NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.6088 8.4244 119.1669 52.3345 40.6461 173.8031 4 Q 4.5213 8.0523 118.1017 54.7212 31.4214 173.1613 5 Y 5.0755 9.7827 122.5779 56.4365 42.6119 173.2637 6 Y 5.3146 9.4930 121.2064 56.0173 42.9827 174.3544 7 G 3.8364 8.0649 112.2797 45.8268 0.0000 171.9856 8 T 3.8214 7.9230 116.1959 60.6272 67.9976 172.8354 9 G 4.1486 10.6613 112.8948 45.0546 0.0000 172.9492 10 R 5.2912 8.4753 116.8490 56.7085 31.7367 174.1869 11 R 4.4244 8.3136 114.3299 56.3986 32.3014 174.6782 12 K 3.9857 9.1944 118.7899 58.2893 29.1676 175.1565 13 S 3.6399 7.9910 104.5075 59.3568 62.0305 172.4512 14 S 5.3753 7.8869 115.8988 56.8230 63.8022 172.1884 15 A 4.5958 8.6108 129.8182 51.2032 19.6483 175.9115 16 A 5.0248 8.6491 123.7158 50.0989 22.8986 175.7458 17 R 4.4724 8.4256 117.7964 54.5152 33.8886 174.7419 18 V 4.4939 8.4589 124.3299 61.1717 34.7668 174.5661 19 F 6.2167 8.3363 123.3007 54.2313 40.7755 172.5420 20 I 4.1543 8.3438 123.0351 61.3761 38.3727 174.6665 21 K 5.0146 8.7618 128.5401 53.6579 35.7441 173.5982 22 P 4.4640 0.0000 0.0000 61.9280 32.3005 174.3966 23 G 3.5383 9.2125 114.3630 45.5764 0.0000 175.2402 24 N 3.7588 9.1380 123.4578 52.6113 39.3317 175.6839 25 G 4.9593 8.5076 98.3203 44.8891 0.0000 174.8503 26 K 4.4149 7.8559 118.9756 56.4701 34.3751 178.0045 27 I 4.4174 8.1915 122.8841 60.4751 40.7730 174.1473 28 V 4.5782 8.3123 128.2728 61.1472 33.7172 174.3938 29 I 4.3915 8.5002 129.8777 61.2685 38.5941 176.1469 30 N 3.8041 8.8676 122.1152 54.6101 36.4210 174.2220 31 Q 3.6696 8.0519 111.4841 56.8832 28.1659 172.2401 32 R 4.7098 8.0717 113.9590 53.3894 34.4729 174.7114 33 S 4.4269 8.2712 113.3809 57.9003 63.2747 174.5336 34 L 3.8828 8.3547 127.3051 58.6060 41.6952 179.3692 35 E 4.2959 8.1110 117.4637 58.5728 29.2890 178.1395 36 Q 4.4002 7.5987 115.9146 56.3720 28.6231 175.3969 37 Y 4.4963 7.6519 119.5783 58.7667 41.4040 175.8547 38 F 5.6699 7.9099 114.6553 55.7139 40.3653 175.0773 39 G 3.9046 8.3992 110.9669 47.2951 0.0000 173.4943 40 R 3.8904 8.8111 121.9012 57.0280 28.9521 175.2984 41 E 4.7562 7.8410 112.7793 54.0399 33.1127 176.8885 42 T 4.0011 8.5738 112.6334 63.3025 67.3408 174.6115 43 A 4.0818 8.2877 125.1993 54.3427 19.3791 180.4276 44 R 4.5005 8.0799 106.8476 57.6521 29.6129 176.9134 45 M 4.2958 8.3544 118.0098 57.8012 32.4607 178.8342 46 V 3.8372 7.6582 112.4688 63.3210 31.9901 178.6798 47 V 3.6253 7.8950 111.8171 64.4517 30.9034 177.4977 48 R 4.1768 7.8848 117.1805 57.7061 30.3700 178.4135 49 Q 4.0714 7.9323 118.5018 58.7921 28.4812 177.8273 50 P 4.1470 0.0000 0.0000 65.3581 31.4676 178.1921 51 L 4.1375 7.5626 118.5641 57.7157 41.7600 178.8245 52 E 4.1153 9.3303 116.7480 58.6486 29.5612 178.0518 53 L 4.3825 7.5988 119.0236 56.5834 42.6086 177.0305 54 V 4.4865 7.6378 112.7338 60.5379 32.6996 171.6626 55 D 4.6005 8.8705 125.0066 54.2842 41.0251 173.5995 56 M 4.4148 8.3737 119.8098 56.1970 34.8308 173.7712 57 V 3.7831 8.7713 121.6488 63.6635 31.4676 173.0198 58 E 4.7818 7.8914 114.4118 55.9783 29.9905 175.7414 59 K 4.5390 7.9370 117.7402 57.2015 34.4461 176.2553 60 L 4.9478 7.3152 116.8926 55.9957 43.4655 171.7484 61 D 5.6140 9.0360 118.2389 50.5229 41.9459 174.9829 62 L 5.8000 8.5443 120.4643 52.5874 45.5753 174.7134 63 Y 5.0481 8.6301 121.8437 56.3885 40.4872 174.2964 64 I 4.2762 8.2857 128.5587 60.9934 39.3815 175.9653 65 T 4.8960 8.9655 122.8999 61.8683 70.4414 172.8212 66 V 4.9025 7.5671 124.3219 59.9454 34.5355 175.2301 67 K 4.3654 9.7445 119.9786 57.2889 36.4436 171.4057 68 G 4.2955 8.9920 116.6313 46.2701 0.0000 171.3646 69 G 4.3214 9.1082 107.5127 43.8186 0.0000 174.0663 70 G 4.0252 8.4265 112.6882 43.8030 0.0000 171.3063 71 I 3.9053 7.9500 118.3016 64.7662 36.7737 178.0285 72 S 4.1025 7.9544 115.1490 61.4787 62.9468 176.9728 73 G 3.5355 7.8926 108.7815 