NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.3562 8.4293 121.4755 55.8548 30.7831 175.6959 3 S 4.0836 8.8427 121.2808 60.7907 63.0450 173.2726 4 D 4.5580 8.3102 121.4017 54.9513 42.5119 176.9942 5 F 5.2153 8.8079 124.5330 57.1798 43.2964 172.1536 6 Y 4.9096 7.8813 125.5029 56.2809 42.7883 173.1471 7 L 4.8584 7.7719 127.1201 53.5285 46.0869 174.6316 8 R 5.0432 9.0893 125.7601 54.8055 34.1181 172.9364 9 Y 5.1812 8.5687 125.7372 55.9162 41.9767 173.1661 10 Y 4.9446 8.2361 126.9071 55.5249 42.5291 174.3868 11 V 4.5028 8.0199 125.0828 59.7860 34.9448 174.5116 12 G 4.4303 8.8302 111.2037 43.5162 0.0000 171.1781 13 H 5.3212 8.9952 122.7581 54.4129 33.4755 172.2875 14 K 4.3963 8.9000 128.8846 55.8019 32.0744 176.7739 15 G 3.8401 8.2565 117.5810 43.6936 0.0000 172.7249 16 K 3.6693 8.3663 118.0415 58.9613 32.0431 178.9945 17 F 4.9561 7.1941 114.9914 57.0436 39.4005 174.4813 18 G 4.0351 7.9601 106.5348 44.2247 0.0000 172.3634 19 H 5.1159 8.5352 119.3669 55.7743 30.8054 174.1035 20 E 5.2053 9.1937 121.8103 55.0630 33.4466 174.0031 21 F 5.2973 8.5706 114.8007 55.9581 41.9920 172.5355 22 L 4.9911 8.8534 121.1467 53.4789 45.5985 174.7003 23 E 5.3078 9.2293 125.6748 55.0282 33.6688 173.6019 24 F 5.5744 8.7225 119.6771 55.7606 42.1793 172.8455 25 E 5.0669 9.3229 120.7879 55.0418 33.4469 173.5855 26 F 5.2189 9.4492 126.2735 56.2408 41.0774 175.7369 27 R 4.9806 9.1736 123.4432 54.3738 31.6880 175.9973 28 P 4.5774 0.0000 0.0000 64.9704 31.4316 177.1769 29 D 4.7083 8.3252 115.2910 53.2364 39.6719 177.1426 30 G 4.0940 8.6427 108.9472 45.2222 0.0000 173.1927 31 K 4.0726 8.2780 122.1568 55.9661 33.4991 175.1793 32 L 4.8767 9.1322 129.9962 53.3338 44.2556 174.9862 33 R 5.1887 8.8714 125.4000 54.6127 33.3917 174.2971 34 Y 5.4043 9.2476 123.5056 56.0771 42.7416 173.6938 35 A 4.9855 8.4545 126.6241 50.6048 23.4412 174.7460 36 N 4.7479 8.6394 120.0768 52.1354 42.8738 172.9061 37 N 5.3625 8.1216 123.3514 51.2513 40.7049 173.5776 38 S 4.9384 8.5541 116.3094 57.3762 67.9437 172.7396 39 N 5.8096 7.9121 118.2843 52.8328 40.8000 171.9618 40 Y 3.7099 9.4865 114.1765 58.1580 36.0106 170.5575 41 K 4.2243 9.9069 120.9606 55.8284 30.8168 176.4774 42 N 4.8941 7.7105 115.8015 52.0871 42.3880 172.9308 43 D 5.2857 8.5380 123.4014 51.4902 41.2352 174.8097 44 V 4.4834 7.9554 121.6701 60.8426 35.4945 173.2121 45 M 4.8400 8.6688 126.1839 53.8635 34.6982 174.2435 46 I 4.4949 8.5861 127.2988 59.7266 39.8578 175.1565 47 R 4.9505 8.4535 124.8498 54.7492 33.2846 174.5143 48 K 4.6461 9.3306 123.2928 54.6428 36.6545 175.4790 49 E 5.3389 8.6585 120.1292 55.2347 33.6344 174.4624 50 A 4.6835 8.9046 123.3059 51.2936 23.3569 174.4481 51 Y 4.9414 8.6374 117.2451 56.7763 39.4369 175.9414 52 V 4.4377 8.5817 117.7599 59.7652 33.9560 175.7877 53 H 4.3079 8.7193 122.5065 55.7904 30.6253 176.2455 54 K 3.9373 8.3991 125.1524 59.5402 31.8315 179.1794 55 S 4.1215 8.3319 114.2914 61.2679 62.8393 176.6043 56 V 3.5294 7.7972 121.7162 66.1123 31.3276 177.8993 57 M 3.6967 7.9153 117.9212 58.3196 31.7293 178.5019 58 E 3.7976 8.2122 118.7485 59.3027 29.6313 178.9462 59 E 3.8417 8.1750 119.3311 59.0824 29.6106 178.8503 60 L 3.8066 7.7535 119.0326 57.7486 41.5913 179.6040 61 K 3.9802 7.6473 118.3035 59.3944 31.8403 179.3731 62 R 3.8511 8.0155 119.0798 59.4099 30.0342 178.6904 63 I 3.6822 7.8386 119.6005 64.3422 36.8773 178.5176 64 I 3.7133 7.6285 119.2624 64.4869 37.3634 177.7014 65 D 4.5917 8.2544 119.7792 57.8926 40.5313 178.6729 66 D 4.4410 8.2162 118.1743 57.7146 40.9052 179.1408 67 S 4.2494 7.9211 113.4580 59.2161 63.2183 174.4640 68 E 3.8898 8.1549 120.2585 56.9943 