NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2496 8.1727 120.1301 56.8499 34.8955 173.7401 2 V 4.6225 8.0116 121.0203 60.7445 32.5472 174.7421 3 F 4.4951 9.8550 128.6568 57.5580 40.2303 174.7927 4 E 4.3531 9.3071 120.8385 55.6813 30.9947 177.0791 5 R 3.7048 9.0685 120.9114 60.6519 29.9227 179.5122 6 C 4.2892 8.0817 115.2674 59.7470 40.1054 175.5756 7 E 3.9173 8.2003 120.6060 59.3318 29.1696 178.6133 8 L 3.3975 8.1165 120.0811 57.7881 42.0686 178.5533 9 A 3.9229 7.9935 120.8696 55.4024 18.3177 179.8916 10 R 3.8871 8.3414 116.8208 59.4984 30.1080 179.4407 11 T 3.8208 7.8691 115.4844 66.7765 68.5425 176.7210 12 L 3.8598 8.0319 121.1288 57.4253 41.5366 179.6405 13 K 3.8826 8.0157 119.6479 59.5808 31.9958 178.7589 14 R 3.9221 7.7398 117.4823 59.2265 29.9569 177.3960 15 L 4.4194 7.6327 116.1564 54.0479 41.6975 176.8306 16 G 3.8448 7.8340 106.5138 47.0302 0.0000 175.4588 17 M 3.8129 7.9379 121.7971 56.7883 32.3220 175.7649 18 D 4.6922 7.9709 117.6126 56.1959 41.0332 175.7674 19 G 3.9250 9.2979 115.7177 45.3324 0.0000 171.2188 20 Y 4.3170 8.3326 122.0484 58.5417 38.7642 176.1503 21 R 3.6125 8.9835 126.6503 57.2505 27.7248 177.3181 22 G 3.7931 8.1885 103.5628 45.6879 0.0000 174.1184 23 I 3.9946 7.5703 122.0292 59.3110 37.8665 175.9030 24 S 4.6438 8.2670 120.9890 57.9231 64.9513 174.6877 25 L 4.1893 8.8806 124.7714 58.6237 41.8241 179.3564 26 A 4.1087 8.1215 120.0667 55.2620 18.3451 179.2281 27 N 4.3678 7.8821 115.0914 56.4027 38.6379 177.7572 28 W 4.2295 8.1238 120.2779 59.7858 28.9878 178.6163 29 M 4.1099 8.3750 118.8771 58.5429 31.4647 177.7512 30 C 3.2182 7.7749 118.4958 59.3025 44.0986 175.2983 31 L 3.9884 8.0594 121.4769 58.3030 41.6741 178.8366 32 A 4.0939 8.3291 120.6581 54.9308 18.2913 179.4916 33 K 3.2362 8.4557 118.2684 59.4808 32.1435 179.1504 34 W 4.3022 8.0842 117.1343 58.9831 29.0153 178.1654 35 E 4.4531 8.2804 118.5922 58.3666 29.7226 177.4479 36 S 4.5483 7.9584 109.6384 56.5750 64.5415 174.8175 37 G 3.6262 8.4136 108.8746 46.7490 0.0000 173.6083 38 Y 3.6983 7.8565 113.8652 58.4778 35.2064 168.4877 39 N 5.1573 7.9244 120.1709 52.6046 39.0735 175.8085 40 T 3.9599 9.0838 118.2126 63.8059 69.8860 175.6038 41 R 4.4690 7.9588 120.6221 55.9332 30.7814 176.1534 42 A 4.4324 7.9562 120.5558 52.0729 19.4310 177.4779 43 T 5.0703 8.3625 110.3282 59.9950 72.3551 172.6890 44 N 5.0721 8.8020 121.1494 52.1057 42.3697 172.1307 45 Y 4.9784 8.6403 125.9493 56.0870 41.7658 173.9295 46 N 4.6284 8.3094 123.7981 51.2044 39.8692 175.3906 47 A 3.7830 8.5120 128.1659 54.7342 19.0124 178.7265 48 G 3.9304 8.2112 104.5879 48.5302 0.0000 174.0471 49 D 4.7451 7.5987 115.7828 51.7457 39.8580 175.7147 50 R 3.6995 8.0258 115.5128 56.5303 28.3964 176.3382 51 S 4.7185 7.5325 112.5047 58.0188 65.3305 172.9070 52 T 5.0694 8.8822 116.3508 61.9391 72.6432 172.7289 53 D 5.4046 8.8777 125.2042 53.1716 43.1825 175.1602 54 Y 5.0067 9.0538 120.7879 57.4474 42.0955 177.3824 55 G 4.5804 9.0166 111.2790 46.1003 0.0000 173.5493 56 I 3.8966 8.3194 116.8697 62.9407 37.9202 177.4422 57 F 4.9194 8.0936 115.5881 56.4824 39.9113 175.2921 58 Q 3.5974 7.9928 119.1716 57.0917 26.4913 173.9412 59 I 4.3123 8.2437 118.9726 60.8018 39.3600 176.7228 60 N 5.3397 9.1311 126.3277 53.3183 39.7250 175.7100 61 S 4.5930 9.3992 121.3536 60.7045 63.3357 175.4719 62 R 3.8400 8.7579 122.0570 58.7165 30.4290 177.7024 63 Y 4.2687 7.9054 114.0624 57.1612 40.5443 176.4499 64 W 5.2273 8.2265 118.1913 57.0374 31.3436 173.5017 65 C 5.8759 8.0979 