NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.3015 8.3144 122.1421 53.6571 33.5094 174.8042 2 E 3.8881 8.5868 117.9558 55.9777 30.0040 175.7415 3 T 4.0521 8.8025 118.2457 61.6081 71.7206 174.5838 4 A 4.0259 8.6796 124.3888 55.6409 18.4429 180.1485 5 A 3.9544 7.9677 118.3913 55.1796 18.5467 179.6000 6 A 4.0487 8.2296 119.4246 54.8772 18.3521 179.7745 7 K 3.9997 8.5510 118.7867 59.6239 32.3337 178.6383 8 F 4.0770 8.4722 120.9962 61.4793 39.3995 176.8433 9 E 4.0421 8.2723 117.5656 59.5476 29.0799 179.4115 10 R 3.9038 7.9565 117.4542 59.6129 30.2350 178.2867 11 Q 3.9324 8.0396 116.9543 58.2433 28.9751 176.5020 12 H 4.5891 7.7957 114.4830 54.2948 31.9736 173.6503 13 M 4.6714 7.8290 117.9067 53.7850 33.5885 176.4382 14 D 4.8316 9.1413 123.2487 52.7956 41.1782 175.7980 15 S 4.5036 8.4888 115.8258 59.2179 63.7058 175.3418 16 S 4.4857 7.8434 114.1446 59.0748 63.5039 174.3131 17 T 4.6820 7.5444 110.4631 59.7991 71.1940 173.9565 18 S 4.1957 8.6450 117.5062 60.4121 62.9239 173.5929 19 A 3.8811 6.9177 118.8729 50.8491 21.2843 175.5264 20 A 3.3310 8.1098 125.8904 52.8105 18.8417 178.8211 21 S 4.5626 8.4334 117.9687 58.8082 63.7197 172.1654 22 S 4.7444 7.4994 111.3787 57.4192 65.2446 175.4694 23 S 4.2582 8.6154 115.8499 61.2422 63.0124 176.0049 24 N 4.4889 8.0835 118.6809 55.3375 37.9846 176.0643 25 Y 4.0250 7.7768 121.5854 61.2595 38.7669 177.7861 26 C 4.1836 8.3085 116.4956 60.0824 37.5425 175.7625 27 N 4.4177 8.2580 117.5377 56.6020 38.1566 177.3689 28 Q 3.9158 7.9739 119.1346 59.2197 29.0183 178.5817 29 M 3.7071 7.8316 120.0490 58.2699 31.8219 178.7156 30 M 4.0934 8.3802 121.7653 58.8088 32.0722 179.7060 31 K 3.9874 7.7003 123.7716 59.9066 31.8114 181.3930 32 S 4.3972 7.8656 114.3487 60.6509 63.0705 175.7401 33 R 4.2183 7.6058 118.9225 55.7127 30.0481 176.3406 34 N 4.3854 7.8378 115.1390 54.2015 36.5363 175.2567 35 L 4.2358 7.9632 118.8896 56.3417 41.9224 178.3017 36 T 5.0217 7.7762 109.0864 60.9979 69.2898 175.6527 37 K 4.3084 8.2277 125.1306 57.1427 32.1018 181.4828 38 D 4.8539 7.8770 117.0223 55.0255 42.4811 176.0849 39 R 4.0019 7.2578 112.9266 55.1002 31.6161 174.5254 40 C 4.7927 8.7645 116.7569 56.0899 39.9931 173.9184 41 K 4.2209 8.1960 127.2656 55.9661 32.3476 175.0047 42 P 4.6973 0.0000 0.0000 64.8355 32.9337 176.1076 43 V 5.0269 7.6179 118.4391 61.1326 34.7546 174.3833 44 N 4.7154 9.0489 124.4082 52.8274 42.6922 172.8368 45 T 4.7610 7.9235 122.1234 61.7966 71.2045 173.1829 46 F 4.8378 8.7574 124.8026 56.0526 41.3543 174.8628 47 V 4.5772 9.1090 123.4339 60.9019 33.5676 175.8024 48 H 5.5005 8.6679 128.8811 54.2334 26.3269 173.9240 49 E 4.8257 7.7129 116.9152 53.3603 34.2274 176.9850 50 S 4.3549 8.3755 115.5082 58.1106 65.0701 175.0083 51 L 3.9837 8.5406 125.0139 58.5261 41.9348 179.0088 52 A 4.0222 8.1415 120.0829 55.6803 17.9680 179.2394 53 D 4.3455 7.8092 115.8718 57.1697 41.1256 178.7301 54 V 3.8741 7.6139 118.8294 65.7409 31.8069 177.9754 55 Q 3.8652 8.5011 117.9896 58.9755 28.5103 178.7556 56 A 3.9798 8.0388 121.7221 55.2090 18.2934 179.7300 57 V 3.4808 7.6060 116.6388 66.1635 31.2850 177.1521 58 C 3.6200 7.6519 114.4651 57.9792 39.8516 174.2201 59 S 4.7010 7.4077 114.2280 57.8313 63.6553 174.7294 60 Q 4.3553 7.5558 120.2871 55.5898 28.7979 176.6209 61 K 4.0941 7.4942 126.2462 57.4567 33.0502 176.3734 62 N 4.4004 8.7378 127.6255 53.6261 39.3434 174.3936 63 V 4.5870 8.4062 118.4651 59.0954 36.7427 174.8676 64 A 4.2436 8.4379 125.5214 52.0187 19.0032 178.6447 65 C 4.4677 8.8811 122.8326 57.5043 41.0570 176.0724 66 K 3.8649 8.9392 123.9920 57.8247 31.2523 179.0829 67 N 4.5988 8.0213 113.6787 