27.7280 176.1421 69 I 3.8692 7.7758 122.1944 64.4196 38.0547 178.0416 70 T 4.1539 8.0287 108.9263 63.9609 68.6501 174.9174 71 K 4.2720 8.0697 120.1263 57.0184 32.7995 176.2059 72 E 4.8282 8.2525 119.2735 54.8826 31.8944 174.1079 73 D 4.6467 8.1536 117.9907 53.1375 44.3260 174.0698 74 D 3.3700 7.8209 122.5496 52.5227 39.7254 177.8469 75 A 3.7996 7.3654 124.9523 55.6553 18.1910 179.3742 76 L 4.5867 7.6616 111.4849 54.5140 42.0390 176.6152 77 W 4.8196 7.7087 119.2526 55.2513 30.4533 174.6294 78 P 4.5120 0.0000 0.0000 62.3843 31.7946 174.5664 79 P 4.8519 0.0000 0.0000 61.8074 32.3404 174.2477 80 P 4.6060 0.0000 0.0000 62.9896 31.5672 175.0749 81 D 4.7224 8.7835 118.8910 51.8558 42.4543 176.0884 82 R 3.8971 8.6281 115.2200 59.1475 29.2277 177.5631 83 V 3.9896 7.7277 117.0153 64.3937 32.4749 175.3062 84 G 4.4570 7.9943 103.3400 45.7758 0.0000 172.7109 85 R 5.4158 8.7285 120.9708 55.0283 34.1046 173.7830 86 Q 5.2921 9.3168 124.5542 54.2625 32.8245 174.3027 87 E 5.3353 9.1263 120.7888 54.6675 34.0191 174.5583 88 L 5.3995 9.3000 124.7573 53.5032 45.9449 174.5032 89 E 5.2803 9.4784 126.5868 54.5807 32.9871 174.2783 90 I 5.0663 8.9202 126.7931 59.5590 41.6091 174.2608 91 V 4.8859 8.7988 127.1330 61.0724 33.6418 174.4095 92 I 4.8755 8.2060 120.8838 58.9892 40.3913 175.0775 93 G 3.8574 8.6456 116.2731 47.3083 0.0000 174.1706 94 D 4.8031 8.7847 123.6954 53.6823 41.8436 175.6433 95 E 4.2983 7.9197 121.2844 55.8601 30.2792 174.6822 96 H 5.6763 8.7906 123.3612 54.3088 32.2863 172.6306 97 I 4.5483 8.7974 118.8366 59.2356 40.9009 174.7017 98 S 5.0983 7.8948 118.9366 57.1144 66.8089 173.2927 99 F 5.0423 9.5799 123.1106 55.9525 42.6090 174.3797 100 T 5.1923 9.1652 118.7383 62.6460 71.7142 173.3817 101 T 5.2721 9.1484 123.0643 61.7620 73.3697 172.9854 102 S 5.2047 8.6152 117.7510 57.6548 65.1268 173.8324 103 K 4.3345 8.4757 118.8537 57.5186 33.4342 177.7680 104 I 4.4267 8.1160 122.8291 60.1343 40.3347 175.9133 105 G 4.2301 8.1741 110.5720 46.3803 0.0000 174.8424 106 S 4.5833 8.6853 124.1049 57.1293 63.5278 174.0462 107 L 3.6368 7.9402 115.1842 57.1303 41.1663 178.8808 108 I 3.6107 7.5197 119.1347 64.5509 36.9396 177.5137 109 D 4.4331 7.8533 118.9656 57.4444 40.7524 179.1635 110 V 3.5353 7.3338 112.9262 64.3994 31.3111 178.4068 111 N 4.4154 8.3194 115.3384 55.4067 38.3851 176.3580 112 Q 4.4544 7.2997 116.4046 54.9078 29.4079 175.5780 113 S 4.5406 7.3053 115.8522 57.1082 64.4721 174.2511 114 K 4.2775 8.3873 118.1147 57.7283 32.1991 177.5684 115 D 4.8440 7.8060 118.7547 50.9826 41.7125 173.4424 116 P 4.3722 0.0000 0.0000 65.2613 31.6583 178.0738 117 E 4.0792 8.1668 117.0849 59.3421 29.7059 179.3255 118 G 4.0498 8.2707 107.0402 47.1123 0.0000 175.8028 119 L 3.2186 7.8620 121.5240 56.6570 41.4504 179.5714 120 R 3.6849 7.9070 119.0922 59.3774 30.0687 178.6449 121 V 3.7677 7.6679 117.8440 65.9675 31.4029 177.8197 122 F 4.0655 8.0283 120.1230 61.3551 39.2792 176.2166 123 Y 3.8570 8.3605 119.5594 61.1159 38.4392 178.0397 124 Y 4.0671 7.8198 117.2769 60.8673 37.9363 178.0821 125 L 3.8570 7.9457 121.3035 58.0026 42.1003 179.0487 126 V 3.0550 7.3992 118.2971 66.0180 31.3399 177.9339 127 Q 3.7202 7.4070 117.4416 59.0507 28.4045 178.7611 128 D 4.2722 8.0838 119.8376 57.1731 40.8444 178.8557 129 L 3.8663 8.1215 119.9087 57.6350 41.5727 179.6114 130 K 3.2391 7.8878 118.5693 59.4222 31.9206 178.9952 131 C 4.0168 7.7481 116.8069 62.7002 28.0208 176.0721 132 L 3.8229 7.4892 121.3219 58.1081 41.6853 179.1494 133 V 3.4109 7.4060 118.0434 66.0539 31.3089 177.9254 134 F 4.3919 8.0790 117.8221 60.7285 38.6533 177.9258 135 S 4.1267 8.1335 114.7356 