NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4852 8.3049 118.1936 54.9637 32.5780 174.7871 2 R 4.0894 8.7024 120.4592 55.4983 31.0016 174.3774 3 H 5.2371 9.3722 118.6747 54.1723 33.0212 172.7232 4 I 4.5862 8.0063 121.6796 59.8639 38.5766 177.0263 5 S 4.6139 8.8118 120.7530 57.0338 65.5199 173.3955 6 P 4.2797 0.0000 0.0000 66.1853 31.1096 178.5676 7 E 4.0234 8.1792 117.3124 59.3324 29.6112 178.5638 8 E 4.0623 8.1880 118.5882 58.9817 29.4277 179.0704 9 L 4.0473 8.1465 120.7636 58.1119 42.1310 178.9104 10 I 3.9352 8.0569 119.5892 64.6084 37.1185 178.3131 11 A 3.9969 8.0262 121.4154 55.0341 18.0671 179.3820 12 L 3.8911 8.4141 119.3700 58.5010 42.0997 178.8097 13 H 3.9439 8.3088 118.3023 59.0925 29.6878 177.0042 14 D 4.2461 8.3902 120.8983 57.3002 40.6861 178.5874 15 A 3.9589 8.0640 121.2728 55.1779 18.3092 179.2608 16 N 4.4413 7.9609 115.5267 56.8715 39.0468 177.1810 17 I 3.8042 8.0900 121.9853 64.3454 36.9273 178.3860 18 S 4.2230 7.8640 114.0184 60.7237 63.2163 175.9337 19 R 3.9576 7.8930 121.2896 57.7204 29.9943 176.2420 20 Y 4.5349 8.3760 113.5776 56.8565 40.1064 176.1045 21 G 3.8545 7.3836 105.0336 44.7470 0.0000 171.6112 22 G 4.2096 8.2696 103.7014 42.6123 0.0000 173.6947 23 L 4.1425 8.7241 121.5162 53.8957 42.0159 175.9345 24 P 4.5609 0.0000 0.0000 62.3535 33.0903 175.9901 25 G 4.0578 8.7434 104.1666 45.6005 0.0000 172.3803 26 M 4.8292 8.0588 117.9554 53.9255 33.1736 177.3756 27 S 4.3046 8.6216 116.6531 60.9411 63.9537 174.2458 28 D 4.5609 7.6595 118.8191 51.9813 43.8438 172.3516 29 P 4.3128 0.0000 0.0000 64.4396 31.9688 176.3677 30 G 3.8987 8.9245 109.6551 46.6343 0.0000 175.3067 31 R 3.8781 7.7620 121.3964 58.6246 29.8431 178.5504 32 A 3.8192 7.7304 120.5817 55.0005 18.4947 179.0223 33 E 3.8548 8.1046 117.2055 59.1454 29.2488 178.7164 34 A 3.9401 7.7972 120.4192 55.1393 18.3840 179.7214 35 I 3.6720 7.8298 118.2485 64.6516 37.3502 178.7776 36 I 3.7527 7.9395 120.8033 64.1806 36.9145 178.7008 37 G 3.6219 8.1362 106.6557 48.0544 0.0000 175.9994 38 R 3.9481 7.5970 119.6094 58.4795 29.9807 179.3518 39 V 3.3695 7.8326 118.6539 66.1727 31.5349 178.2418 40 Q 3.8927 8.1216 117.5429 58.6907 28.4750 178.5549 41 A 4.0404 8.0853 122.0288 54.7710 18.3362 179.6752 42 R 3.8691 8.1161 117.6055 59.4947 30.0686 178.9273 43 V 3.5594 7.7645 117.8612 66.0349 31.2605 177.9469 44 A 4.0121 8.1571 120.5626 55.2299 17.9934 179.0770 45 Y 4.0524 8.3875 117.9536 60.6896 38.9442 176.4927 46 E 4.0780 8.6388 116.4938 55.9093 30.4904 175.8834 47 E 3.7583 7.2863 116.6022 57.2549 27.1002 174.5154 48 I 4.2404 8.2839 118.9204 60.5746 38.3777 176.5502 49 T 4.4472 8.3566 114.8343 61.9450 70.8756 174.7682 50 D 4.4879 8.0156 122.4512 53.9929 42.2627 176.5958 51 L 4.2139 8.6606 127.2401 57.9203 41.6586 179.3714 52 F 4.3688 8.5250 117.8068 60.1081 38.9938 177.5278 53 E 4.0596 8.5285 118.8301 59.0194 29.6195 178.9001 54 V 3.5834 7.8900 118.5282 65.8246 31.5450 177.8567 55 S 3.8858 8.1321 112.6774 61.4997 62.2879 176.0440 56 A 4.0416 8.1379 123.2649 55.4626 17.9749 179.7933 57 T 3.7953 7.6606 113.9537 66.8946 68.5805 176.5179 58 Y 3.8490 7.7736 118.4227 60.8075 37.8061 178.3652 59 L 4.1235 8.1736 121.3676 58.2663 42.2831 179.1743 60 V 3.5542 8.3791 118.1393 66.0138 31.5454 177.7127 61 A 3.9819 8.1452 120.6048 55.5774 17.9314 179.7620 62 T 3.9710 7.7418 112.7234 66.4782 68.7433 176.7516 63 A 4.1674 8.2247 122.1522 54.8180 17.3475 179.0761 64 R 4.4728 8.1093 115.0630 57.0713 30.7415 178.8179 65 G 3.5526 8.1591 104.8385 45.2897 0.0000 172.7477 66 H 4.1097 7.4901 119.9777 57.4001 