53.1421 37.5364 175.6016 68 G 3.9938 8.2152 108.5850 45.5521 0.0000 174.5019 69 Q 4.1117 8.0593 118.9476 56.6830 29.1617 176.9118 70 T 4.6680 8.3361 109.7956 61.6252 69.2617 173.5820 71 N 4.9539 7.9855 118.3594 54.0811 38.6104 175.0147 72 C 5.3665 7.4473 115.9563 56.8915 44.3366 172.6155 73 Y 5.1205 8.7078 118.0221 56.5902 42.4234 173.7548 74 Q 5.0814 9.1251 125.7619 54.0060 31.2973 174.9228 75 S 4.3787 8.6224 121.7751 58.7026 63.2068 174.2646 76 Y 4.5475 8.8895 121.3033 61.0155 37.9089 177.0345 77 S 4.7700 7.8900 114.0180 57.1866 64.4867 173.9749 78 T 4.2041 8.1193 113.0726 62.1366 69.7536 173.3638 79 M 5.0581 8.8949 122.0532 53.3753 36.5459 174.8764 80 S 4.8017 9.1426 117.0937 58.2410 63.5419 173.0564 81 I 5.1907 8.8228 120.4049 59.3949 41.5371 174.4449 82 T 4.9549 8.7919 119.9664 61.9580 71.3725 172.5621 83 D 4.9579 9.2314 127.7972 53.3175 43.0847 174.2569 84 C 5.7461 9.1460 123.8014 55.1659 41.6900 173.1010 85 R 5.3881 8.8774 120.4208 53.9737 32.2214 174.7025 86 E 4.1613 9.2709 124.6554 56.5879 30.5151 176.2149 87 T 4.4836 8.3202 116.1391 59.9697 71.0270 176.0519 88 G 3.7023 8.7800 111.2960 48.0986 0.0000 174.5109 89 S 4.3497 7.4163 111.5036 58.3575 63.5580 174.2467 90 S 4.0138 7.6889 117.4482 58.3342 62.3399 173.4098 91 K 4.4171 8.6907 128.9442 54.7201 34.7136 174.4785 92 Y 4.1974 8.8835 127.3019 58.0651 38.8090 174.0501 93 P 3.1752 0.0000 0.0000 62.6213 32.4054 176.6148 94 N 4.6562 7.7211 119.6628 52.1607 37.0339 173.4008 95 C 4.6063 7.8979 117.1197 56.6648 42.6750 173.2666 96 A 5.0784 8.5301 124.3457 50.4813 22.3106 174.6256 97 Y 5.1547 9.1371 117.9353 56.0298 42.0990 174.9674 98 K 4.4624 9.1802 124.5659 55.8686 34.1272 175.3601 99 T 4.8258 8.5447 123.8917 62.7068 69.9293 174.1994 100 T 4.5657 8.7244 123.2996 61.6765 71.8463 172.9061 101 Q 4.7839 8.7739 128.1928 55.4115 30.2205 174.4664 102 A 4.6901 8.8679 126.6057 51.0147 23.7689 174.4454 103 N 5.8153 8.5953 116.0442 51.0366 40.2636 174.6568 104 K 4.7778 8.3092 122.1230 54.6474 37.3437 175.8426 105 H 4.8236 9.0076 119.7279 55.8980 30.1286 174.5806 106 I 4.9322 8.5837 114.7417 59.2982 40.8117 174.4569 107 I 4.8684 8.0410 124.3738 59.7650 39.8695 175.0638 108 V 4.6930 8.6350 119.7643 59.3191 35.7172 174.4707 109 A 5.0962 8.6566 124.3890 50.8074 21.0719 175.5604 110 C 5.1905 8.6929 118.2328 55.3739 37.6832 173.3239 111 E 4.8178 8.6895 119.4333 56.0964 34.0350 174.1986 112 G 4.0539 9.2378 106.6464 44.7169 0.0000 172.2538 113 N 4.9192 8.2590 115.3066 50.5637 40.0664 173.1376 114 P 4.3711 0.0000 0.0000 62.4386 32.1253 175.8160 115 Y 4.8146 8.2266 121.4649 56.1687 39.0900 174.7853 116 V 4.4179 7.9995 119.1067 58.3364 36.3445 173.5679 117 P 4.4314 0.0000 0.0000 62.8760 31.1995 176.9080 118 V 4.4687 8.4540 115.8425 61.3106 33.5877 175.2070 119 H 4.9800 7.8332 119.8868 54.9218 33.4483 171.9076 120 F 4.2878 8.8336 128.3374 57.9317 39.1540 174.1010 121 D 4.5889 8.2666 126.7776 55.1453 41.9405 176.3375 122 A 4.6608 6.5239 117.5516 51.4721 22.0952 174.7641 123 S 5.2513 9.0360 114.5747 56.7078 65.8077 174.5461 124 V 4.1601 8.5321 114.8863 61.6887 32.5386 175.3773 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 8.31 4.30 0.00 1.79 1.69 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.01 7.81 2 E 8.59 3.89 0.00 2.01 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 3 T 8.80 4.05 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 4 A 8.68 4.03 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 A 7.97 3.95 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 6 A 8.23 4.05 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 7 K 