112.1473 53.8058 43.7815 172.7755 66 N 4.9870 8.9223 119.4907 52.4122 39.5795 174.9124 67 D 4.6926 8.9520 124.5427 52.1428 40.7599 176.3326 68 G 4.0310 8.2188 107.6958 46.3161 0.0000 174.8269 69 K 4.5399 8.3576 113.1335 56.8468 34.5519 175.4530 70 T 4.5221 7.8131 116.9135 61.0492 69.7324 172.5302 71 P 4.2539 0.0000 0.0000 63.9292 32.0518 176.2486 72 G 3.8574 8.4348 108.1253 46.6062 0.0000 172.4810 73 A 4.5895 7.6306 118.0304 50.3972 21.6497 177.3881 74 V 4.3097 8.2508 112.5029 59.4759 35.4396 176.3833 75 N 5.0111 8.1161 117.0616 52.3260 38.0777 174.6273 76 A 4.0510 9.2226 125.4301 54.5111 19.1075 178.4312 77 C 4.5061 8.3392 111.4494 57.1071 40.9894 173.0556 78 H 4.1040 7.9436 115.5798 56.6779 26.4146 174.2982 79 L 4.8417 7.5088 116.4864 52.8424 46.3144 176.3389 80 S 4.7035 8.3615 115.2434 58.0390 63.2467 176.0391 81 C 4.1699 8.8079 124.9310 59.6127 37.3897 176.6033 82 S 3.8744 7.7807 115.5791 61.2723 62.1668 176.3880 83 A 4.0927 7.8587 123.5199 54.4386 18.1996 177.9465 84 L 4.4442 7.8567 116.0851 55.1673 41.8296 177.6131 85 L 5.0378 7.7445 117.5317 54.5787 42.2286 176.5658 86 Q 4.4541 7.7881 117.5520 54.9908 29.8138 175.8777 87 D 4.4207 8.5745 120.0632 57.0522 41.1531 176.8485 88 N 4.6847 8.0168 117.5273 53.0586 39.7897 174.7298 89 I 4.3812 8.3492 118.0099 61.0151 38.1729 177.3110 90 A 3.9579 8.4052 125.3618 56.0135 18.1681 180.3230 91 D 4.3118 8.0850 116.6139 57.3381 40.9014 178.6382 92 A 4.1122 8.0074 120.9484 55.0292 18.4497 179.7249 93 V 3.3654 8.2574 116.9439 66.1913 31.6619 178.2415 94 A 3.8575 7.9343 120.4086 55.1052 18.1299 178.7620 95 C 4.2106 8.2872 117.0080 59.4901 44.8024 175.5303 96 A 3.9501 8.1683 122.8542 55.0241 17.5821 179.7532 97 K 3.7693 7.5058 116.1031 59.3833 32.3141 179.2627 98 R 4.0209 7.5906 118.5646 59.2861 30.0538 178.4625 99 V 2.1778 7.6630 118.3403 65.8420 31.2516 178.3041 100 V 3.8698 7.9535 110.7949 63.4426 31.1430 178.1112 101 R 4.1596 7.7518 117.2036 57.1343 30.5093 176.5407 102 D 4.6769 7.5658 118.9973 53.2605 41.6964 175.3727 103 P 4.2311 0.0000 0.0000 66.0390 31.4280 178.1270 104 Q 4.1343 8.1980 114.0440 56.3700 30.1041 177.1636 105 G 3.7087 7.9378 109.2728 47.4370 0.0000 176.1217 106 I 4.0244 8.0918 122.6270 62.6617 37.8802 177.6052 107 R 4.1339 7.8480 118.1086 59.1045 29.9559 177.7075 108 A 3.9537 7.8654 120.2730 53.5465 18.4623 177.4827 109 W 4.8270 8.1531 116.6277 54.1119 29.6873 176.4164 110 V 3.7335 8.4241 124.4579 64.5755 30.7895 177.8162 111 A 3.9894 8.4034 120.9835 54.7601 17.9433 179.3337 112 W 3.9517 8.4954 127.0968 60.6031 30.6260 178.0551 113 R 3.6179 8.2212 116.7568 59.6704 29.6063 177.7535 114 N 4.3446 8.1036 114.8757 55.4176 38.6493 176.7127 115 R 4.0346 7.8040 116.5415 55.7435 31.7865 175.9473 116 C 4.5514 7.1734 114.6106 57.6253 42.8127 174.2339 117 Q 3.0552 6.6164 120.1060 57.0884 28.6574 175.5117 118 N 4.2221 8.6230 120.6329 54.3058 36.1035 173.9566 119 R 4.6086 7.2597 114.9062 53.8593 33.8648 174.9320 120 D 4.4472 8.6372 119.5665 54.7220 41.3327 176.8825 121 V 4.5585 8.3298 118.9495 61.3102 32.3656 177.3946 122 R 3.9818 8.2874 120.7964 59.4895 29.6021 178.1460 123 Q 4.0658 8.1874 116.1240 59.3637 28.3812 177.9699 124 Y 4.2143 8.1729 118.1106 59.9688 38.2733 176.7153 125 V 4.3539 7.7272 110.5741 60.6997 33.6979 175.2970 126 Q 4.0837 7.9142 121.7830 57.6681 29.0899 176.6918 127 G 3.9379 8.8651 111.9641 46.3302 0.0000 174.5152 128 C 4.5012 8.1734 115.8485 56.0867 40.7693 173.7888 129 G 3.8733 8.0230 107.2673 46.9851 0.0000 174.2032 