NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2532 8.1733 122.0586 56.4084 34.2058 174.5747 2 I 4.7349 8.2437 127.2241 58.9641 37.5930 174.0082 3 L 4.3790 9.2635 128.5745 54.5960 42.9608 177.2157 4 K 4.2191 9.2500 121.3380 55.7314 33.1067 178.2843 5 K 3.3752 8.6261 123.5882 59.6760 32.0117 178.7664 6 Q 3.9617 7.8993 118.7458 58.3796 29.0946 177.5681 7 E 3.9341 8.0025 119.6512 58.9947 29.5853 178.5491 8 L 3.8403 7.6798 120.3962 58.4219 42.2512 178.3621 9 C 4.2563 8.3380 116.6442 60.0311 38.7136 176.3685 10 K 3.8935 8.0759 119.9625 59.4151 31.5959 179.0755 11 N 4.2289 8.1498 116.6800 56.2504 38.4273 177.0793 12 L 3.6928 7.7336 120.1962 57.9323 41.7595 179.8241 13 V 3.5168 7.6101 117.2127 66.1207 31.2983 177.9994 14 A 4.0347 8.1278 119.2708 54.5925 18.1504 178.4984 15 Q 4.3485 7.7773 114.9878 54.9683 28.9503 175.8807 16 G 3.9221 7.8202 107.4441 46.9139 0.0000 175.2554 17 M 4.0337 8.2029 121.7056 56.7893 32.5521 175.3124 18 N 4.5543 8.1046 117.4210 54.9632 39.0246 174.6433 19 G 3.8564 8.9972 114.1951 45.6052 0.0000 172.2243 20 Y 3.9962 8.0379 121.8622 58.2666 38.6766 175.4899 21 Q 3.5317 8.5955 128.6554 57.5837 27.4495 172.4308 22 H 3.9003 8.1223 108.2949 56.2474 26.7160 174.8980 23 I 4.0821 7.3779 120.4872 59.7333 37.2950 176.1216 24 T 4.4841 8.1285 116.0037 60.9994 69.9201 175.4398 25 L 4.2076 8.8378 123.0548 58.0132 41.6677 177.9967 26 P 4.9061 0.0000 0.0000 65.1312 31.3165 178.4086 27 N 4.4898 8.1240 115.0026 56.1237 38.4623 177.5519 28 W 4.0775 7.9762 119.8998 59.6793 29.2060 178.6626 29 V 3.7461 8.4816 118.7318 66.2268 31.0269 177.2326 30 C 2.9380 8.2282 118.2070 59.3774 44.2797 175.8007 31 T 3.8684 7.8458 116.8406 66.6998 68.1569 176.6247 32 A 4.0156 8.0700 122.6497 54.8737 18.2762 179.5686 33 F 3.3341 8.5020 119.8203 61.6570 39.2704 177.2216 34 H 4.0495 7.9832 114.2154 58.2195 28.5304 177.4686 35 E 4.2500 8.1825 120.5783 58.6689 29.8600 177.7792 36 S 4.4876 7.5834 109.0110 56.6689 64.7089 174.3775 37 S 2.8138 8.2359 116.0377 59.8262 60.5784 171.4400 38 Y 3.8092 7.7566 113.8891 58.9534 35.2804 168.6685 39 N 4.9284 7.9893 120.2453 52.7126 39.1760 175.7455 40 T 4.1479 9.1762 117.6204 63.6228 69.7397 175.7756 41 R 4.6764 8.1754 120.0398 55.8860 31.0183 176.4191 42 A 4.3693 8.1050 123.2678 52.2393 19.4314 177.2659 43 T 5.5283 8.2134 110.3052 59.1487 72.5326 172.8995 44 N 4.8554 8.2003 120.9213 52.4713 42.5177 172.1817 45 H 5.0809 8.8919 126.5042 55.5249 31.1144 174.3309 46 N 4.9217 9.4255 124.6961 51.7508 40.5724 176.4291 47 T 3.8721 8.4813 110.0348 64.2917 68.9926 174.8408 48 D 4.5613 8.0402 120.0490 53.0078 39.5963 177.2752 49 G 3.9228 8.0210 109.0037 45.3967 0.0000 174.0625 50 S 4.6593 8.0564 114.9522 58.0720 65.3061 173.2093 51 T 5.0203 8.5550 115.4660 61.9594 72.8325 172.8785 52 D 5.2751 8.9823 125.6978 53.2044 42.9187 175.0283 53 Y 4.9354 9.0928 121.5338 57.3895 41.3818 177.5333 54 G 4.4146 9.0978 112.0044 45.2950 0.0000 173.5309 55 I 4.1606 8.4077 116.8553 62.9269 38.0295 177.4114 56 L 4.5906 7.9838 116.9785 53.5392 42.4834 176.3253 57 Q 3.5239 7.9078 116.6064 57.1258 26.5786 173.9711 58 I 4.2832 8.2449 119.1522 60.8741 39.3397 176.6670 59 N 5.3573 9.1277 125.9262 53.1277 40.2170 175.1269 60 S 5.0176 9.1230 119.8028 58.7802 63.3611 174.6960 61 R 3.9848 8.4894 122.5739 58.1831 30.7905 177.5381 62 Y 4.0952 7.6710 114.9883 57.7523 40.0541 176.8721 63 W 4.8479 8.3200 118.8749 57.2447 32.2305 173.6187 64 C 5.6242 8.2739 112.1855 53.7916 43.4805 172.2313 65 H 5.3443 9.1012 120.0025 54.5815 31.0434 174.4621 66 D 4.5587 8.7859 123.5579 52.4373 40.3950 177.0650 67 G 3.8849 8.2225 107.9228 45.7797 0.0000 174.1705 68 K 4.5827 8.2679 115.4746 56.6632 