NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3480 0.0000 0.0000 63.0451 31.9052 175.2448 3 R 3.4273 7.8896 122.5665 54.6256 31.3374 174.8106 4 A 4.5926 8.8534 127.7283 49.3883 19.8870 174.5045 5 K 3.8997 7.8596 122.0375 56.0908 33.6475 176.9447 6 T 4.3425 8.3262 107.6807 61.3633 68.8696 174.4365 7 G 3.8969 7.7183 111.4596 46.4698 0.0000 175.3350 8 I 3.8308 8.6687 115.1263 62.6177 38.7002 176.3093 9 V 3.5522 9.0630 119.7858 65.7159 31.1530 178.0613 10 R 3.6920 7.5230 117.4580 59.1777 29.9149 177.9025 11 R 3.9719 7.9291 117.9932 60.6285 29.8451 177.5558 12 R 3.8224 8.4639 116.2277 58.9675 30.0883 180.2163 13 R 3.6222 8.1767 117.5493 59.3745 31.3444 178.2730 14 H 4.2162 8.8974 117.0723 58.8102 28.7157 177.7668 15 K 3.9346 8.7858 120.4986 60.1680 31.6875 178.5803 16 K 3.8753 8.2062 117.7059 59.7669 32.2618 178.7785 17 V 3.8973 7.8793 116.4881 66.5861 31.6598 177.8259 18 L 3.9633 8.1785 118.1712 58.3253 41.3508 179.4119 19 K 3.9551 8.2905 119.2781 59.8130 32.0898 178.6780 20 R 3.9844 8.2126 117.7138 57.8257 30.3839 177.1035 21 A 3.0981 7.9127 121.9399 51.1800 19.4851 175.2209 22 K 4.3427 7.0422 118.1549 57.9251 34.3677 177.2720 23 G 3.9126 8.3772 104.4194 45.1711 0.0000 173.8405 24 F 4.7452 8.1615 119.9210 56.1884 38.3052 175.1367 25 W 4.0383 9.1683 135.0000 58.2154 31.4834 177.1749 26 G 3.7847 6.9589 110.7125 46.4790 0.0000 173.8215 27 S 4.2937 8.6611 112.1242 60.7052 62.9897 176.2987 28 R 4.3039 7.8550 117.2504 57.3048 29.1237 177.7843 29 S 4.8051 7.6586 107.5931 59.3168 65.0736 174.9364 30 K 4.4932 8.8880 119.5692 55.2922 34.3470 176.5739 31 Q 4.5765 7.5447 117.7674 55.1584 30.7997 175.5611 32 Y 3.7793 8.2431 124.5892 60.0546 39.4960 177.7505 33 R 3.6739 8.1194 118.2986 59.5875 30.3419 178.3491 34 N 4.2091 8.1144 115.3038 56.9695 38.9370 176.0001 35 A 4.3104 7.6160 120.2267 55.5778 18.6107 178.6674 36 F 4.0135 8.2675 117.7909 61.5201 39.4523 177.4412 37 Q 3.7540 8.2340 118.7944 59.7129 28.9690 178.5395 38 T 3.8296 8.5605 117.5575 66.4308 68.1047 175.6239 39 L 4.2798 7.4770 118.0987 55.2074 41.6397 177.8734 40 L 4.2282 7.5860 121.3958 56.8476 42.6191 178.6368 41 N 4.0729 7.8035 115.5569 55.8227 38.6590 177.0887 42 A 4.1372 7.8911 121.7250 54.9577 18.3606 179.5043 43 A 3.9077 8.0242 119.6020 55.6565 18.3717 179.7623 44 T 3.6545 7.5797 113.3834 67.5684 68.5162 175.4671 45 Y 4.5728 7.7977 118.1632 61.2548 37.7193 178.4562 46 E 3.6262 8.4516 117.4487 59.4231 29.9170 178.8943 47 Y 4.2023 8.6145 119.3951 61.2673 39.1018 178.9103 48 R 4.4027 7.9270 116.8646 58.1683 30.3563 177.8082 49 D 4.6858 8.2929 119.3590 56.3181 41.2258 178.7834 50 R 4.2331 7.8071 119.0077 59.2006 30.0454 179.0190 51 R 3.9610 7.8941 116.1154 58.2861 30.5922 176.8096 52 N 4.7913 8.6393 116.6641 55.0642 40.4511 176.3264 53 K 4.0199 8.9159 121.0750 60.0356 31.8534 178.5395 54 K 3.9429 8.1698 119.7292 59.7122 31.4738 178.4944 55 R 3.8301 8.1900 116.9861 59.8412 29.9117 178.3540 56 D 4.4281 8.0129 118.6998 57.8180 41.2659 179.2384 57 F 4.2432 8.2753 117.5993 60.8796 38.9555 177.6979 58 R 3.7810 7.6758 117.0544 59.5080 29.7582 178.7162 59 R 3.9170 7.7304 117.1732 59.5646 30.0641 177.8577 60 L 4.2068 8.1288 121.3254 57.4392 42.0458 178.6187 61 W 4.2662 8.7483 117.9594 60.2060 28.8589 178.2077 62 I 3.7235 8.5245 118.4782 64.6722 36.6342 177.8881 63 Q 4.2074 8.2354 118.7453 59.3416 28.6382 179.8470 64 R 3.8640 8.0314 118.4191 59.5831 29.9952 179.1548 65 I 3.7877 7.5012 119.7436 63.7182 37.1545 176.7257 66 N 4.9766 7.9008 113.5087 52.4826 37.9980 