28.9297 174.8369 67 I 3.5925 7.4161 122.2487 63.5241 37.0575 176.9362 68 F 5.1338 8.2234 118.1571 55.3153 41.1530 176.5688 69 N 4.5175 8.6698 120.1413 56.2106 38.4757 174.7307 70 D 4.5388 7.7283 111.9010 53.6643 44.8013 173.5228 71 A 3.7840 8.5558 120.9337 53.5738 16.2914 180.0314 72 N 4.5482 8.3321 118.8182 57.7274 38.9101 177.0633 73 K 3.9739 7.9882 119.3034 59.5863 32.2618 179.3084 74 R 3.8685 7.9459 117.6405 59.8099 29.9665 179.1698 75 T 3.8621 7.9084 114.9101 66.2940 68.3313 176.6672 76 A 4.0198 8.0376 122.8332 55.1412 18.5588 179.4297 77 L 3.9260 7.9388 118.7642 58.4259 42.1355 178.9652 78 N 4.3477 8.3414 116.7465 56.2687 38.4967 177.6248 79 S 4.0895 8.4663 115.8533 61.3342 62.5849 176.3951 80 A 3.9949 8.1060 124.4294 54.8730 18.0648 179.4614 81 L 4.0390 7.9184 117.1204 57.1924 41.8392 179.1982 82 L 3.8483 8.2665 120.9969 57.8257 41.4609 178.7703 83 F 3.9004 8.1340 120.6852 61.1839 39.2587 177.1833 84 L 3.6929 7.5487 117.4182 57.6424 41.4464 179.3438 85 R 4.5380 7.8722 120.1400 59.0973 29.7961 178.7508 86 R 3.9853 7.8249 116.0472 58.0039 29.9226 177.6469 87 N 4.7436 7.1246 114.2840 52.5725 39.6250 175.8141 88 G 3.8366 7.8470 108.4888 45.1567 0.0000 174.1626 89 V 4.0785 7.7244 123.2405 61.8689 32.5072 175.6219 90 Q 4.5770 8.5798 125.9014 54.6329 28.9055 172.4512 91 V 3.9005 7.9423 114.7308 58.6825 35.2140 174.9347 92 F 4.9887 7.3416 115.2414 55.2286 40.5282 173.7918 93 D 4.6057 8.6809 121.7447 54.8227 42.0390 175.3863 94 S 4.8058 8.2171 116.8567 56.2363 65.4158 173.3093 95 P 4.4272 0.0000 0.0000 65.0546 31.4221 177.5748 96 E 4.2338 7.9250 117.1216 58.3296 30.1121 178.7024 97 L 3.9744 7.9805 118.8427 57.7441 41.5000 179.2876 98 A 3.9654 7.9245 119.8592 55.3842 18.4860 179.2287 99 D 4.2834 8.0289 116.7847 57.3033 40.9793 178.5060 100 L 3.9278 8.1818 121.0820 58.7598 42.0905 179.3245 101 T 3.9257 8.2553 115.8657 66.5588 68.3421 177.0000 102 V 3.7309 8.3050 120.8735 65.8606 31.5405 178.4197 103 G 3.6338 8.7120 105.8386 46.8348 0.0000 175.6523 104 A 4.1467 8.2113 122.8885 55.0959 18.2201 179.6402 105 A 3.9780 7.8446 118.4293 55.2323 18.2950 179.4101 106 T 4.1740 8.1730 107.6263 62.6246 68.9612 176.6030 107 G 4.0480 7.5972 109.5849 45.5618 0.0000 174.1194 108 E 4.1527 7.9739 119.7012 57.4655 29.9918 176.7282 109 I 4.4097 7.4963 119.9355 59.1278 39.0549 176.3882 110 S 4.4918 8.3780 120.5421 57.4354 65.4112 175.5238 111 V 3.6171 8.2462 115.1796 65.0382 31.2911 179.0567 112 S 4.5603 8.0241 115.3716 61.0874 62.6127 176.6416 113 S 4.3023 7.7482 115.3207 61.1219 62.1187 176.3213 114 V 3.5871 8.1051 121.2034 65.9941 31.2124 177.9045 115 A 4.1591 8.6530 120.8361 55.0983 18.1783 179.4000 116 D 4.2055 8.0236 117.4630 57.8532 40.9718 178.8286 117 T 3.8012 7.5907 115.7071 66.9384 68.4958 176.6219 118 L 4.1054 7.9062 120.5509 57.7336 41.6388 179.5833 119 R 2.5100 7.9294 118.8890 58.2419 29.6061 178.6062 120 R 3.7712 7.3665 118.0385 59.1227 30.2997 177.9789 121 L 3.8606 7.7950 117.8020 57.0609 41.5698 177.5185 122 Y 4.9047 7.5157 111.8434 57.1201 39.7614 175.7731 123 G 4.3264 7.6154 108.3507 44.8957 0.0000 173.7705 124 S 4.3893 8.5110 112.7402 58.2050 62.5045 173.6197 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.49 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.65 0.00 2 R 8.70 4.09 0.00 1.62 1.80 0.00 3.04 0.00 0.00 3.29 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 3 H 9.37 5.24 0.00 3.24 3.41 0.00 5.67 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 I 8.01 4.59 1.86 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.52 0.92 0.00 