NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.2073 8.2431 119.7063 55.7542 31.4270 174.9655 2 G 3.5211 8.3564 107.5773 44.2503 0.0000 172.0050 3 S 4.3034 9.0139 121.9178 58.0452 64.9190 173.1879 4 H 4.6476 8.5295 119.9198 54.8730 28.0417 173.9051 5 H 4.8053 8.1462 117.7950 55.3439 28.8991 177.1237 6 H 4.2216 8.0138 119.4662 59.6961 28.9076 176.9140 7 H 4.1912 8.3702 118.4569 59.2238 30.1167 176.4897 8 H 4.1200 8.6493 119.1632 59.4563 29.7861 175.7449 9 H 4.1160 7.6885 115.1004 57.9611 29.7187 175.5569 10 G 4.0400 7.4823 102.3384 44.3596 0.0000 175.6950 11 S 4.8278 8.4866 118.8810 56.4697 65.7415 172.5631 12 A 4.7770 8.0675 122.1735 50.6665 22.1212 175.6883 13 V 4.3934 8.3200 119.1866 61.0631 34.6936 174.6475 14 Q 4.5496 8.5692 126.3933 54.1010 30.9366 174.7307 15 V 5.3572 8.3495 123.4542 60.0956 34.6889 174.6121 16 T 4.5963 7.7839 115.5106 59.9750 72.6455 172.2186 17 F 5.2826 8.9405 122.1053 56.0786 41.4805 174.4513 18 T 4.9744 9.1725 120.0855 61.5837 71.2838 173.6154 19 V 3.8004 8.3078 126.8580 62.9346 32.8169 174.6465 20 Q 4.8836 8.5527 127.6124 53.6240 32.4074 174.5880 21 K 4.0301 8.8324 122.5669 58.3228 32.0524 175.7668 22 G 3.4497 8.9928 117.6110 44.8354 0.0000 172.9977 23 S 4.1928 7.2659 116.3312 58.6268 62.8243 172.6785 24 D 5.0418 9.1894 126.6431 51.8058 45.1568 173.9175 25 P 4.4863 0.0000 0.0000 65.1444 31.6925 177.8189 26 K 4.7356 8.0748 115.3815 55.6896 33.3429 175.0435 27 K 5.0696 7.5462 118.6065 54.6247 36.7080 174.7810 28 L 4.9145 8.9680 126.1373 53.0830 45.6900 175.0448 29 V 4.7946 8.2726 124.8763 61.1174 34.4999 174.0016 30 L 5.2008 8.8002 126.7124 53.1331 46.5400 174.9195 31 D 4.9828 10.2704 123.0972 53.8041 42.7531 174.9752 32 I 4.9055 8.5738 125.3816 59.4155 40.3865 174.7438 33 K 4.5838 8.6027 126.2014 54.7725 34.3800 174.5327 34 Y 4.9440 8.7906 126.3165 56.1456 41.1949 174.5832 35 T 4.4979 8.4183 124.4977 61.6606 71.4299 173.4208 36 R 4.7002 8.1908 126.3721 53.4603 33.8494 172.3099 37 P 4.3233 0.0000 0.0000 64.6902 30.7838 176.5486 38 G 3.9691 9.3296 112.4006 45.3105 0.0000 170.8657 39 D 5.0187 7.7201 118.0633 53.0814 44.9386 173.8883 40 S 4.9237 8.1062 113.8992 57.2834 67.6632 173.7151 41 L 3.7372 8.9458 124.0002 55.3930 41.8646 175.8048 42 A 4.7437 9.7363 127.8647 53.0954 21.2602 176.3915 43 E 4.8241 7.7090 112.3871 54.8795 34.4662 174.8975 44 V 4.3396 7.6721 120.5329 61.1024 35.1237 173.7233 45 E 4.9920 9.2120 125.9727 54.4506 33.7787 174.3588 46 L 4.9209 9.7319 125.3692 53.1793 45.2405 174.9015 47 R 4.3755 7.6291 126.5587 54.0991 32.5063 175.2271 48 Q 4.6143 8.2390 124.5411 55.6423 30.2722 175.2691 49 H 4.1621 8.5913 121.7703 57.2907 30.3277 176.1479 50 G 3.6778 8.1304 112.0541 45.7080 0.0000 173.1826 51 S 4.7243 7.4166 112.9129 56.5183 64.6251 173.2729 52 E 4.4873 8.6026 123.0239 55.7794 29.9650 175.5781 53 E 4.5460 7.4856 120.2396 53.7542 30.1695 175.5347 54 W 4.0702 8.8867 126.8053 56.6856 29.9426 175.2930 55 E 4.8495 9.5521 126.6252 53.5565 31.4122 173.3809 56 P 4.7047 0.0000 0.0000 62.9920 32.2900 175.4419 57 L 5.0248 8.2474 121.9007 53.7507 44.2967 175.9205 58 T 4.4718 8.6804 119.1741 61.8763 70.3720 174.0128 59 K 2.9692 8.2732 128.2399 55.9996 32.8200 176.4958 60 K 4.1906 8.7554 129.5012 54.9327 33.7594 178.2183 61 G 3.9626 9.0772 116.8774 46.1278 0.0000 172.6451 62 N 4.9360 9.0471 111.6215 52.4579 41.2058 173.8342 63 V 4.7897 7.8803 112.0695 59.4961 35.9350 173.9552 64 W 5.2068 9.0322 119.5345 55.1082 32.4495 174.8438 65 E 5.3770 9.0887 123.5635 54.4364 33.0326 174.7247 66 V 4.8005 8.7793 124.1481 59.9486 34.9926 174.1875 67 K 4.9533 8.7940 122.8425 54.6347 34.7375 175.2464 68 S 4.8496 8.7108 118.5929 56.6068 65.1933 174.0382 69 S 4.4517 8.7235 117.4330 59.1059 63.0855 173.7043 70 K 4.7420 7.6934 119.0951 53.2919 35.8434 173.8095 71 P 5.1542 0.0000 0.0000 62.3238 31.7637 176.2898 72 L 4.3503 8.4307 121.5032 54.7221 42.5624 176.3581 73 V 4.3342 8.6146 121.8415 61.1312 34.2911 175.2638 74 G 3.3457 7.8008 115.6880 43.5389 0.0000 171.3621 75 P 4.4045 0.0000 0.0000 62.6323 