34.0600 175.6915 69 T 4.5520 7.7722 116.1829 61.1824 70.1515 172.5617 70 P 4.2615 0.0000 0.0000 63.7490 31.9376 176.2372 71 G 3.7763 8.7708 109.6453 46.3209 0.0000 173.4963 72 S 4.2254 8.1438 113.7155 58.2070 62.7872 173.8554 73 K 4.1959 8.6317 126.0475 55.6126 33.9952 175.7993 74 N 4.2118 8.0851 116.8350 54.5068 37.1091 175.0572 75 A 4.1273 7.9272 120.6932 55.0594 19.0445 178.5149 76 C 4.5304 8.8557 112.0428 57.0508 41.1402 172.7290 77 N 4.1544 8.0901 117.2607 53.8281 37.0803 173.3736 78 I 4.5899 8.1270 117.4634 59.3422 42.1418 173.5159 79 S 4.6198 8.5034 120.9005 58.1146 63.0605 175.8334 80 C 4.0685 8.9242 125.6362 59.8767 34.1232 176.5960 81 S 3.8371 7.8406 115.3110 61.0598 62.2458 176.1155 82 K 4.2135 7.8689 120.6035 57.8499 32.0153 177.3855 83 L 4.8100 7.9141 119.3688 54.6377 41.6662 177.3305 84 L 5.3426 7.9482 116.2423 53.5547 42.5252 176.1458 85 D 4.7972 7.7694 119.1660 52.3193 41.5254 175.5452 86 D 4.5662 8.4992 117.0873 54.8292 41.2742 175.7379 87 D 4.7749 7.7273 119.0551 52.7589 42.3210 176.0809 88 I 4.6337 8.0418 121.0318 60.6233 37.9817 177.4525 89 T 3.7569 8.0949 119.3953 67.3462 68.2571 176.1738 90 D 4.3643 7.9781 120.3572 56.4145 39.3824 177.9409 91 D 4.3392 8.0458 119.8595 57.3564 40.8773 178.6750 92 L 3.7643 8.2518 119.7754 57.5195 41.3208 179.7212 93 K 3.8631 7.7750 117.8268 59.3165 32.2184 178.3480 94 C 4.3675 8.4362 118.8161 59.6547 44.8339 175.3149 95 A 4.0619 8.0969 122.4319 55.3711 17.7755 179.7538 96 K 3.7437 7.9013 116.9080 59.2754 31.9559 179.5017 97 K 4.0020 7.9360 120.0676 59.4042 32.1169 179.0197 98 I 2.9426 7.3242 119.3007 64.1676 37.0339 178.1825 99 A 4.5347 7.9275 123.1290 54.5525 17.8937 179.9279 100 G 3.6794 8.6866 104.5220 48.2140 0.0000 175.8898 101 E 4.0638 8.2806 119.9613 58.7756 29.6027 178.7056 102 A 4.1342 8.0113 118.6783 51.7214 19.7272 176.9752 103 K 3.6329 8.0267 115.7829 55.9260 29.6710 174.5689 104 G 3.8156 6.7554 105.8008 44.8866 0.0000 172.9893 105 L 4.5607 7.0157 119.8732 54.5490 41.5083 178.9853 106 T 4.1128 7.6196 111.4731 64.0004 68.8587 173.8121 107 P 4.0817 0.0000 0.0000 64.5404 31.4613 176.0924 108 W 4.5103 8.1568 119.0923 55.2283 28.8011 177.3050 109 V 3.7632 8.6015 125.3196 64.8438 30.6668 178.0606 110 A 4.0622 8.4837 121.2910 54.4817 18.1599 179.4185 111 W 4.0192 8.2869 126.9142 60.5836 30.6369 178.0942 112 K 3.6346 8.5364 116.6861 59.7711 31.6895 179.0431 113 S 4.2729 8.0509 112.8435 60.3555 63.1890 175.4025 114 K 4.2396 8.2241 118.9198 55.8193 33.5288 175.7141 115 C 4.6469 7.4024 115.3186 57.9714 42.6048 174.4020 116 R 3.3633 7.2413 119.7399 57.2053 29.6243 176.6174 117 G 3.7300 8.5945 112.3876 46.1191 0.0000 172.4766 118 H 4.7569 7.4952 116.3554 53.3245 30.9792 174.0041 119 D 4.5113 8.4911 120.3143 54.7157 41.6093 175.6419 120 L 5.0754 8.4159 124.5222 54.6200 42.8701 178.6098 121 S 4.1770 8.4334 116.8873 60.9744 63.0269 176.4238 122 K 3.9147 7.7723 119.1129 58.0963 31.9532 177.3885 123 F 4.9393 7.8954 117.1175 56.8180 39.2957 175.3966 124 K 4.2480 7.5412 121.0181 56.6150 32.6168 176.2970 125 C 4.4826 8.6580 120.4359 57.2253 41.3513 173.7166 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 K 8.17 4.25 0.00 1.95 1.82 0.00 1.65 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.43 1.50 7.81 2 I 8.24 4.73 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.42 1.06 0.00 0.00 3 L 9.26 4.38 0.00 1.49 1.50 0.90 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 4 K 9.25 4.22 0.00 1.73 1.67 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.80 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.52 7.81 5 K 8.63 3.38 0.00 1.67 1.74 0.00 1.82 0.00 0.00 1.82 0.00 0.00 2.86 