175.4581 67 A 4.3463 8.2670 122.7334 52.9464 18.9101 178.1447 68 G 3.5459 7.5059 103.9502 45.7007 0.0000 175.1465 69 A 4.1966 7.4898 122.9926 55.4823 18.5151 180.1117 70 R 4.2961 8.3675 117.6012 58.3588 29.8602 178.3888 71 L 4.2762 7.5353 117.2131 56.1404 41.8396 176.0710 72 H 4.7686 8.7967 112.4696 56.3530 31.0352 175.2624 73 G 5.3408 7.5167 118.2230 46.6013 0.0000 172.6619 74 M 4.7324 7.5963 121.8999 54.7868 32.5155 175.3553 75 N 4.5613 9.2367 124.1679 55.3717 38.6722 176.3333 76 Y 3.1809 7.1936 121.0228 56.7090 41.3282 177.5539 77 S 3.8385 7.3580 112.1434 61.9057 64.0782 176.4604 78 T 3.6229 9.0163 116.4491 66.6133 68.3617 176.9040 79 F 3.7750 7.6876 121.8290 61.3905 40.9274 178.1230 80 I 3.4353 8.5280 120.0445 64.1190 36.7393 177.8251 81 N 4.2981 8.5183 118.3895 56.9094 38.7742 176.5515 82 G 4.2367 7.8984 107.5070 47.4332 0.0000 175.0051 83 L 3.8006 7.0883 121.8398 56.9263 41.6701 179.8111 84 K 4.0160 7.4072 118.2804 59.5066 32.4252 178.9545 85 R 4.1525 8.2701 116.7904 57.0859 31.1819 176.9140 86 A 4.5296 7.5639 122.1049 48.9225 18.9528 175.5898 87 N 4.0313 8.6013 119.9779 56.6947 38.6931 175.4780 88 I 3.4156 7.2774 115.6889 65.6708 37.7411 175.1803 89 D 4.5336 8.4025 122.9021 54.8412 41.4559 177.2216 90 L 4.3577 7.8470 122.9735 54.2941 42.1048 176.0920 91 N 4.3703 8.1274 115.3910 53.3373 38.8226 175.5192 92 R 4.2425 7.7501 120.7454 56.8891 29.0804 176.3527 93 K 4.6494 7.6693 115.9523 57.2887 34.2023 175.1572 94 V 3.9886 11.0167 126.0387 64.3006 29.9349 172.4277 95 L 3.9533 8.1843 120.2013 58.0126 42.2310 178.1726 96 A 3.9248 8.2833 120.3840 55.6098 18.1053 178.7568 97 D 4.0932 7.7168 115.8247 57.6968 41.3134 178.7064 98 I 3.7604 7.6240 119.3598 64.2483 36.8176 178.2200 99 A 3.4905 8.0840 121.2318 54.6021 18.1428 179.1858 100 A 3.8928 7.5105 118.4851 55.0113 18.6872 179.5419 101 R 4.2292 8.2206 115.7151 58.0105 31.7389 178.7006 102 E 4.4491 7.4177 122.4020 54.2361 28.4625 174.9086 103 P 4.3649 0.0000 0.0000 65.2037 31.3039 177.4374 104 E 3.9694 8.3967 116.9452 59.8445 28.8719 179.4963 105 A 3.9235 8.0038 119.7611 54.9643 18.4912 179.1688 106 F 4.0192 8.7137 119.7007 62.0007 39.5079 176.4278 107 K 3.5488 9.1768 117.4245 60.6255 31.5800 178.0407 108 A 3.5604 8.2484 116.5515 54.8787 18.7112 179.5202 109 L 3.7368 7.8640 114.1892 58.0357 42.0701 179.3622 110 V 3.5795 8.0959 117.5039 65.3820 30.9470 176.8082 111 D 4.2948 8.1292 118.1942 57.6034 41.2576 178.8759 112 A 3.8875 9.0028 120.5629 55.4029 18.6179 179.2187 113 S 4.0205 7.9990 111.0813 61.3336 62.5392 176.3412 114 R 3.8777 7.7807 121.6394 58.6326 30.3007 176.8135 115 N 5.1950 7.6339 116.1099 51.6898 37.7875 175.8749 116 A 4.4316 7.4944 117.4527 53.0172 22.6629 176.7145 117 R 4.3510 7.2362 113.8014 55.5911 33.2135 175.6942 118 Q 4.2413 8.0112 121.9237 56.0199 28.9944 175.7333 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 2 P 0.00 4.35 0.00 2.19 2.16 0.00 3.76 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 1.88 1.96 0.00 3 R 7.89 3.43 0.00 1.88 1.84 0.00 3.17 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 4 A 8.85 4.59 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 5 K 7.86 3.90 0.00 1.73 1.90 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.47 7.81 6 T 8.33 4.34 4.19 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 1.17 0.00 0.00 7 G 7.72 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 8 I 8.67 3.83 1.85 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 1.28 0.45 0.89 0.00 0.00 9 V 9.06 3.55 2.03 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 0.95 0.00 0.00 1.00 0.00 0.00 10 R 7.52 3.69 0.00 1.88 1.75 0.00 3.02 0.00 0.00 2.88 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.32 0.00 11 R 7.93 3.97 0.00 1.87 1.90 0.00 3.25 0.00 0.00 3.33 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.73 0.00 12 R 8.46 3.82 0.00 2.04 1.85 0.00 3.23 0.00 0.00 3.08 8.