61.4683 62.6410 176.6556 136 L 3.9430 7.9782 121.6078 57.9747 41.4360 179.8015 137 I 3.9572 7.9420 119.8632 64.2907 36.8952 178.6990 138 G 3.6723 8.2674 106.7739 47.4527 0.0000 175.6173 139 L 4.1015 7.7173 120.2163 57.3021 41.9197 178.5958 140 H 4.0780 8.0641 117.3892 58.6853 28.7183 176.5367 141 F 4.6685 8.3012 117.0398 55.9877 39.8831 175.6701 142 K 4.1617 8.3419 116.7850 56.5079 29.2349 173.3369 143 I 4.5033 7.0501 108.3696 58.5963 40.6966 174.0926 144 K 4.5054 8.2471 121.4899 54.3732 32.6865 174.4140 145 P 4.3932 0.0000 0.0000 62.9004 31.1411 176.1322 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 E 8.43 4.36 0.00 1.95 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 2.23 2.49 0.00 3 S 8.84 4.08 0.00 4.14 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 4 D 8.31 4.56 0.00 2.75 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 5 F 8.81 5.22 0.00 3.16 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 6 Y 7.88 4.91 0.00 3.01 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 0.00 0.00 0.00 0.00 7 L 7.77 4.86 0.00 1.56 1.57 1.05 1.07 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 8 R 9.09 5.04 0.00 1.68 1.74 0.00 3.33 0.00 0.00 3.29 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.70 0.00 9 Y 8.57 5.18 0.00 2.79 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 10 Y 8.24 4.94 0.00 3.09 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 11 V 8.02 4.50 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 0.77 0.00 0.00 0.93 0.00 0.00 12 G 8.83 4.43 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 0.00 0.00 0.00 13 H 9.00 5.32 0.00 3.13 3.07 0.00 5.60 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 K 8.90 4.40 0.00 1.85 1.83 0.00 1.76 0.00 0.00 1.80 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.46 1.43 7.81 15 G 8.26 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 16 K 8.37 3.67 0.00 0.79 0.77 0.00 1.18 0.00 0.00 1.47 0.00 0.00 2.87 0.00 0.00 2.45 0.00 0.00 0.00 0.00 1.14 1.17 7.81 17 F 7.19 4.96 0.00 2.85 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 18 G 7.96 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 19 H 8.54 5.12 0.00 3.24 3.26 0.00 5.68 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 E 9.19 5.21 0.00 2.12 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 2.34 2.25 0.00 21 F 8.57 5.30 0.00 3.00 3.20 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 22 L 8.85 4.99 0.00 1.74 1.52 1.18 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 23 E 9.23 5.31 0.00 2.33 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 2.28 2.53 0.00 24 F 8.72 5.57 0.00 3.23 3.32 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 25 E 9.32 5.07 0.00 2.07 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 2.27 2.20 0.00 26 F 9.45 5.22 0.00 3.24 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 27 R 9.17 4.98 0.00 2.04 2.05 0.00 3.23 0.00 0.00 3.30 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.73 0.00 28 P 0.00 4.58 0.00 2.16 2.27 0.00 3.91 0.00 0.00 4.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.24 0.00 29 D 8.33 4.71 0.00 2.94 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 30 G 8.64 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 0.00 0.00 0.00 31 K 8.28 4.07 0.00 1.43 1.71 0.00 1.09 0.00 0.00 0.61 0.00 0.00 2.79 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.28 1.18 7.81 32 L 9.13 4.88 0.00 1.41 1.50 0.11 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.87 5.19 0.00 1.79 1.82 0.00 3.34 0.00 0.00 3.11 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.53 0.00 34 