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.48 7.81 6 Q 7.90 3.96 0.00 2.17 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.69 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 7 E 8.00 3.93 0.00 1.98 1.93 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 2.36 2.31 0.00 8 L 7.68 3.84 0.00 1.57 1.62 0.84 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 9 C 8.34 4.26 0.00 3.13 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 K 8.08 3.89 0.00 1.76 1.82 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.45 7.81 11 N 8.15 4.23 0.00 2.91 2.76 0.00 0.00 7.03 6.13 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 12 L 7.73 3.69 0.00 1.77 1.61 0.44 0.61 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 13 V 7.61 3.52 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 0.99 0.00 0.00 0.95 0.00 0.00 14 A 8.13 4.03 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 15 Q 7.78 4.35 0.00 1.88 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.69 0.00 0.00 0.00 0.00 0.00 2.41 2.35 0.00 16 G 7.82 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 M 8.20 4.03 0.00 1.62 1.85 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.81 0.00 18 N 8.10 4.55 0.00 2.75 2.78 0.00 0.00 7.04 7.98 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 19 G 9.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 8.04 4.00 0.00 3.32 3.27 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 21 Q 8.60 3.53 0.00 1.65 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.62 0.00 0.00 0.00 0.00 0.00 2.02 2.19 0.00 22 H 8.12 3.90 0.00 3.28 3.35 0.00 5.74 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 I 7.38 4.08 1.83 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.86 -0.14 0.00 0.00 24 T 8.13 4.48 4.30 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 1.24 0.00 0.00 25 L 8.84 4.21 0.00 1.80 1.88 0.96 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 26 P 0.00 4.91 0.00 2.26 2.27 0.00 3.88 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.14 0.00 27 N 8.12 4.49 0.00 2.80 2.74 0.00 0.00 6.96 9.03 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 28 W 7.98 4.08 0.00 3.53 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 29 V 8.48 3.75 2.38 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 1.34 0.00 0.00 1.06 0.00 0.00 30 C 8.23 2.94 0.00 2.56 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 31 T 7.85 3.87 4.31 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 0.83 0.00 0.00 32 A 8.07 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.50 3.33 0.00 2.93 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 7.98 4.05 0.00 3.26 3.32 0.00 5.90 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.18 4.25 0.00 2.03 2.10 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 2.64 2.59 0.00 36 S 7.58 4.49 0.00 3.97 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 37 S 8.24 2.81 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 38 Y 7.76 3.81 0.00 3.26 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.99 4.93 0.00 2.81 2.77 0.00 0.00 6.99 6.91 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 40 T 9.18 4.15 4.41 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 1.24 0.00 0.00 41 R 8.18 4.68 0.00 1.88 2.01 0.00 3.19 0.00 0.00 3.