32.3302 176.1036 76 F 4.5884 9.0603 120.7146 56.7508 41.1402 174.4148 77 N 5.3088 8.1885 118.4807 51.5781 41.6067 173.8795 78 F 5.7743 9.5090 120.2099 56.0837 43.4067 173.6143 79 R 5.1704 9.8859 124.1273 54.6708 32.4645 174.5435 80 F 5.0415 10.5368 123.7166 55.8094 42.4906 173.7983 81 M 5.1797 8.7766 122.3371 53.7397 34.9672 174.7608 82 S 4.3739 10.4700 121.1363 58.1772 64.3017 175.0208 83 K 3.9262 9.8371 123.7393 59.9406 32.0170 178.5924 84 G 3.7443 7.7498 105.0823 46.3376 0.0000 173.6985 85 G 3.8985 9.2545 109.0292 45.6693 0.0000 173.1585 86 M 4.6213 8.2974 119.0810 53.7843 34.1018 175.5070 87 R 5.0667 8.4483 119.9343 54.5878 33.0770 174.7439 88 N 4.9451 10.6121 118.9433 51.4316 43.1249 173.4715 89 V 4.0857 7.8804 121.5676 60.9296 34.6239 174.4816 90 F 4.9982 9.3451 125.7388 55.9667 41.9232 173.9161 91 D 5.3102 9.1230 123.3756 52.9982 42.8053 176.0696 92 E 3.7694 8.2834 118.8357 57.6588 27.5791 176.0686 93 V 3.9186 7.9710 118.1917 64.6818 32.6124 176.0582 94 I 4.5144 7.6450 120.2963 58.4220 40.0767 173.2617 95 P 4.6282 0.0000 0.0000 62.3530 32.1881 176.4075 96 T 3.7124 8.4434 115.9014 66.5227 68.3046 174.6156 97 A 4.2489 7.8160 125.7657 50.8236 17.9121 175.8866 98 F 4.8373 7.6388 115.9854 55.8874 40.2517 175.7582 99 S 4.8538 8.5509 118.3261 56.9889 65.0569 173.7968 100 I 4.3231 8.2511 123.2753 61.8491 37.9746 176.5942 101 G 4.0051 8.5753 113.6754 44.7388 0.0000 172.8046 102 K 4.5818 7.6944 120.5774 54.6283 35.1739 175.7314 103 T 4.5429 8.1573 122.7556 63.8301 70.3225 174.3730 104 Y 4.5422 9.3770 120.9686 57.6939 41.0515 174.7561 105 K 5.0417 8.5805 123.9357 54.0724 34.3437 174.9145 106 P 4.5468 0.0000 0.0000 63.0330 31.9189 176.1083 107 E 4.5198 8.7772 122.4683 54.9609 31.0593 176.2318 108 E 4.2215 8.6803 118.6837 57.0214 29.4752 177.2874 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 R 8.24 4.21 0.00 1.82 1.99 0.00 3.19 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 2 G 8.36 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 0.00 0.00 0.00 3 S 9.01 4.30 0.00 4.01 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 4 H 8.53 4.65 0.00 3.16 3.41 0.00 5.88 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 H 8.15 4.81 0.00 3.30 3.49 0.00 5.48 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 H 8.01 4.22 0.00 3.25 3.41 0.00 5.62 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 H 8.37 4.19 0.00 3.25 3.38 0.00 5.88 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 H 8.65 4.12 0.00 3.13 3.51 0.00 5.83 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 H 7.69 4.12 0.00 3.38 3.40 0.00 5.87 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 G 7.48 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 11 S 8.49 4.83 0.00 3.83 3.75 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 12 A 8.07 4.78 1.14 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 0.00 0.00 0.00 0.00 0.00 0.00 13 V 8.32 4.39 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 0.49 0.00 0.00 0.97 0.00 0.00 14 Q 8.57 4.55 0.00 1.86 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.47 0.00 0.00 0.00 0.00 0.00 2.19 2.17 0.00 15 V 8.35 5.36 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 -0.19 0.00 0.00 0.79 0.00 0.00 16 T 7.78 4.60 4.15 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 1.09 0.00 0.00 17 F 8.94 5.28 0.00 3.25 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 18 T 9.17 4.97 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 1.30 0.00 0.00 19 V 8.31 3.80 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 1.10 0.00 0.00 1.06 0.00 0.00 20 Q 8.55 4.88 0.00 2.27 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.70 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 21 K 8.83 4.03 0.00 1.81 1.82 0.00 1.82 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.50 7.81 22 G 8.99 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 23 S 7.27 4.19 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 24 D 9.19 5.04 0.00 2.67 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 