Y 9.25 5.40 0.00 2.93 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 0.00 35 A 8.45 4.99 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 36 N 8.64 4.75 0.00 2.43 2.44 0.00 0.00 6.56 6.41 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 37 N 8.12 5.36 0.00 2.69 2.39 0.00 0.00 6.29 7.15 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 38 S 8.55 4.94 0.00 3.66 3.72 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 39 N 7.91 5.81 0.00 2.67 2.93 0.00 0.00 7.30 7.54 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 40 Y 9.49 3.71 0.00 3.17 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 41 K 9.91 4.22 0.00 1.83 2.01 0.00 1.84 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.12 1.20 7.81 42 N 7.71 4.89 0.00 2.72 2.64 0.00 0.00 6.96 8.08 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 43 D 8.54 5.29 0.00 2.52 2.61 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 0.00 0.00 0.00 0.00 44 V 7.96 4.48 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 0.96 0.00 0.00 0.92 0.00 0.00 45 M 8.67 4.84 0.00 2.00 1.90 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.61 0.00 46 I 8.59 4.49 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.66 0.97 0.00 0.00 47 R 8.45 4.95 0.00 1.62 1.80 0.00 3.19 0.00 0.00 3.24 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 48 K 9.33 4.65 0.00 1.56 1.12 0.00 0.61 0.00 0.00 1.15 0.00 0.00 2.50 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.11 0.94 7.81 49 E 8.66 5.34 0.00 1.84 1.76 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 2.21 2.33 0.00 50 A 8.90 4.68 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 51 Y 8.64 4.94 0.00 2.85 2.93 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 52 V 8.58 4.44 2.18 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 0.72 0.00 0.00 1.20 0.00 0.00 53 H 8.72 4.31 0.00 3.17 3.17 0.00 5.68 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 54 K 8.40 3.94 0.00 1.83 1.69 0.00 1.77 0.00 0.00 1.81 0.00 0.00 3.08 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.53 7.81 55 S 8.33 4.12 0.00 4.09 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 0.00 56 V 7.80 3.53 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 1.05 0.00 0.00 0.96 0.00 0.00 57 M 7.92 3.70 0.00 1.78 2.12 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.60 0.00 58 E 8.21 3.80 0.00 1.91 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 0.00 2.45 2.41 0.00 59 E 8.17 3.84 0.00 2.08 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 0.00 2.24 2.32 0.00 60 L 7.75 3.81 0.00 1.45 1.39 -0.38 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 61 K 7.65 3.98 0.00 1.88 1.82 0.00 1.55 0.00 0.00 1.56 0.00 0.00 2.49 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.46 0.95 7.81 62 R 8.02 3.85 0.00 1.83 2.05 0.00 3.07 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 63 I 7.84 3.68 1.97 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.81 0.87 0.00 0.00 64 I 7.63 3.71 1.98 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.59 1.03 0.00 0.00 65 D 8.25 4.59 0.00 3.01 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 66 D 8.22 4.44 0.00 2.84 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 67 S 7.92 4.25 0.00 4.10 4.13 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 68 E 8.15 3.89 0.00 2.31 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 0.00 2.28 2.44 0.00 69 I 7.78 3.87 1.98 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 1.46 1.47 1.07 0.00 0.00 70 T 8.03 4.15 4.38 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 0.00 0.00 0.00 1.32 0.00 0.00 