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.95 0.00 13 R 8.18 3.62 0.00 2.00 1.92 0.00 2.91 0.00 0.00 2.87 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.65 0.00 14 H 8.90 4.22 0.00 3.30 3.21 0.00 5.73 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 15 K 8.79 3.93 0.00 1.87 1.93 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.71 7.81 16 K 8.21 3.88 0.00 2.10 1.92 0.00 1.77 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.49 7.81 17 V 7.88 3.90 2.59 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 1.27 0.00 0.00 1.38 0.00 0.00 18 L 8.18 3.96 0.00 1.96 1.77 1.05 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 19 K 8.29 3.96 0.00 1.75 2.21 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.50 7.81 20 R 8.21 3.98 0.00 1.93 1.98 0.00 3.30 0.00 0.00 3.28 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.88 0.00 21 A 7.91 3.10 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 22 K 7.04 4.34 0.00 1.76 1.60 0.00 1.38 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.00 1.12 7.81 23 G 8.38 3.91 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 0.00 0.00 0.00 24 F 8.16 4.75 0.00 2.97 3.07 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 25 W 9.17 4.04 0.00 3.44 3.17 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 0.00 26 G 6.96 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 27 S 8.66 4.29 0.00 4.05 4.19 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 28 R 7.86 4.30 0.00 2.34 2.03 0.00 3.16 0.00 0.00 3.08 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 29 S 7.66 4.81 0.00 4.02 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 0.00 30 K 8.89 4.49 0.00 1.67 1.84 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.78 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.48 7.81 31 Q 7.54 4.58 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 32 Y 8.24 3.78 0.00 3.00 2.80 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 33 R 8.12 3.67 0.00 1.86 2.01 0.00 3.46 0.00 0.00 3.37 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.74 0.00 34 N 8.11 4.21 0.00 2.84 2.82 0.00 0.00 6.89 8.15 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 35 A 7.62 4.31 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 36 F 8.27 4.01 0.00 2.50 2.80 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 37 Q 8.23 3.75 0.00 2.30 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.53 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 38 T 8.56 3.83 4.28 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 0.74 0.00 0.00 39 L 7.48 4.28 0.00 1.48 1.54 1.01 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 40 L 7.59 4.23 0.00 1.62 1.54 0.86 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 41 N 7.80 4.07 0.00 2.60 2.61 0.00 0.00 6.99 8.12 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 42 A 7.89 4.14 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 43 A 8.02 3.91 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 44 T 7.58 3.65 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 0.97 0.00 0.00 45 Y 7.80 4.57 0.00 3.09 3.03 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 