NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.2686 8.1593 110.9409 61.7499 70.3485 174.0442 3 T 4.2152 8.0136 114.9507 59.7858 71.8396 173.5053 4 P 4.2737 0.0000 0.0000 65.7755 31.7080 180.0183 5 S 4.3997 8.0419 111.5496 61.3556 62.1450 176.6151 6 R 3.9658 7.9173 120.2056 59.3159 30.1929 178.5617 7 R 3.9397 7.8208 117.4100 59.5476 29.9822 179.1413 8 R 3.9283 8.2346 118.0823 59.5723 30.2992 178.6514 9 L 4.1607 8.0397 118.6140 57.8214 41.5136 179.5969 10 M 4.2465 8.9454 121.8738 59.1752 32.0832 179.5239 11 R 4.0801 8.1297 120.7940 61.5838 29.5418 180.2842 12 D 4.7209 8.6285 119.6857 57.3366 40.7888 178.8099 13 F 4.4286 8.5082 121.0482 61.0951 39.3249 176.9216 14 K 3.7531 8.1613 119.3297 59.6227 31.9332 178.6923 15 K 4.0273 7.9365 118.1509 59.5635 31.8126 179.1874 16 L 4.0073 7.7857 119.0420 57.7440 41.9785 178.6306 17 Q 3.8092 7.8080 119.4816 59.4802 29.1311 176.6618 18 E 3.9044 8.6628 119.0380 58.6761 30.7197 177.0640 19 D 4.7733 7.9480 120.4065 50.9154 41.7335 172.8169 20 P 4.2623 0.0000 0.0000 61.9740 32.1844 175.0513 21 P 4.4456 0.0000 0.0000 61.9858 32.1244 176.0791 22 A 4.1465 8.4658 122.6964 53.1852 18.8431 178.2987 23 G 4.5595 9.0703 106.9563 46.2011 0.0000 172.9512 24 V 4.5162 6.9442 118.2841 61.0716 34.1636 174.9212 25 S 4.5857 8.5737 117.2665 57.8731 66.2882 174.7309 26 G 4.5207 8.8123 111.3415 46.3214 0.0000 171.8769 27 A 4.6386 8.9956 120.7923 49.9536 23.0112 174.4744 28 P 4.2520 0.0000 0.0000 62.1940 32.2611 175.9855 29 T 4.1772 8.3698 111.4166 60.4581 69.7799 175.6474 30 E 3.6745 8.8055 122.5771 59.5120 30.8995 178.7773 31 D 4.4173 8.0301 117.3528 54.9512 39.9564 177.2724 32 N 4.8374 9.0551 121.8961 51.4755 39.6314 176.7296 33 I 3.6403 8.3078 122.5962 63.2520 38.3791 176.2056 34 L 4.4828 7.9347 118.4403 56.1234 41.7580 175.8888 35 T 5.3838 8.2423 116.1219 61.7933 72.5580 173.0986 36 W 5.5415 9.7054 124.8749 55.0035 34.1232 173.9258 37 E 5.3000 9.5665 120.2492 54.8500 32.7026 175.1851 38 A 5.2237 9.3480 124.2653 50.5917 23.8501 174.8257 39 I 5.0780 10.1182 119.1231 59.6192 41.0985 174.7815 40 I 4.8885 8.7299 127.7572 59.4170 39.9464 175.0253 41 F 5.1884 9.6830 127.6055 56.6507 40.3681 175.9493 42 G 4.6545 10.2223 111.8098 45.4420 0.0000 171.0309 43 P 4.7388 0.0000 0.0000 63.1715 31.5480 176.2349 44 Q 4.1830 8.9714 125.1250 57.8444 29.8254 175.6957 45 E 3.9330 10.1673 117.8537 56.5585 27.7437 174.9425 46 T 4.8841 7.4574 108.0971 60.0486 71.9124 172.7055 47 P 4.3261 0.0000 0.0000 64.3285 31.1500 176.6188 48 F 4.7886 7.9901 117.3032 57.0580 40.8225 175.0564 49 E 4.7990 8.2749 122.3889 57.3702 29.6882 177.4266 50 D 4.8186 9.0530 123.0511 54.4403 38.9843 174.2574 51 G 3.7140 7.6639 106.7310 45.6047 0.0000 173.2359 52 T 5.0745 7.8649 114.1741 59.8594 70.5209 173.3608 53 F 5.1185 8.8343 125.9108 55.4479 41.7276 174.7283 54 K 4.9883 9.6776 125.6622 55.3270 33.8510 175.2582 55 L 5.4554 9.3090 126.4706 53.0264 46.8006 175.2678 56 S 5.2762 8.5829 114.6346 56.5847 66.1889 172.7908 57 L 4.8734 8.9875 122.7601 52.9307 44.6470 174.9455 58 E 4.6759 8.7131 125.9584 54.8678 30.6863 175.0107 59 F 4.6607 9.4774 126.5087 56.4296 41.3182 175.5645 60 T 4.6972 8.1664 116.0045 61.5424 71.4276 174.9675 61 E 4.2785 8.6860 122.6566 57.9900 30.0314 177.3025 62 E 4.2866 8.0665 117.1941 58.4329 30.1219 175.7463 63 Y 4.7097 8.1112 119.7230 56.8856 39.0283 174.8892 64 P 3.8808 0.0000 0.0000 62.8909 32.1908 177.5347 65 N 4.4271 8.1687 117.6414 55.7244 38.4242 175.1676 66 K 4.4339 7.8448 118.8165 53.5885 34.0316 173.7762 67 P 3.0046 0.0000 0.0000 61.2240 32.0179 173.8097 68 P 4.3546 0.0000 0.0000 61.9337 33.5268 174.5204 69 T 4.4750 7.7901 109.0229 59.9737 71.3577 173.6858 