71 K 8.07 4.27 0.00 1.97 1.96 0.00 1.72 0.00 0.00 1.75 0.00 0.00 3.15 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.51 1.57 7.81 72 E 8.25 4.83 0.00 2.45 2.21 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 2.43 2.60 0.00 73 D 8.15 4.65 0.00 2.47 2.33 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 74 D 7.82 3.37 0.00 2.51 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 0.00 0.00 0.00 75 A 7.37 3.80 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 76 L 7.66 4.59 0.00 1.81 1.80 0.98 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 77 W 7.71 4.82 0.00 3.14 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 78 P 0.00 4.51 0.00 2.10 2.01 0.00 3.63 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.10 0.00 79 P 0.00 4.85 0.00 2.09 2.08 0.00 3.80 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 80 P 0.00 4.61 0.00 2.09 2.08 0.00 3.70 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 81 D 8.78 4.72 0.00 2.88 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 82 R 8.63 3.90 0.00 1.93 2.17 0.00 3.08 0.00 0.00 3.16 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.73 0.00 83 V 7.73 3.99 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 0.95 0.00 0.00 0.94 0.00 0.00 84 G 7.99 4.46 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 0.00 0.00 0.00 85 R 8.73 5.42 0.00 1.98 1.97 0.00 3.07 0.00 0.00 3.36 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 86 Q 9.32 5.29 0.00 2.28 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.54 0.00 0.00 0.00 0.00 0.00 2.39 2.55 0.00 87 E 9.13 5.34 0.00 1.93 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 2.23 2.29 0.00 88 L 9.30 5.40 0.00 2.24 2.03 1.16 0.77 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 89 E 9.48 5.28 0.00 2.16 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 2.50 2.28 0.00 90 I 8.92 5.07 2.01 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.75 0.98 0.00 0.00 91 V 8.80 4.89 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 0.94 0.00 0.00 0.46 0.00 0.00 92 I 8.21 4.88 2.00 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 1.30 1.03 1.23 0.00 0.00 93 G 8.65 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 94 D 8.78 4.80 0.00 2.66 2.70 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 95 E 7.92 4.30 0.00 2.04 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 2.34 2.28 0.00 96 H 8.79 5.68 0.00 3.07 3.13 0.00 5.69 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 97 I 8.80 4.55 1.74 0.00 0.00 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 1.49 1.23 0.75 0.00 0.00 98 S 7.89 5.10 0.00 3.51 3.60 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 99 F 9.58 5.04 0.00 3.08 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 0.00 100 T 9.17 5.19 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 1.24 0.00 0.00 101 T 9.15 5.27 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 1.47 0.00 0.00 102 S 8.62 5.20 0.00 3.90 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 0.00 103 K 8.48 4.33 0.00 1.79 1.87 0.00 1.40 0.00 0.00 1.55 0.00 0.00 2.74 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.45 7.81 104 I 8.12 4.43 1.94 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.43 0.98 0.00 0.00 105 G 8.17 4.23 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 0.00 106 S 8.69 4.58 0.00 3.82 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 0.00 107 L 7.94 3.64 0.00 1.54 1.48 0.92 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 108 I 7.52 3.61 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 1.59 0.41 0.86 0.00 0.00 109 