8.55 4.00 0.00 1.92 2.03 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.60 1.46 7.81 8 F 8.47 4.08 0.00 3.22 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 9 E 8.27 4.04 0.00 2.27 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 2.49 2.66 0.00 10 R 7.96 3.90 0.00 1.80 2.08 0.00 3.37 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 11 Q 8.04 3.93 0.00 1.59 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.53 0.00 0.00 0.00 0.00 0.00 2.25 2.47 0.00 12 H 7.80 4.59 0.00 2.03 2.69 0.00 5.61 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.83 4.67 0.00 2.00 2.17 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 2.70 2.73 0.00 14 D 9.14 4.83 0.00 2.75 2.46 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 0.00 0.00 0.00 0.00 15 S 8.49 4.50 0.00 3.94 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 16 S 7.84 4.49 0.00 4.00 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 17 T 7.54 4.68 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 1.32 0.00 0.00 18 S 8.64 4.20 0.00 3.84 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 19 A 6.92 3.88 1.09 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 0.00 0.00 20 A 8.11 3.33 0.69 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 0.00 0.00 21 S 8.43 4.56 0.00 3.64 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 22 S 7.50 4.74 0.00 3.96 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 S 8.62 4.26 0.00 4.03 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 24 N 8.08 4.49 0.00 2.72 2.91 0.00 0.00 6.43 7.93 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 25 Y 7.78 4.02 0.00 3.13 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 26 C 8.31 4.18 0.00 3.19 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 27 N 8.26 4.42 0.00 3.01 2.92 0.00 0.00 7.11 7.48 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 28 Q 7.97 3.92 0.00 2.03 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.82 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 29 M 7.83 3.71 0.00 0.75 1.16 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.64 0.00 30 M 8.38 4.09 0.00 1.67 1.89 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 2.53 0.00 31 K 7.70 3.99 0.00 1.75 1.81 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.31 7.81 32 S 7.87 4.40 0.00 3.96 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 33 R 7.61 4.22 0.00 1.98 2.15 0.00 3.58 0.00 0.00 3.21 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.92 0.00 34 N 7.84 4.39 0.00 2.91 2.96 0.00 0.00 6.97 7.30 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 35 L 7.96 4.24 0.00 1.77 1.64 0.79 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.78 5.02 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 37 K 8.23 4.31 0.00 1.80 1.76 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.03 7.81 38 D 7.88 4.85 0.00 2.62 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 39 R 7.26 4.00 0.00 1.84 1.81 0.00 2.94 0.00 0.00 3.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 40 C 8.76 4.79 0.00 3.12 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.20 4.22 0.00 2.06 1.76 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.23 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.39 7.81 42 P 0.00 4.70 0.00 2.21 2.33 0.00 3.74 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.99 0.00 43 V 7.62 5.03 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 0.82 0.00 0.00 0.98 0.00 0.00 44 N 9.05 4.72 0.00 2.57 2.29 0.00 0.00 6.85 6.78 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 45 T 7.92 4.76 