70 V 4.7128 7.9945 122.6208 61.1062 35.1857 174.1941 71 K 5.0787 8.5236 125.0553 54.6449 36.6800 174.7860 72 F 4.9418 8.7967 121.1390 56.5043 39.5759 176.4394 73 I 4.0429 9.3348 126.1350 64.6121 37.4098 177.2007 74 S 4.4806 8.2707 115.6935 58.0256 63.6747 174.3094 75 K 4.1588 8.5332 122.5576 56.7567 32.5965 175.6767 76 M 4.6235 8.1866 123.2693 53.9736 35.4088 174.8246 77 F 4.5682 8.3206 124.4353 57.4720 40.6801 172.7737 78 H 4.7809 8.2041 126.2510 53.9563 33.0350 172.3340 79 P 4.1798 0.0000 0.0000 65.7647 31.5009 177.1591 80 N 4.6883 8.2021 113.1445 52.6330 38.6572 174.0176 81 V 4.7214 7.8659 118.3824 60.9907 34.1627 175.2492 82 Y 4.3693 8.5329 124.5155 57.2253 38.5627 176.6832 83 A 4.0967 8.7383 123.9939 55.1575 18.4911 178.1932 84 D 4.6378 8.2147 113.0365 53.3540 39.9386 177.4078 85 G 4.0760 8.2989 109.4806 45.3067 0.0000 173.6568 86 S 4.6536 8.7970 117.8891 58.8098 63.8362 173.3864 87 I 4.3256 8.4231 126.8235 60.5487 37.9301 175.1838 88 C 4.4920 8.5813 128.8217 58.0151 31.8929 172.5269 89 L 4.6828 8.0419 127.5719 52.6215 44.4129 175.3183 90 D 4.1192 8.1216 120.1174 58.8900 42.0428 178.3184 91 I 3.9578 7.7042 113.7489 63.1872 38.2047 177.7844 92 L 4.3662 7.6186 121.8900 56.6563 43.8916 176.3089 93 Q 4.5845 8.1941 114.5884 56.1875 28.4056 176.7436 94 N 4.5430 9.4633 121.5036 55.7976 38.5597 174.6207 95 R 4.7175 8.5883 113.8514 56.0272 32.2061 175.1963 96 W 5.1263 8.3433 126.8269 57.1985 31.4964 175.1672 97 S 3.9166 6.6434 116.4568 55.4407 64.2930 173.0021 98 P 4.4014 0.0000 0.0000 64.1380 31.2132 177.2358 99 T 3.9378 6.6291 114.1828 65.1429 68.7973 175.0155 100 Y 4.5218 7.0521 119.5308 57.5548 38.5891 174.6077 101 D 5.4558 8.2937 122.8491 49.6903 44.1237 176.5374 102 V 3.5272 8.5746 117.7065 66.3657 31.0972 177.5089 103 A 3.9864 8.1802 119.4262 55.2596 18.1738 179.1922 104 A 4.1207 8.3761 118.8862 55.4025 18.4230 179.6576 105 I 3.5893 7.9722 118.4212 64.6194 37.1452 178.5334 106 L 3.9081 8.3687 119.6964 58.1965 41.5207 179.4387 107 T 3.8774 8.7246 116.7210 67.0899 68.4262 176.6765 108 S 4.0682 8.4513 116.9397 61.7259 62.7239 176.8792 109 I 3.7182 7.9338 122.6571 64.1618 36.2386 178.3181 110 Q 3.9655 8.2524 120.8379 59.3257 28.9243 178.5291 111 S 3.9911 8.1057 116.2197 61.4940 62.6441 176.2702 112 L 3.9448 8.1006 122.4458 58.1571 41.6988 178.6380 113 L 3.7093 7.4472 120.7087 58.3891 41.6029 179.2882 114 D 5.0373 7.6445 122.1692 57.9570 40.7859 179.8851 115 E 4.8446 7.8790 118.0568 52.2651 30.4954 175.4285 116 P 4.5646 0.0000 0.0000 62.1569 32.2204 175.8546 117 N 4.7974 8.9492 118.6499 51.2892 40.0038 173.4791 118 P 4.1976 0.0000 0.0000 65.1566 31.9125 175.3755 119 N 4.0345 8.3517 117.2096 54.4309 38.6221 174.0691 120 S 3.6010 8.6499 116.1477 58.4644 61.2494 169.9771 121 P 4.2585 0.0000 0.0000 63.4688 32.0465 177.2150 122 A 3.9540 8.3975 122.4930 52.8331 19.3682 177.3627 123 N 4.7749 7.3902 114.4633 50.3902 39.3640 174.1472 124 S 4.0848 8.5378 119.5326 61.1657 62.8406 176.1833 125 L 3.9239 7.9577 123.0482 57.8741 41.8893 178.6286 126 A 3.9121 8.8846 120.7253 54.9798 18.1829 179.5611 127 A 3.8588 7.8964 119.3775 55.3459 18.0118 179.3542 128 Q 3.9325 8.6716 118.5093 59.1407 28.7697 178.7640 129 L 4.2454 7.8102 118.9571 57.3105 42.2020 178.0763 130 Y 3.4398 7.6595 117.9892 60.8459 38.4535 176.5001 131 Q 3.9885 7.9662 119.1597 56.8064 29.2160 176.2189 132 E 3.8436 7.4633 120.8416 59.1833 30.8248 177.9780 133 N 4.7878 8.2325 126.4681 51.6257 39.7582 175.7298 134 R 4.1957 8.2735 127.4471 60.7036 29.0879 176.6078 135 R 4.1053 8.1022 117.2242 60.0118 30.0791 178.4120 136 E 4.0736 9.6856 119.2028 58.6883 29.5162 177.5955 137 Y 4.2912 7.5763 118.7487 61.3279 38.8177 