48.0024 0.0000 175.0146 74 Q 4.1091 9.4404 123.4661 57.8211 28.8468 178.8788 75 A 4.2522 8.2991 121.1934 55.7319 18.1608 179.8076 76 G 3.5728 8.0791 102.3388 47.8228 0.0000 175.1900 77 A 4.1420 8.5005 123.4761 55.0397 18.3745 179.4447 78 I 3.5748 8.1287 118.4262 64.8615 37.4098 178.3636 79 R 3.7559 7.9406 119.1114 59.7781 29.5854 177.9964 80 H 4.2195 8.3525 117.9666 59.1462 29.9935 177.1881 81 G 3.7674 7.9458 108.3370 47.8470 0.0000 174.4973 82 I 3.5505 7.9859 122.3974 64.3487 36.7855 177.8723 83 T 3.7604 7.8722 115.9022 65.7209 67.5845 176.4353 84 R 3.9356 8.1530 119.9489 59.1932 30.0836 178.7086 85 A 4.2010 8.4910 120.6971 55.2254 18.3035 179.3169 86 L 3.8404 8.1344 117.8283 58.5258 41.4170 179.3151 87 M 4.2662 7.9035 118.9220 57.9987 31.7848 178.2370 88 E 4.1039 8.1709 118.2439 59.7384 29.8580 178.5334 89 Y 4.0932 7.4526 117.3320 59.3423 38.9672 174.9722 90 D 4.0361 7.7504 117.3681 53.4828 42.6275 175.0147 91 E 4.3512 8.5888 126.1866 56.8311 30.0496 177.5721 92 S 4.4052 8.3821 115.2241 61.7153 63.6122 176.2755 93 L 4.1081 7.8067 119.8839 57.7304 39.8617 179.0486 94 R 3.8797 7.7140 120.0783 59.7692 30.1005 178.4011 95 S 4.0417 8.1065 112.1556 61.7668 62.0719 176.2424 96 E 3.9308 7.9890 119.2487 59.2594 29.8023 178.5024 97 L 4.3317 7.8674 119.0423 58.0615 41.7537 179.7038 98 R 3.8681 8.6063 118.7375 59.2631 29.8371 178.3143 99 K 4.0287 7.7350 118.0503 58.6021 31.9943 177.4175 100 A 4.3133 6.9597 118.7458 50.3550 20.6511 176.9281 101 G 3.7872 7.9101 107.4560 48.2262 0.0000 172.8014 102 F 5.1322 7.5282 118.1642 59.5692 41.9496 178.5660 103 V 3.4563 8.2312 112.2400 64.6045 31.4893 177.2016 104 T 4.0902 7.2697 108.1153 61.4637 69.1245 173.3801 105 R 4.3024 8.1050 121.8079 54.1947 32.0764 175.1349 106 D 4.4458 8.5511 125.1334 54.6246 39.1665 176.7389 107 A 4.2001 8.2696 125.5932 53.1330 18.7180 178.1687 108 R 4.0367 7.3706 116.5835 56.2136 30.5220 176.1018 109 Q 4.5203 8.3407 122.2533 54.0678 32.1742 173.9438 110 V 3.5478 8.3860 123.1701 63.6865 31.8974 175.0862 111 E 4.4590 8.5087 125.9114 54.7148 30.6058 176.5140 112 R 3.8833 8.4017 120.0109 55.7940 29.9622 176.2726 113 K 4.0752 8.4916 122.1139 56.2520 30.5413 176.7028 114 K 4.2215 8.4000 126.5039 56.0138 32.7729 177.2723 115 V 3.9146 7.9909 120.7259 62.6768 32.4417 174.7783 116 G 4.2970 8.9790 112.0505 46.0088 0.0000 174.2047 117 L 4.3594 6.6812 116.4445 53.8277 43.1247 175.8980 118 R 4.4927 8.0809 117.2015 56.9122 32.4061 176.5475 119 K 4.3122 7.9885 114.4644 56.1566 33.2464 176.2904 120 A 4.1461 8.4130 121.8340 53.5617 18.5770 178.5364 121 R 4.5161 8.4102 110.8145 57.5496 36.6366 174.6609 122 R 3.7702 8.1080 119.5770 56.7942 29.6813 175.0958 123 R 4.6021 8.3506 125.4648 53.7655 30.7723 175.0889 124 P 4.3287 0.0000 0.0000 62.4304 31.6871 176.2337 125 Q 4.1970 8.7267 120.5227 56.7168 28.7870 176.3372 126 F 4.5763 9.0970 114.6949 55.9216 39.0281 176.5420 127 S 2.9735 7.1041 113.3038 58.5240 63.5411 171.6208 128 K 3.6209 7.8081 125.7953 56.1604 32.6058 176.7998 129 R 4.6139 8.3968 125.5693 56.5291 30.1597 175.4071 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 3 N 8.42 4.61 0.00 2.62 2.56 0.00 0.00 6.89 6.19 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 4 Q 8.05 4.52 0.00 2.10 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.66 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 5 Y 9.78 5.08 0.00 3.07 3.22 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 0.00 6 Y 9.49 5.31 0.00 3.32 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 7 G 8.06 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 8 T 7.92 3.82 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 1.37 0.00 0.00 9 G 10.66 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 0.00 0.00 0.00 0.00 10 R 8.48 5.29 0.00 1.97 1.84 0.00 2.70 0.00 0.00 3.95 