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 0.84 0.00 0.00 46 F 8.76 4.84 0.00 3.04 2.90 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 47 V 9.11 4.58 2.16 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 1.15 0.00 0.00 1.05 0.00 0.00 48 H 8.67 5.50 0.00 3.14 3.45 0.00 5.61 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.71 4.83 0.00 1.95 1.84 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 2.26 2.27 0.00 50 S 8.38 4.35 0.00 4.07 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 51 L 8.54 3.98 0.00 1.83 1.75 1.04 1.26 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 52 A 8.14 4.02 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 53 D 7.81 4.35 0.00 2.80 2.78 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 54 V 7.61 3.87 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 1.22 0.00 0.00 1.10 0.00 0.00 55 Q 8.50 3.87 0.00 2.29 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.52 0.00 0.00 0.00 0.00 0.00 2.30 2.46 0.00 56 A 8.04 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.61 3.48 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 0.96 0.00 0.00 0.96 0.00 0.00 58 C 7.65 3.62 0.00 2.81 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 59 S 7.41 4.70 0.00 3.94 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 60 Q 7.56 4.36 0.00 1.80 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.01 0.00 0.00 0.00 0.00 0.00 2.14 2.25 0.00 61 K 7.49 4.09 0.00 1.96 1.67 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.47 7.81 62 N 8.74 4.40 0.00 2.76 2.64 0.00 0.00 7.00 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 63 V 8.41 4.59 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 0.67 0.00 0.00 0.83 0.00 0.00 64 A 8.44 4.24 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 C 8.88 4.47 0.00 3.09 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 66 K 8.94 3.86 0.00 1.76 1.73 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.39 1.26 7.81 67 N 8.02 4.60 0.00 2.81 2.94 0.00 0.00 6.30 7.00 0.00 0.00 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 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 69 Q 8.06 4.11 0.00 2.26 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 70 T 8.34 4.67 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 71 N 7.99 4.95 0.00 2.97 3.15 0.00 0.00 6.07 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 72 C 7.45 5.37 0.00 3.10 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 73 Y 8.71 5.12 0.00 2.79 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 74 Q 9.13 5.08 0.00 2.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.99 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 75 S 8.62 4.38 0.00 4.01 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 76 Y 8.89 4.55 0.00 3.04 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 77 S 7.89 4.77 0.00 3.91 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 78 T 8.12 4.20 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 0.95 0.00 0.00 79 M 8.89 5.06 0.00 1.97 2.01 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 2.54 2.48 0.00 80 S 9.14 4.80 0.00 3.92 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 81 I 8.82 5.19 1.88 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 1.39 0.72 1.01 0.00 0.00 82 T 8.79 4.95 4.42 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 1.30 0.00 0.00 83 D 9.23 4.96 0.00 2.70 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 84 C 9.15 5.75 0.00 2.99 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 85 R 8.88 5.39 0.00 1.93 2.06 0.00 2.82 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 