178.1845 138 E 3.7644 8.6538 121.5392 59.7537 29.3042 180.3171 139 K 3.9392 7.3187 122.2493 59.6798 32.0412 182.9012 140 R 3.9847 8.0247 119.4209 58.7579 29.9964 179.2135 141 V 3.3141 7.5814 118.4078 65.7576 31.2517 177.8855 142 Q 3.8781 8.0891 121.9397 59.7227 28.6495 178.8492 143 Q 3.8747 7.4524 120.2259 59.5450 28.3101 180.3653 144 I 4.2701 7.3494 121.2305 64.7866 37.5132 178.9416 145 V 3.5356 8.1759 120.6404 65.9113 31.3360 179.9407 146 E 2.5400 7.9022 119.6325 58.7187 29.1179 179.0468 147 Q 3.9073 7.6275 117.5206 58.8239 28.7886 178.4634 148 S 4.1440 6.9832 115.4894 61.0033 64.0739 176.2222 149 W 4.7575 6.6913 120.1273 56.4402 27.1726 176.1461 150 L 4.3932 7.4804 123.5865 55.2406 41.8915 175.6010 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 T 8.16 4.27 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 1.22 0.00 0.00 3 T 8.01 4.22 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 4 P 0.00 4.27 0.00 2.21 2.16 0.00 3.64 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.15 0.00 5 S 8.04 4.40 0.00 4.13 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 6 R 7.92 3.97 0.00 1.90 1.98 0.00 3.43 0.00 0.00 3.63 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.69 0.00 7 R 7.82 3.94 0.00 2.06 2.04 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 1.68 1.86 0.00 8 R 8.23 3.93 0.00 1.99 2.27 0.00 3.23 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.90 0.00 9 L 8.04 4.16 0.00 2.08 1.95 0.71 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 10 M 8.95 4.25 0.00 2.08 2.37 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 2.81 2.56 0.00 11 R 8.13 4.08 0.00 1.84 1.94 0.00 3.27 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 1.56 1.55 0.00 12 D 8.63 4.72 0.00 3.00 2.86 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 13 F 8.51 4.43 0.00 3.26 3.29 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 14 K 8.16 3.75 0.00 1.96 1.97 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.51 7.81 15 K 7.94 4.03 0.00 2.10 1.87 0.00 1.78 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.69 7.81 16 L 7.79 4.01 0.00 1.81 1.81 0.97 0.87 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 17 Q 7.81 3.81 0.00 1.33 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.64 0.00 0.00 0.00 0.00 0.00 2.20 2.27 0.00 18 E 8.66 3.90 0.00 2.02 1.89 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 2.33 2.42 0.00 19 D 7.95 4.77 0.00 2.64 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 20 P 0.00 4.26 0.00 2.05 2.02 0.00 3.68 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.37 0.00 21 P 0.00 4.45 0.00 2.06 2.01 0.00 3.70 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 22 A 8.47 4.15 1.32 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 0.00 0.00 0.00 23 G 9.07 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 V 6.94 4.52 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 0.80 0.00 0.00 0.98 0.00 0.00 25 S 8.57 4.59 0.00 3.89 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.81 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 A 9.00 4.64 1.18 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 0.00 0.00 28 P 0.00 4.25 0.00 1.39 0.49 0.00 2.41 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 1.04 0.72 0.00 29 T 8.37 4.18 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 1.25 0.00 0.00 30 E 8.81 3.67 0.00 2.02 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 2.23 2.26 0.00 31 D 8.03 4.42 0.00 2.67 2.47 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 32 N 9.06 4.84 0.00 2.87 2.94 0.00 0.00 5.57 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 33 I 8.31 3.64 1.79 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.61 0.93 0.00 0.00 34 L 7.93 4.48 0.00 1.83 1.96 1.