46 E 8.45 3.63 0.00 2.30 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 2.44 2.77 0.00 47 Y 8.61 4.20 0.00 3.11 2.81 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 48 R 7.93 4.40 0.00 1.96 2.07 0.00 3.17 0.00 0.00 3.19 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.99 0.00 49 D 8.29 4.69 0.00 3.17 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.81 4.23 0.00 1.73 1.94 0.00 3.04 0.00 0.00 3.12 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 51 R 7.89 3.96 0.00 1.85 2.06 0.00 3.15 0.00 0.00 2.47 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.87 0.00 52 N 8.64 4.79 0.00 3.04 2.92 0.00 0.00 6.81 6.62 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 53 K 8.92 4.02 0.00 2.14 2.18 0.00 1.42 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.68 1.68 7.81 54 K 8.17 3.94 0.00 1.83 1.85 0.00 1.69 0.00 0.00 1.79 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.52 7.81 55 R 8.19 3.83 0.00 2.08 1.96 0.00 3.17 0.00 0.00 3.18 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.73 0.00 56 D 8.01 4.43 0.00 2.59 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 57 F 8.28 4.24 0.00 3.36 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 58 R 7.68 3.78 0.00 1.95 1.99 0.00 3.07 0.00 0.00 2.99 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.83 0.00 59 R 7.73 3.92 0.00 1.90 2.14 0.00 3.08 0.00 0.00 3.07 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 60 L 8.13 4.21 0.00 1.78 2.17 0.91 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 61 W 8.75 4.27 0.00 3.60 3.42 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 62 I 8.52 3.72 1.92 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.75 0.24 0.00 0.00 63 Q 8.24 4.21 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.68 0.00 64 R 8.03 3.86 0.00 1.78 1.83 0.00 3.02 0.00 0.00 3.04 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.76 0.00 65 I 7.50 3.79 2.36 0.00 0.00 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 1.72 1.00 0.96 0.00 0.00 66 N 7.90 4.98 0.00 3.02 3.29 0.00 0.00 6.76 7.38 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 67 A 8.27 4.35 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 68 G 7.51 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 69 A 7.49 4.20 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 70 R 8.37 4.30 0.00 1.91 2.01 0.00 3.15 0.00 0.00 3.21 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.69 0.00 71 L 7.54 4.28 0.00 1.76 1.58 0.85 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 72 H 8.80 4.77 0.00 3.38 3.30 0.00 5.85 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 73 G 7.52 5.34 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 0.00 74 M 7.60 4.73 0.00 2.20 2.03 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.52 0.00 75 N 9.24 4.56 0.00 2.98 3.01 0.00 0.00 5.68 7.57 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 76 Y 7.19 3.18 0.00 3.38 3.03 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 77 S 7.36 3.84 0.00 4.07 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 9.02 3.62 4.44 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 1.24 0.00 0.00 79 F 7.69 3.77 0.00 3.13 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 80 I 8.53 3.44 1.71 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 0.84 -0.36 0.86 0.00 0.00 81 N 8.52 4.30 0.00 2.76 2.97 0.00 0.00 7.07 8.32 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 82 G 7.90 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 