86 E 9.27 4.16 0.00 2.09 1.83 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 2.10 1.85 0.00 87 T 8.32 4.48 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 1.21 0.00 0.00 88 G 8.78 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 S 7.42 4.35 0.00 4.01 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 S 7.69 4.01 0.00 3.86 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 91 K 8.69 4.42 0.00 1.80 1.57 0.00 1.73 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.36 1.39 7.81 92 Y 8.88 4.20 0.00 3.01 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 P 0.00 3.18 0.00 1.81 1.26 0.00 3.64 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.76 0.00 94 N 7.72 4.66 0.00 2.80 2.75 0.00 0.00 7.00 7.23 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 95 C 7.90 4.61 0.00 3.12 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 96 A 8.53 5.08 1.09 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 0.00 0.00 97 Y 9.14 5.15 0.00 2.83 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 98 K 9.18 4.46 0.00 1.85 1.73 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.46 7.81 99 T 8.54 4.83 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 1.28 0.00 0.00 100 T 8.72 4.57 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 1.23 0.00 0.00 101 Q 8.77 4.78 0.00 1.94 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.77 0.00 0.00 0.00 0.00 0.00 2.21 2.36 0.00 102 A 8.87 4.69 1.23 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 0.00 103 N 8.60 5.82 0.00 2.56 2.75 0.00 0.00 7.04 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 K 8.31 4.78 0.00 1.70 1.80 0.00 1.70 0.00 0.00 1.88 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.48 7.81 105 H 9.01 4.82 0.00 3.13 3.24 0.00 5.58 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.58 4.93 1.84 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 1.28 0.85 1.17 0.00 0.00 107 I 8.04 4.87 1.69 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 1.14 0.56 0.83 0.00 0.00 108 V 8.63 4.69 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 0.67 0.00 0.00 0.79 0.00 0.00 109 A 8.66 5.10 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 0.00 110 C 8.69 5.19 0.00 1.71 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 0.00 111 E 8.69 4.82 0.00 1.86 1.80 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 2.29 2.29 0.00 112 G 9.24 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 0.00 113 N 8.26 4.92 0.00 2.68 2.75 0.00 0.00 6.85 8.02 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 0.00 114 P 0.00 4.37 0.00 2.04 1.99 0.00 3.67 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 2.03 2.07 0.00 115 Y 8.23 4.81 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 0.00 116 V 8.00 4.42 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 0.64 0.00 0.00 0.90 0.00 0.00 117 P 0.00 4.43 0.00 0.49 1.04 0.00 3.29 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.74 0.00 118 V 8.45 4.47 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 0.64 0.00 0.00 0.92 0.00 0.00 119 H 7.83 4.98 0.00 3.30 3.14 0.00 5.85 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 0.00 120 F 8.83 4.29 0.00 2.59 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 0.00 121 D 8.27 4.59 0.00 2.53 2.55 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 0.00 122 A 6.52 4.66 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 S 9.04 5.25 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 0.00 124 V 8.53 4.16 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 0.76 0.00 0.00 0.94 0.00 0.00