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 35 T 8.24 5.38 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 1.29 0.00 0.00 36 W 9.71 5.54 0.00 3.23 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 E 9.57 5.30 0.00 1.88 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 2.26 2.28 0.00 38 A 9.35 5.22 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 I 10.12 5.08 1.70 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 1.02 0.59 0.00 0.00 40 I 8.73 4.89 2.06 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 1.24 0.91 1.00 0.00 0.00 41 F 9.68 5.19 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 42 G 10.22 4.65 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 0.00 0.00 0.00 43 P 0.00 4.74 0.00 2.19 2.20 0.00 3.97 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.25 0.00 44 Q 8.97 4.18 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.94 0.00 0.00 0.00 0.00 0.00 2.38 2.61 0.00 45 E 10.17 3.93 0.00 2.04 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 2.16 2.10 0.00 46 T 7.46 4.88 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 47 P 0.00 4.33 0.00 1.81 2.17 0.00 3.92 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 2.01 2.19 0.00 48 F 7.99 4.79 0.00 3.20 3.32 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 0.00 49 E 8.27 4.80 0.00 2.22 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.36 0.00 50 D 9.05 4.82 0.00 3.11 3.09 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 51 G 7.66 3.71 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 0.00 0.00 0.00 52 T 7.86 5.07 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 1.59 0.00 0.00 53 F 8.83 5.12 0.00 3.29 3.09 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 54 K 9.68 4.99 0.00 1.90 1.79 0.00 1.64 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.48 7.81 55 L 9.31 5.46 0.00 1.56 1.46 1.13 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 56 S 8.58 5.28 0.00 3.90 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 57 L 8.99 4.87 0.00 1.76 1.30 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 58 E 8.71 4.68 0.00 2.00 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 2.17 2.26 0.00 59 F 9.48 4.66 0.00 2.94 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 60 T 8.17 4.70 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 61 E 8.69 4.28 0.00 1.94 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 2.43 0.00 62 E 8.07 4.29 0.00 2.11 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 2.39 2.31 0.00 63 Y 8.11 4.71 0.00 3.24 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 64 P 0.00 3.88 0.00 2.20 1.43 0.00 3.67 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.79 0.00 65 N 8.17 4.43 0.00 2.91 2.99 0.00 0.00 6.73 7.62 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 66 K 7.84 4.43 0.00 1.74 1.62 0.00 1.66 0.00 0.00 1.80 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.22 1.28 7.81 67 P 0.00 3.00 0.00 1.46 0.49 0.00 3.48 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 68 P 0.00 4.35 0.00 0.94 0.49 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.73 0.00 69 T 7.79 4.47 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 1.07 0.00 0.00 70 V 7.99 4.71 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 0.84 0.00 0.00 0.67 0.00 0.00 71 K 8.52 5.08 0.00 1.69 1.64 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.31 1.31 7.81 72 F 8.80 4.94 0.00 3.00 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 73 I 9.33 4.04 2.05 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.80 0.97 0.00 