130 V 4.0047 7.9026 117.5581 61.0952 32.0626 176.0197 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 8.17 4.25 0.00 1.68 1.88 0.00 1.10 0.00 0.00 1.40 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.15 1.05 7.81 2 V 8.01 4.62 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 0.94 0.00 0.00 0.95 0.00 0.00 3 F 9.86 4.50 0.00 2.88 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 4 E 9.31 4.35 0.00 1.97 1.90 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 2.33 2.28 0.00 5 R 9.07 3.70 0.00 2.02 1.97 0.00 3.37 0.00 0.00 3.41 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.91 0.00 6 C 8.08 4.29 0.00 3.02 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 7 E 8.20 3.92 0.00 2.09 2.30 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 2.66 2.46 0.00 8 L 8.12 3.40 0.00 1.20 1.23 -0.18 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.99 3.92 1.38 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 0.00 0.00 0.00 10 R 8.34 3.89 0.00 2.02 1.99 0.00 3.14 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 11 T 7.87 3.82 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 1.16 0.00 0.00 12 L 8.03 3.86 0.00 1.57 1.58 0.88 0.56 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 13 K 8.02 3.88 0.00 1.93 1.92 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.45 7.81 14 R 7.74 3.92 0.00 1.97 2.16 0.00 3.30 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 15 L 7.63 4.42 0.00 1.54 1.55 0.86 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.83 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 17 M 7.94 3.81 0.00 1.34 1.98 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.22 0.00 18 D 7.97 4.69 0.00 2.66 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 19 G 9.30 3.92 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 0.00 20 Y 8.33 4.32 0.00 3.26 3.10 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 21 R 8.98 3.61 0.00 1.81 1.79 0.00 3.22 0.00 0.00 2.93 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.15 0.00 22 G 8.19 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 23 I 7.57 3.99 1.75 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.83 -0.58 0.00 0.00 24 S 8.27 4.64 0.00 4.09 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 25 L 8.88 4.19 0.00 1.98 1.80 0.95 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.12 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 27 N 7.88 4.37 0.00 2.66 2.64 0.00 0.00 7.01 7.52 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 28 W 8.12 4.23 0.00 3.54 3.14 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 29 M 8.37 4.11 0.00 2.18 2.29 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 2.71 2.93 0.00 30 C 7.77 3.22 0.00 2.49 3.11 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 0.00 31 L 8.06 3.99 0.00 1.82 1.86 0.89 -0.53 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 32 A 8.33 4.09 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.46 3.24 0.00 1.75 2.00 0.00 1.04 0.00 0.00 1.06 0.00 0.00 2.13 0.00 0.00 2.45 0.00 0.00 0.00 0.00 1.40 0.86 7.81 34 W 8.08 4.30 0.00 3.36 3.29 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 0.00 35 E 8.28 4.45 0.00 2.12 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 0.00 2.71 2.70 0.00 36 S 7.96 4.55 0.00 4.11 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 0.00 37 G 8.41 3.63 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 0.00 0.00 0.00 38 Y 7.86 3.70 0.00 3.23 