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.67 0.00 42 A 8.10 4.37 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 43 T 8.21 5.53 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 1.19 0.00 0.00 44 N 8.20 4.86 0.00 2.90 2.60 0.00 0.00 6.65 7.89 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 45 H 8.89 5.08 0.00 3.08 3.18 0.00 5.96 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 N 9.43 4.92 0.00 2.74 2.68 0.00 0.00 6.35 6.93 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 47 T 8.48 3.87 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 1.19 0.00 0.00 48 D 8.04 4.56 0.00 2.77 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 G 8.02 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 S 8.06 4.66 0.00 3.90 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 T 8.55 5.02 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 0.55 0.00 0.00 52 D 8.98 5.28 0.00 2.70 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 53 Y 9.09 4.94 0.00 3.07 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 54 G 9.10 4.41 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 0.00 55 I 8.41 4.16 1.93 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.71 0.93 0.00 0.00 56 L 7.98 4.59 0.00 1.75 1.90 0.75 0.66 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 57 Q 7.91 3.52 0.00 2.47 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.48 6.80 0.00 0.00 0.00 0.00 0.00 2.51 2.77 0.00 58 I 8.24 4.28 2.04 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.94 1.07 0.00 0.00 59 N 9.13 5.36 0.00 3.06 3.07 0.00 0.00 6.98 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 60 S 9.12 5.02 0.00 4.01 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 0.00 61 R 8.49 3.98 0.00 1.63 1.68 0.00 2.89 0.00 0.00 2.80 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.04 0.00 62 Y 7.67 4.10 0.00 1.77 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 0.00 0.00 0.00 63 W 8.32 4.85 0.00 3.54 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 64 C 8.27 5.62 0.00 3.17 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 65 H 9.10 5.34 0.00 3.23 3.19 0.00 5.73 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 D 8.79 4.56 0.00 2.74 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.22 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 0.00 0.00 0.00 68 K 8.27 4.58 0.00 1.84 1.82 0.00 1.59 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.42 7.81 69 T 7.77 4.55 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 1.15 0.00 0.00 70 P 0.00 4.26 0.00 2.14 2.03 0.00 3.83 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 2.08 1.94 0.00 71 G 8.77 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 72 S 8.14 4.23 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 73 K 8.63 4.20 0.00 1.62 1.72 0.00 1.90 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.33 1.28 7.81 74 N 8.09 4.21 0.00 2.89 2.74 0.00 0.00 7.13 8.62 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 75 A 7.93 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 C 8.86 4.53 0.00 3.31 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 77 N 8.09 4.15 0.00 2.89 2.88 0.00 0.00 6.84 7.94 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 78 I 8.13 4.59 1.90 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 1.18 1.39 0.96 0.00 0.00 79 S 8.50 4.62 0.00 3.88 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 80 C 8.92 4.07 0.00 2.16 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 S 7.84 3.84 0.00 4.01 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 82 K 7.87 4.21 0.00 1.84 2.05 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.45 1.61 7.81 83 L 7.91 4.81 0.00 1.83 1.86 1.