25 P 0.00 4.49 0.00 2.25 2.35 0.00 3.68 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 2.10 2.02 0.00 26 K 8.07 4.74 0.00 1.81 2.00 0.00 1.63 0.00 0.00 1.83 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.43 7.81 27 K 7.55 5.07 0.00 1.89 1.63 0.00 1.61 0.00 0.00 1.75 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.43 7.81 28 L 8.97 4.91 0.00 1.44 1.25 0.21 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 29 V 8.27 4.79 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 0.98 0.00 0.00 1.02 0.00 0.00 30 L 8.80 5.20 0.00 1.67 1.61 0.80 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 31 D 10.27 4.98 0.00 2.86 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 32 I 8.57 4.91 2.14 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 1.19 1.00 0.92 0.00 0.00 33 K 8.60 4.58 0.00 1.61 1.67 0.00 1.55 0.00 0.00 1.55 0.00 0.00 2.79 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.31 7.81 34 Y 8.79 4.94 0.00 3.09 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 35 T 8.42 4.50 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 1.12 0.00 0.00 36 R 8.19 4.70 0.00 1.63 1.83 0.00 3.45 0.00 0.00 3.50 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.53 0.00 37 P 0.00 4.32 0.00 2.22 2.07 0.00 3.81 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 38 G 9.33 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 0.00 0.00 0.00 39 D 7.72 5.02 0.00 2.73 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 40 S 8.11 4.92 0.00 3.83 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 41 L 8.95 3.74 0.00 1.58 1.60 0.41 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 42 A 9.74 4.74 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 43 E 7.71 4.82 0.00 1.79 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 2.34 2.30 0.00 44 V 7.67 4.34 0.67 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 0.16 0.00 0.00 -1.16 0.00 0.00 45 E 9.21 4.99 0.00 1.93 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 0.00 2.27 2.18 0.00 46 L 9.73 4.92 0.00 1.74 1.45 -0.73 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 47 R 7.63 4.38 0.00 0.67 0.66 0.00 3.00 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.95 0.00 48 Q 8.24 4.61 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.85 0.00 0.00 0.00 0.00 0.00 2.42 2.27 0.00 49 H 8.59 4.16 0.00 2.88 3.05 0.00 6.05 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 G 8.13 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 51 S 7.42 4.72 0.00 3.73 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 52 E 8.60 4.49 0.00 1.95 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 2.17 2.20 0.00 53 E 7.49 4.55 0.00 1.89 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 2.24 2.27 0.00 54 W 8.89 4.07 0.00 3.19 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 55 E 9.55 4.85 0.00 2.00 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 2.23 2.23 0.00 56 P 0.00 4.70 0.00 2.19 2.10 0.00 3.84 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 2.04 2.04 0.00 57 L 8.25 5.02 0.00 1.81 2.06 1.17 1.06 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 58 T 8.68 4.47 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 1.15 0.00 0.00 59 K 8.27 2.97 0.00 0.79 1.19 0.00 1.16 0.00 0.00 1.40 0.00 0.00 2.75 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.80 0.21 7.81 60 K 8.76 4.19 0.00 1.69 1.64 0.00 1.91 0.00 0.00 1.60 0.00 0.00 2.85 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.25 1.36 7.81 61 G 9.08 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 0.00 0.00 0.00 62 N 9.05 4.94 0.00 2.62 2.76 0.00 0.00 6.61 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 63 V 7.88 4.79 2.31 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 0.82 0.00 0.00 0.93 0.00 0.00 64 W 9.03 5.21 0.00 3.29 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 65 E 9.09 5.38 0.00 2.05 1.74 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 2.20 2.38 0.00 66 V 8.78 4.80 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 0.64 0.00 0.00 0.92 0.00 0.00 67 K 8.79 4.95 0.00 1.62 1.72 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.32 1.39 7.81 68 S 8.71 4.85 0.00 3.83 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 69 S 8.72 4.45 0.00 3.90 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 70 K 7.69 4.74 0.00 1.70 1.70 0.00 1.71 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.34 7.81 71 P 0.00 5.15 0.00 2.22 2.08 0.00 3.38 0.00 0.