0.00 0.00 0.00 0.00 83 L 7.09 3.80 0.00 1.29 1.59 -0.46 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 84 K 7.41 4.02 0.00 1.79 2.12 0.00 1.81 0.00 0.00 1.89 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.45 7.81 85 R 8.27 4.15 0.00 1.73 2.00 0.00 3.17 0.00 0.00 3.40 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.68 0.00 86 A 7.56 4.53 1.16 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 0.00 0.00 87 N 8.60 4.03 0.00 2.65 2.89 0.00 0.00 7.25 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 88 I 7.28 3.42 1.83 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 1.39 0.52 0.89 0.00 0.00 89 D 8.40 4.53 0.00 2.69 2.52 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 90 L 7.85 4.36 0.00 1.54 1.57 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 91 N 8.13 4.37 0.00 2.85 2.88 0.00 0.00 7.18 7.66 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 92 R 7.75 4.24 0.00 2.05 2.12 0.00 3.44 0.00 0.00 3.38 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 93 K 7.67 4.65 0.00 1.98 1.72 0.00 1.68 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.62 7.81 94 V 11.02 3.99 2.22 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 0.94 0.00 0.00 1.08 0.00 0.00 95 L 8.18 3.95 0.00 2.09 1.90 1.15 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 96 A 8.28 3.92 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 97 D 7.72 4.09 0.00 2.42 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 98 I 7.62 3.76 2.23 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 1.51 0.92 1.05 0.00 0.00 99 A 8.08 3.49 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 0.00 0.00 0.00 0.00 0.00 0.00 100 A 7.51 3.89 1.20 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 0.00 0.00 0.00 101 R 8.22 4.23 0.00 1.74 1.97 0.00 3.13 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 102 E 7.42 4.45 0.00 2.21 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 0.00 2.28 2.39 0.00 103 P 0.00 4.36 0.00 2.19 2.14 0.00 3.65 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 104 E 8.40 3.97 0.00 2.03 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 2.43 2.44 0.00 105 A 8.00 3.92 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 0.00 106 F 8.71 4.02 0.00 3.42 3.26 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 0.00 107 K 9.18 3.55 0.00 1.88 1.93 0.00 1.40 0.00 0.00 1.60 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.50 7.81 108 A 8.25 3.56 1.26 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 0.00 0.00 0.00 109 L 7.86 3.74 0.00 1.66 1.61 1.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 110 V 8.10 3.58 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 1.02 0.00 0.00 0.81 0.00 0.00 111 D 8.13 4.29 0.00 2.78 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.00 3.89 1.28 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 0.00 0.00 113 S 8.00 4.02 0.00 3.58 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 0.00 114 R 7.78 3.88 0.00 1.86 2.03 0.00 3.13 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 115 N 7.63 5.19 0.00 2.64 2.76 0.00 0.00 6.80 8.30 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 0.00 116 A 7.49 4.43 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 0.00 117 R 7.24 4.35 0.00 1.86 1.86 0.00 3.23 0.00 0.00 3.22 7.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 118 Q 8.01 4.24 0.00 2.06 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.42 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00