0.00 74 S 8.27 4.48 0.00 3.99 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 75 K 8.53 4.16 0.00 1.72 1.72 0.00 1.64 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.51 7.81 76 M 8.19 4.62 0.00 1.80 1.28 0.00 0.00 0.00 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 1.96 0.00 77 F 8.32 4.57 0.00 2.89 2.86 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 78 H 8.20 4.78 0.00 3.10 2.95 0.00 5.77 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.18 0.00 1.91 1.90 0.00 3.04 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.94 0.00 80 N 8.20 4.69 0.00 2.77 2.89 0.00 0.00 6.52 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 81 V 7.87 4.72 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 0.98 0.00 0.00 0.99 0.00 0.00 82 Y 8.53 4.37 0.00 3.08 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 83 A 8.74 4.10 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 D 8.21 4.64 0.00 2.81 2.79 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 85 G 8.30 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 S 8.80 4.65 0.00 3.94 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 87 I 8.42 4.33 1.66 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.33 0.76 0.00 0.00 88 C 8.58 4.49 0.00 2.88 2.86 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 89 L 8.04 4.68 0.00 1.61 1.36 0.85 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.12 4.12 0.00 2.77 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 91 I 7.70 3.96 1.94 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.54 0.71 0.00 0.00 92 L 7.62 4.37 0.00 1.69 1.67 0.84 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 93 Q 8.19 4.58 0.00 2.11 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.73 0.00 0.00 0.00 0.00 0.00 2.25 2.24 0.00 94 N 9.46 4.54 0.00 2.69 2.86 0.00 0.00 6.64 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 95 R 8.59 4.72 0.00 1.95 1.94 0.00 3.25 0.00 0.00 3.49 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 96 W 8.34 5.13 0.00 3.52 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 97 S 6.64 3.92 0.00 2.99 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 98 P 0.00 4.40 0.00 1.90 2.04 0.00 3.40 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.06 0.00 99 T 6.63 3.94 3.62 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 0.99 0.00 0.00 100 Y 7.05 4.52 0.00 2.32 2.70 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 0.00 101 D 8.29 5.46 0.00 3.15 2.89 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 0.00 102 V 8.57 3.53 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 0.67 0.00 0.00 0.25 0.00 0.00 103 A 8.18 3.99 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 0.00 104 A 8.38 4.12 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 0.00 105 I 7.97 3.59 1.96 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.96 0.83 0.00 0.00 106 L 8.37 3.91 0.00 1.99 1.72 0.89 0.85 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 0.00 107 T 8.72 3.88 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 1.20 0.00 0.00 108 S 8.45 4.07 0.00 3.88 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 0.00 109 I 7.93 3.72 1.88 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 1.26 0.72 0.00 0.00 110 Q 8.25 3.97 0.00 2.23 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 111 S 8.11 3.99 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 0.00 112 L 8.10 3.94 0.00 1.59 1.75 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 113 L 7.45 3.71 0.00 1.69 1.52 0.08 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 114 D 7.64 5.04 0.00 2.61 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 