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 72 L 8.43 4.35 0.00 1.86 1.84 0.88 0.68 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 73 V 8.61 4.33 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 0.91 0.00 0.00 0.99 0.00 0.00 74 G 7.80 3.35 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 0.00 75 P 0.00 4.40 0.00 1.98 1.94 0.00 3.11 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.85 0.00 76 F 9.06 4.59 0.00 3.13 2.50 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 77 N 8.19 5.31 0.00 1.67 2.69 0.00 0.00 6.64 7.58 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 78 F 9.51 5.77 0.00 3.22 3.43 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 79 R 9.89 5.17 0.00 0.80 1.32 0.00 2.73 0.00 0.00 2.54 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.33 0.00 80 F 10.54 5.04 0.00 3.28 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 81 M 8.78 5.18 0.00 2.00 1.78 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.40 0.00 82 S 10.47 4.37 0.00 4.17 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 83 K 9.84 3.93 0.00 1.52 1.98 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.23 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.53 1.68 7.81 84 G 7.75 3.74 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 0.00 0.00 0.00 85 G 9.25 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 86 M 8.30 4.62 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.68 0.00 87 R 8.45 5.07 0.00 1.58 1.69 0.00 3.04 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.57 0.00 88 N 10.61 4.95 0.00 2.80 2.31 0.00 0.00 6.22 7.59 0.00 0.00 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 7.88 4.09 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 0.78 0.00 0.00 0.70 0.00 0.00 90 F 9.35 5.00 0.00 3.19 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 91 D 9.12 5.31 0.00 2.64 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 92 E 8.28 3.77 0.00 2.10 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 2.25 2.26 0.00 93 V 7.97 3.92 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 0.54 0.00 0.00 1.20 0.00 0.00 94 I 7.65 4.51 2.18 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.21 0.73 0.00 0.00 95 P 0.00 4.63 0.00 2.16 2.04 0.00 3.44 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.03 0.00 96 T 8.44 3.71 4.18 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 1.21 0.00 0.00 97 A 7.82 4.25 1.21 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 98 F 7.64 4.84 0.00 3.01 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 99 S 8.55 4.85 0.00 4.04 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 0.00 100 I 8.25 4.32 1.95 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.89 0.99 0.00 0.00 101 G 8.58 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 0.00 0.00 0.00 102 K 7.69 4.58 0.00 1.82 1.56 0.00 1.69 0.00 0.00 1.49 0.00 0.00 2.66 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.96 1.28 7.81 103 T 8.16 4.54 4.11 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 1.18 0.00 0.00 104 Y 9.38 4.54 0.00 3.11 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 0.00 105 K 8.58 5.04 0.00 1.64 1.71 0.00 1.63 0.00 0.00 1.75 0.00 0.00 2.81 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.34 1.44 7.81 106 P 0.00 4.55 0.00 2.32 2.09 0.00 3.75 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 1.79 1.06 0.00 107 E 8.78 4.52 0.00 2.05 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 2.34 2.40 0.00 108 E 8.68 4.22 0.00 2.00 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 2.37 2.29 0.00