0.00 5 S 8.81 4.61 0.00 4.11 4.03 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 6 P 0.00 4.28 0.00 2.20 2.29 0.00 3.64 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.20 0.00 7 E 8.18 4.02 0.00 2.06 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 8 E 8.19 4.06 0.00 2.27 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 2.35 2.34 0.00 9 L 8.15 4.05 0.00 1.89 1.98 1.07 1.10 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 10 I 8.06 3.94 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 1.67 0.94 1.09 0.00 0.00 11 A 8.03 4.00 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 12 L 8.41 3.89 0.00 1.87 1.86 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 13 H 8.31 3.94 0.00 2.41 2.92 0.00 5.64 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 14 D 8.39 4.25 0.00 2.69 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 15 A 8.06 3.96 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 16 N 7.96 4.44 0.00 2.86 2.89 0.00 0.00 7.22 8.58 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 17 I 8.09 3.80 1.91 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 1.27 0.44 0.87 0.00 0.00 18 S 7.86 4.22 0.00 4.00 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 19 R 7.89 3.96 0.00 1.61 1.74 0.00 2.96 0.00 0.00 2.91 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.17 0.00 20 Y 8.38 4.53 0.00 3.10 2.88 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 21 G 7.38 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 0.00 0.00 0.00 22 G 8.27 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 23 L 8.72 4.14 0.00 1.67 1.65 0.95 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 24 P 0.00 4.56 0.00 2.19 2.07 0.00 3.54 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 1.97 2.08 0.00 25 G 8.74 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 0.00 0.00 0.00 26 M 8.06 4.83 0.00 2.08 1.98 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.22 0.00 27 S 8.62 4.30 0.00 4.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 D 7.66 4.56 0.00 2.71 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 P 0.00 4.31 0.00 2.06 2.00 0.00 3.82 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 30 G 8.92 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 31 R 7.76 3.88 0.00 1.95 1.75 0.00 3.04 0.00 0.00 3.13 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.55 0.00 32 A 7.73 3.82 1.25 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 0.00 0.00 33 E 8.10 3.85 0.00 2.04 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 2.36 2.37 0.00 34 A 7.80 3.94 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 35 I 7.83 3.67 1.80 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.90 0.86 0.00 0.00 36 I 7.94 3.75 2.03 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 1.60 0.96 1.06 0.00 0.00 37 G 8.14 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 0.00 0.00 0.00 0.00 38 R 7.60 3.95 0.00 2.04 1.91 0.00 3.14 0.00 0.00 3.03 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.74 0.00 39 V 7.83 3.37 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.06 0.00 0.00 0.71 0.00 0.00 40 Q 8.12 3.89 0.00 2.19 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.23 2.44 0.00 41 A 8.09 4.04 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 42 R 8.12 3.87 0.00 1.95 2.07 0.00 3.05 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 1.62 1.65 0.00 43 V 7.76 3.56 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 1.16 0.00 0.00 0.87 0.00 0.00 44 A 8.16 4.01 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 