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.50 0.00 11 R 8.31 4.42 0.00 1.94 1.96 0.00 3.09 0.00 0.00 3.32 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 12 K 9.19 3.99 0.00 1.91 1.90 0.00 1.89 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.34 1.39 7.81 13 S 7.99 3.64 0.00 4.12 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 14 S 7.89 5.38 0.00 3.90 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 15 A 8.61 4.60 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 16 A 8.65 5.02 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 17 R 8.43 4.47 0.00 1.68 1.85 0.00 3.15 0.00 0.00 3.12 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.74 0.00 18 V 8.46 4.49 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 0.91 0.00 0.00 0.75 0.00 0.00 19 F 8.34 6.22 0.00 3.44 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 20 I 8.34 4.15 2.02 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.73 0.81 0.00 0.00 21 K 8.76 5.01 0.00 1.79 1.90 0.00 1.60 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.37 7.81 22 P 0.00 4.46 0.00 2.10 1.97 0.00 3.89 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 1.99 2.00 0.00 23 G 9.21 3.54 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 0.00 0.00 0.00 24 N 9.14 3.76 0.00 2.96 2.81 0.00 0.00 5.94 6.92 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 25 G 8.51 4.96 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 26 K 7.86 4.41 0.00 1.74 1.76 0.00 1.65 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.48 7.81 27 I 8.19 4.42 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 1.24 1.10 0.91 0.00 0.00 28 V 8.31 4.58 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 1.06 0.00 0.00 0.98 0.00 0.00 29 I 8.50 4.39 1.37 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 1.14 0.46 0.41 0.00 0.00 30 N 8.87 3.80 0.00 2.14 2.57 0.00 0.00 6.95 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 31 Q 8.05 3.67 0.00 2.21 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.81 0.00 0.00 0.00 0.00 0.00 2.27 2.45 0.00 32 R 8.07 4.71 0.00 1.78 1.70 0.00 3.22 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 33 S 8.27 4.43 0.00 3.85 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 34 L 8.35 3.88 0.00 1.89 1.68 1.03 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.11 4.30 0.00 2.09 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 2.35 2.44 0.00 36 Q 7.60 4.40 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.73 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 37 Y 7.65 4.50 0.00 2.63 2.25 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 38 F 7.91 5.67 0.00 3.25 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 39 G 8.40 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 40 R 8.81 3.89 0.00 1.95 2.00 0.00 3.20 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 41 E 7.84 4.76 0.00 2.24 1.75 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 2.23 2.45 0.00 42 T 8.57 4.00 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 1.15 0.00 0.00 43 A 8.29 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 R 8.08 4.50 0.00 2.06 2.37 0.00 3.10 0.00 0.00 3.54 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.68 0.00 45 M 8.35 4.30 0.00 2.17 2.33 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.70 0.00 46 V 7.66 3.84 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 0.94 0.00 0.00 0.93 0.00 0.00 47 V 7.90 3.63 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 0.89 0.00 0.00 1.01 0.00 0.00 48 R 7.88 4.18 0.00 2.02 2.11 0.00 3.23 0.00 0.00 3.33 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 49 Q 7.93 4.07 0.00 2.14 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.54 0.00 50 P 0.00 4.15 0.00 2.10 1.86 0.00 3.58 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.88 