D 7.85 4.43 0.00 2.70 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 0.00 110 V 7.33 3.54 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 0.61 0.00 0.00 0.79 0.00 0.00 111 N 8.32 4.42 0.00 2.64 2.84 0.00 0.00 7.01 7.24 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 0.00 112 Q 7.30 4.45 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.86 0.00 0.00 0.00 0.00 0.00 2.29 2.54 0.00 113 S 7.31 4.54 0.00 3.95 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 0.00 114 K 8.39 4.28 0.00 2.05 1.94 0.00 1.92 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.45 7.81 115 D 7.81 4.84 0.00 2.87 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 0.00 116 P 0.00 4.37 0.00 2.19 2.05 0.00 3.67 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 117 E 8.17 4.08 0.00 2.11 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 2.44 2.48 0.00 118 G 8.27 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 0.00 119 L 7.86 3.22 0.00 1.46 1.31 0.54 -0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 120 R 7.91 3.68 0.00 2.01 2.17 0.00 3.15 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.63 0.00 121 V 7.67 3.77 2.37 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 1.09 0.00 0.00 1.07 0.00 0.00 122 F 8.03 4.07 0.00 2.97 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 0.00 123 Y 8.36 3.86 0.00 2.90 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 0.00 124 Y 7.82 4.07 0.00 3.10 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 0.00 125 L 7.95 3.86 0.00 1.75 1.62 0.91 0.68 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 0.00 126 V 7.40 3.06 1.50 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 0.49 0.00 0.00 -0.08 0.00 0.00 127 Q 7.41 3.72 0.00 2.02 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.59 0.00 0.00 0.00 0.00 0.00 2.03 1.72 0.00 128 D 8.08 4.27 0.00 2.75 2.63 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 0.00 0.00 0.00 0.00 129 L 8.12 3.87 0.00 1.72 1.82 0.94 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 130 K 7.89 3.24 0.00 1.56 0.94 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.75 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.34 7.81 131 C 7.75 4.02 0.00 3.04 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 0.00 132 L 7.49 3.82 0.00 1.68 1.71 0.87 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 133 V 7.41 3.41 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 0.79 0.00 0.00 0.10 0.00 0.00 134 F 8.08 4.39 0.00 3.01 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 0.00 135 S 8.13 4.13 0.00 4.04 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 0.00 136 L 7.98 3.94 0.00 1.81 1.69 1.02 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 137 I 7.94 3.96 1.55 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 1.38 0.27 0.62 0.00 0.00 138 G 8.27 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 0.00 0.00 0.00 139 L 7.72 4.10 0.00 1.82 1.71 0.91 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 140 H 8.06 4.08 0.00 3.10 2.99 0.00 5.73 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 F 8.30 4.67 0.00 3.36 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 0.00 142 K 8.34 4.16 0.00 1.86 1.84 0.00 1.74 0.00 0.00 0.61 0.00 0.00 3.06 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.48 1.29 7.81 143 I 7.05 4.50 1.87 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.96 1.01 0.00 0.00 144 K 8.25 4.51 0.00 1.69 1.71 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.27 1.36 7.81 145 P 0.00 4.39 0.00 1.49 1.79 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.96 0.00