45 Y 8.39 4.05 0.00 2.91 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 46 E 8.64 4.08 0.00 2.18 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 2.46 0.00 47 E 7.29 3.76 0.00 2.10 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 2.23 2.19 0.00 48 I 8.28 4.24 1.89 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 1.37 0.52 0.94 0.00 0.00 49 T 8.36 4.45 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 1.24 0.00 0.00 50 D 8.02 4.49 0.00 2.81 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 51 L 8.66 4.21 0.00 1.30 1.51 0.71 1.09 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 52 F 8.53 4.37 0.00 3.38 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 53 E 8.53 4.06 0.00 2.16 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 2.41 2.44 0.00 54 V 7.89 3.58 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 0.60 0.00 0.00 1.09 0.00 0.00 55 S 8.13 3.89 0.00 4.23 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 56 A 8.14 4.04 1.52 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 57 T 7.66 3.80 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 1.03 0.00 0.00 58 Y 7.77 3.85 0.00 3.17 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 59 L 8.17 4.12 0.00 1.92 1.85 0.98 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 60 V 8.38 3.55 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.97 0.00 0.00 61 A 8.15 3.98 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 62 T 7.74 3.97 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 1.40 0.00 0.00 63 A 8.22 4.17 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 64 R 8.11 4.47 0.00 1.88 1.97 0.00 3.12 0.00 0.00 3.35 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 65 G 8.16 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 H 7.49 4.11 0.00 3.37 3.28 0.00 5.76 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 67 I 7.42 3.59 1.13 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.20 -0.15 0.00 0.00 68 F 8.22 5.13 0.00 3.23 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 69 N 8.67 4.52 0.00 2.81 2.94 0.00 0.00 6.67 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 D 7.73 4.54 0.00 2.68 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 A 8.56 3.78 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.33 4.55 0.00 2.82 2.95 0.00 0.00 7.00 7.31 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 73 K 7.99 3.97 0.00 1.80 1.86 0.00 1.68 0.00 0.00 1.83 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.56 7.81 74 R 7.95 3.87 0.00 1.79 1.89 0.00 3.19 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 75 T 7.91 3.86 4.34 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 1.27 0.00 0.00 76 A 8.04 4.02 1.48 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 0.00 0.00 0.00 77 L 7.94 3.93 0.00 1.79 1.66 0.95 0.52 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 78 N 8.34 4.35 0.00 2.82 2.84 0.00 0.00 6.82 7.14 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 79 S 8.47 4.09 0.00 4.00 4.16 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 80 A 8.11 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 81 L 7.92 4.04 0.00 1.82 1.57 1.03 0.33 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 82 L 8.27 3.85 0.00 1.74 1.79 0.87 0.66 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 83 F 8.13 3.90 0.00 2.87 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 84 L 7.55 3.69 0.00 1.76 1.52 1.02 0.47 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 85 R 7.87 4.54 0.00 