0.00 51 L 7.56 4.14 0.00 1.86 1.73 0.95 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 52 E 9.33 4.12 0.00 1.98 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 0.00 2.55 2.41 0.00 53 L 7.60 4.38 0.00 1.94 1.96 1.01 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.64 4.49 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 0.78 0.00 0.00 1.06 0.00 0.00 55 D 8.87 4.60 0.00 2.86 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 56 M 8.37 4.41 0.00 1.91 1.93 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.56 0.00 57 V 8.77 3.78 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 0.94 0.00 0.00 58 E 7.89 4.78 0.00 2.06 1.95 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 2.27 2.24 0.00 59 K 7.94 4.54 0.00 1.80 1.83 0.00 2.01 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.46 0.00 0.00 0.00 0.00 1.37 1.33 7.81 60 L 7.32 4.95 0.00 1.85 1.63 0.77 0.70 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 61 D 9.04 5.61 0.00 2.69 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 62 L 8.54 5.80 0.00 1.61 1.70 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 8.63 5.05 0.00 3.10 3.33 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 64 I 8.29 4.28 1.75 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.34 0.77 0.00 0.00 65 T 8.97 4.90 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 1.13 0.00 0.00 66 V 7.57 4.90 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 0.73 0.00 0.00 1.02 0.00 0.00 67 K 9.74 4.37 0.00 1.83 1.90 0.00 1.29 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.29 1.40 7.81 68 G 8.99 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 0.00 0.00 0.00 0.00 69 G 9.11 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 0.00 0.00 0.00 70 G 8.43 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 0.00 0.00 0.00 71 I 7.95 3.91 1.80 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.73 0.75 0.00 0.00 72 S 7.95 4.10 0.00 3.97 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 73 G 7.89 3.54 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 0.00 0.00 0.00 74 Q 9.44 4.11 0.00 2.64 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.64 0.00 0.00 0.00 0.00 0.00 2.83 2.51 0.00 75 A 8.30 4.25 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 G 8.08 3.57 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 0.00 0.00 0.00 77 A 8.50 4.14 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 78 I 8.13 3.57 2.06 0.00 0.00 1.00 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 0.99 0.89 0.00 0.00 79 R 7.94 3.76 0.00 1.96 1.99 0.00 2.79 0.00 0.00 2.95 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.73 0.00 80 H 8.35 4.22 0.00 3.23 3.41 0.00 5.86 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 81 G 7.95 3.77 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 0.00 0.00 0.00 82 I 7.99 3.55 1.92 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 1.34 0.81 0.85 0.00 0.00 83 T 7.87 3.76 4.10 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 0.00 0.00 1.28 0.00 0.00 84 R 8.15 3.94 0.00 1.86 1.82 0.00 3.26 0.00 0.00 3.01 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.44 0.00 85 A 8.49 4.20 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 86 L 8.13 3.84 0.00 1.90 1.76 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 87 M 7.90 4.27 0.00 2.21 2.07 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.61 0.00 88 E 8.17 4.10 0.00 2.28 2.39 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 2.48 2.50 0.00 89 Y 7.45 4.09 0.00 1.47 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 90 D 7.75 4.04 0.00 2.16 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 0.00 0.00 0.00 0.00 91 E 8.59 4.35 0.00 1.95 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 2.42 2.24 0.00 92 S 8.38 4.41 0.00 