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.95 5.34 0.00 1.68 1.71 1.11 1.02 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 85 D 7.77 4.80 0.00 2.76 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 86 D 8.50 4.57 0.00 2.69 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 D 7.73 4.77 0.00 2.63 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 88 I 8.04 4.63 1.81 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 1.60 1.84 0.90 0.00 0.00 89 T 8.09 3.76 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 1.16 0.00 0.00 90 D 7.98 4.36 0.00 2.93 2.91 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 91 D 8.05 4.34 0.00 2.93 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 L 8.25 3.76 0.00 1.70 1.43 0.71 0.32 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 93 K 7.78 3.86 0.00 1.83 1.81 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.57 7.81 94 C 8.44 4.37 0.00 3.00 3.21 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 95 A 8.10 4.06 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 96 K 7.90 3.74 0.00 1.78 1.54 0.00 1.36 0.00 0.00 1.19 0.00 0.00 2.47 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.30 0.87 7.81 97 K 7.94 4.00 0.00 1.84 1.81 0.00 2.14 0.00 0.00 2.03 0.00 0.00 3.09 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.53 1.73 7.81 98 I 7.32 2.94 1.77 0.00 0.00 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 -0.30 -0.36 0.03 0.00 0.00 99 A 7.93 4.53 1.79 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 0.00 100 G 8.69 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 0.00 101 E 8.28 4.06 0.00 2.11 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 0.00 2.45 2.63 0.00 102 A 8.01 4.13 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 0.00 103 K 8.03 3.63 0.00 1.87 1.82 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.35 7.81 104 G 6.76 3.82 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 0.00 0.00 0.00 105 L 7.02 4.56 0.00 0.27 0.81 -0.15 -0.69 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 0.00 106 T 7.62 4.11 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 107 P 0.00 4.08 0.00 0.98 1.74 0.00 3.75 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.95 0.00 108 W 8.16 4.51 0.00 3.72 3.30 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 0.00 109 V 8.60 3.76 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 0.91 0.00 0.00 0.98 0.00 0.00 110 A 8.48 4.06 1.53 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 0.00 111 W 8.29 4.02 0.00 3.35 3.49 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 0.00 0.00 0.00 0.00 112 K 8.54 3.63 0.00 2.05 1.94 0.00 2.29 0.00 0.00 1.91 0.00 0.00 3.17 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.72 2.09 7.81 113 S 8.05 4.27 0.00 4.02 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 0.00 114 K 8.22 4.24 0.00 1.49 1.33 0.00 1.60 0.00 0.00 1.55 0.00 0.00 2.86 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.24 1.46 7.81 115 C 7.40 4.65 0.00 2.34 2.84 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 0.00 116 R 7.24 3.36 0.00 0.67 1.35 0.00 3.38 0.00 0.00 3.13 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.28 0.00 117 G 8.59 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 H 7.50 4.76 0.00 3.12 3.26 0.00 5.86 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 D 8.49 4.51 0.00 2.63 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 0.00 120 L 8.42 5.08 0.00 1.82 1.81 1.09 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 121 S 8.43 4.18 0.00 4.00 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 0.00 122 K 7.77 3.91 0.00 1.01 0.96 0.00 1.37 0.00 0.00 1.41 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.20 1.21 7.81 123 F 7.90 4.94 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 0.00 124 K 7.54 4.25 0.00 1.82 1.84 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.44 7.81 125 C 8.66 4.48 0.00 3.03 2.98 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