1.81 1.82 0.00 3.10 0.00 0.00 3.20 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.46 0.00 86 R 7.82 3.99 0.00 1.81 1.79 0.00 3.09 0.00 0.00 3.14 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 87 N 7.12 4.74 0.00 2.25 2.47 0.00 0.00 7.13 7.53 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 88 G 7.85 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 89 V 7.72 4.08 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 1.08 0.00 0.00 0.79 0.00 0.00 90 Q 8.58 4.58 0.00 2.11 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.55 0.00 0.00 0.00 0.00 0.00 2.27 1.95 0.00 91 V 7.94 3.90 1.39 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 0.33 0.00 0.00 0.75 0.00 0.00 92 F 7.34 4.99 0.00 3.15 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 93 D 8.68 4.61 0.00 2.75 2.72 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 94 S 8.22 4.81 0.00 3.98 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 95 P 0.00 4.43 0.00 2.10 2.12 0.00 3.77 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 96 E 7.92 4.23 0.00 2.04 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 2.27 0.00 97 L 7.98 3.97 0.00 1.83 1.76 1.08 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 98 A 7.92 3.97 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 99 D 8.03 4.28 0.00 2.70 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 L 8.18 3.93 0.00 1.81 1.91 0.93 1.03 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 0.00 101 T 8.26 3.93 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 1.25 0.00 0.00 102 V 8.30 3.73 2.20 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 1.02 0.00 0.00 0.98 0.00 0.00 103 G 8.71 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 A 8.21 4.15 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 0.00 105 A 7.84 3.98 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 0.00 106 T 8.17 4.17 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 1.24 0.00 0.00 107 G 7.60 4.05 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 0.00 108 E 7.97 4.15 0.00 1.97 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 2.30 2.33 0.00 109 I 7.50 4.41 1.88 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 1.36 0.59 0.92 0.00 0.00 110 S 8.38 4.49 0.00 4.05 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 8.25 3.62 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.93 0.00 0.00 112 S 8.02 4.56 0.00 3.87 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 S 7.75 4.30 0.00 4.03 4.01 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 0.00 114 V 8.11 3.59 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.02 0.00 0.00 115 A 8.65 4.16 1.52 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 0.00 116 D 8.02 4.21 0.00 2.86 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 0.00 117 T 7.59 3.80 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 1.16 0.00 0.00 118 L 7.91 4.11 0.00 2.09 2.16 1.11 1.06 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 0.00 119 R 7.93 2.51 0.00 1.55 1.80 0.00 2.99 0.00 0.00 3.04 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.06 0.00 120 R 7.37 3.77 0.00 1.75 1.97 0.00 3.27 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 1.54 1.58 0.00 121 L 7.79 3.86 0.00 0.86 0.13 0.71 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 122 Y 7.52 4.90 0.00 3.25 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 G 7.62 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 0.00 124 S 8.51 4.39 0.00 3.91 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