.00 0.00 0.00 168 Q 8.29 4.54 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.30 2.29 0.00 169 A 8.37 4.40 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 0.00 170 P 0.00 4.42 0.00 2.13 2.29 0.00 3.89 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 2.08 2.42 0.00 171 K 8.03 3.86 0.00 1.93 1.90 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.11 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.62 7.81 172 L 7.98 4.19 0.00 1.63 1.58 0.93 0.94 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