4.12 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 93 L 7.81 4.11 0.00 1.93 1.93 0.96 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 94 R 7.71 3.88 0.00 1.81 2.04 0.00 3.35 0.00 0.00 3.10 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 95 S 8.11 4.04 0.00 3.87 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 96 E 7.99 3.93 0.00 2.11 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 2.31 2.34 0.00 97 L 7.87 4.33 0.00 1.91 2.01 0.99 0.85 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 98 R 8.61 3.87 0.00 1.83 1.99 0.00 3.11 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 99 K 7.74 4.03 0.00 1.84 1.92 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.41 7.81 100 A 6.96 4.31 0.32 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 0.00 101 G 7.91 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 0.00 0.00 0.00 102 F 7.53 5.13 0.00 3.10 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 0.00 103 V 8.23 3.46 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 0.79 0.00 0.00 0.96 0.00 0.00 104 T 7.27 4.09 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 0.00 105 R 8.11 4.30 0.00 1.73 1.80 0.00 3.38 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.52 0.00 106 D 8.55 4.45 0.00 2.75 2.62 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 0.00 107 A 8.27 4.20 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 0.00 108 R 7.37 4.04 0.00 1.77 1.89 0.00 3.16 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.56 0.00 109 Q 8.34 4.52 0.00 1.95 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.80 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 110 V 8.39 3.55 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 0.85 0.00 0.00 0.93 0.00 0.00 111 E 8.51 4.46 0.00 1.99 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 2.27 2.28 0.00 112 R 8.40 3.88 0.00 1.91 1.94 0.00 3.04 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 113 K 8.49 4.08 0.00 1.74 1.80 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.13 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.46 7.81 114 K 8.40 4.22 0.00 1.86 1.71 0.00 1.89 0.00 0.00 1.87 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.53 1.58 7.81 115 V 7.99 3.91 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 0.70 0.00 0.00 0.93 0.00 0.00 116 G 8.98 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 0.00 0.00 0.00 0.00 117 L 6.68 4.36 0.00 1.64 1.83 0.95 0.82 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 0.00 118 R 8.08 4.49 0.00 1.71 1.98 0.00 3.30 0.00 0.00 3.15 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.52 0.00 119 K 7.99 4.31 0.00 1.77 1.62 0.00 1.89 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.34 1.36 7.81 120 A 8.41 4.15 1.42 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 0.00 0.00 0.00 121 R 8.41 4.52 0.00 1.72 1.91 0.00 3.35 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.71 0.00 122 R 8.11 3.77 0.00 1.88 1.88 0.00 3.22 0.00 0.00 3.34 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.75 0.00 123 R 8.35 4.60 0.00 1.85 1.88 0.00 3.43 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 124 P 0.00 4.33 0.00 2.20 2.09 0.00 3.80 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 1.98 0.00 125 Q 8.73 4.20 0.00 2.18 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.94 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 126 F 9.10 4.58 0.00 3.18 3.16 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 0.00 127 S 7.10 2.97 0.00 3.91 3.69 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 0.00 128 K 7.81 3.62 0.00 1.64 1.78 0.00 1.61 0.00 0.00 1.59 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.51 7.81 129 R 8.40 4.61 0.00 2.15 1.84 0.00 3.41 0.00 0.00 3.42 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00