0.00 115 E 7.88 4.84 0.00 1.94 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 0.00 2.14 2.07 0.00 116 P 0.00 4.56 0.00 1.74 1.63 0.00 3.52 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 0.85 0.90 0.00 117 N 8.95 4.80 0.00 2.61 2.69 0.00 0.00 7.19 7.63 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 0.00 118 P 0.00 4.20 0.00 2.22 2.19 0.00 3.82 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 1.98 1.96 0.00 119 N 8.35 4.03 0.00 2.67 2.81 0.00 0.00 7.21 7.63 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 0.00 120 S 8.65 3.60 0.00 4.08 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 0.00 121 P 0.00 4.26 0.00 2.09 1.99 0.00 3.72 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.91 0.00 122 A 8.40 3.95 0.05 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 0.00 0.00 123 N 7.39 4.77 0.00 2.75 2.52 0.00 0.00 6.95 7.63 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 0.00 124 S 8.54 4.08 0.00 4.08 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 0.00 125 L 7.96 3.92 0.00 1.83 1.95 1.03 1.24 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 0.00 126 A 8.88 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 A 7.90 3.86 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 0.00 128 Q 8.67 3.93 0.00 2.25 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.64 0.00 0.00 0.00 0.00 0.00 2.40 2.51 0.00 129 L 7.81 4.25 0.00 2.02 2.05 1.18 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 130 Y 7.66 3.44 0.00 2.19 2.74 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 0.00 131 Q 7.97 3.99 0.00 2.17 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.64 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 132 E 7.46 3.84 0.00 2.32 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 2.36 2.32 0.00 133 N 8.23 4.79 0.00 2.62 2.68 0.00 0.00 7.49 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 0.00 134 R 8.27 4.20 0.00 1.86 1.92 0.00 3.33 0.00 0.00 3.34 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.29 0.00 135 R 8.10 4.11 0.00 2.04 2.04 0.00 3.09 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.72 0.00 136 E 9.69 4.07 0.00 2.06 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 2.26 2.29 0.00 137 Y 7.58 4.29 0.00 3.21 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 0.00 138 E 8.65 3.76 0.00 2.06 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 2.45 2.69 0.00 139 K 7.32 3.94 0.00 1.89 1.73 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.35 7.81 140 R 8.02 3.98 0.00 1.27 0.88 0.00 2.43 0.00 0.00 2.56 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.52 0.00 141 V 7.58 3.31 1.50 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 -0.30 0.00 0.00 0.11 0.00 0.00 142 Q 8.09 3.88 0.00 2.20 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.57 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 143 Q 7.45 3.87 0.00 2.20 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.64 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 144 I 7.35 4.27 1.96 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.58 1.13 0.00 0.00 145 V 8.18 3.54 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 0.78 0.00 0.00 0.93 0.00 0.00 146 E 7.90 2.54 0.00 1.94 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 2.31 2.42 0.00 147 Q 7.63 3.91 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.50 0.00 0.00 0.00 0.00 0.00 2.56 2.49 0.00 148 S 6.98 4.14 0.00 3.15 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 W 6.69 4.76 0.00 3.67 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 0.00 150 L 7.48 4.39 0.00 1.93 1.45 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00