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 39 N 7.92 5.16 0.00 2.85 2.88 0.00 0.00 6.98 7.20 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 40 T 9.08 3.96 4.48 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 1.47 0.00 0.00 41 R 7.96 4.47 0.00 1.91 1.97 0.00 3.29 0.00 0.00 3.26 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.76 0.00 42 A 7.96 4.43 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 43 T 8.36 5.07 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 1.30 0.00 0.00 44 N 8.80 5.07 0.00 2.92 2.83 0.00 0.00 6.80 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 45 Y 8.64 4.98 0.00 3.04 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 46 N 8.31 4.63 0.00 2.41 2.59 0.00 0.00 6.74 7.41 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 47 A 8.51 3.78 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 48 G 8.21 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 0.00 0.00 0.00 49 D 7.60 4.75 0.00 2.68 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 50 R 8.03 3.70 0.00 2.01 2.17 0.00 3.17 0.00 0.00 3.16 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.52 0.00 51 S 7.53 4.72 0.00 3.87 3.95 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 52 T 8.88 5.07 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 0.60 0.00 0.00 53 D 8.88 5.40 0.00 2.73 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 54 Y 9.05 5.01 0.00 2.96 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 55 G 9.02 4.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 8.32 3.90 1.75 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 1.89 0.22 0.00 0.00 57 F 8.09 4.92 0.00 3.32 3.29 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 0.00 58 Q 7.99 3.60 0.00 2.59 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.80 0.00 0.00 0.00 0.00 0.00 2.60 2.76 0.00 59 I 8.24 4.31 2.10 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.25 1.05 0.00 0.00 60 N 9.13 5.34 0.00 3.04 2.99 0.00 0.00 6.97 7.63 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 61 S 9.40 4.59 0.00 4.04 4.40 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 62 R 8.76 3.84 0.00 1.75 1.63 0.00 3.06 0.00 0.00 2.91 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.17 0.00 63 Y 7.91 4.27 0.00 1.82 1.54 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 64 W 8.23 5.23 0.00 3.49 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 65 C 8.10 5.88 0.00 3.05 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 66 N 8.92 4.99 0.00 2.88 2.72 0.00 0.00 7.09 7.82 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 67 D 8.95 4.69 0.00 2.87 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 68 G 8.22 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 69 K 8.36 4.54 0.00 1.90 1.87 0.00 1.63 0.00 0.00 1.80 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.67 1.52 7.81 70 T 7.81 4.52 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 1.17 0.00 0.00 71 P 0.00 4.25 0.00 2.15 2.05 0.00 3.91 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 1.97 1.97 0.00 72 G 8.43 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 73 A 7.63 4.59 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 74 V 8.25 4.31 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 0.60 0.00 0.00 0.91 0.00 0.00 75 N 8.12 5.01 0.00 2.78 2.63 0.00 0.00 6.79 8.57 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 A 9.22 4.05 1.35 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 77 C 8.34 4.51 0.00 3.29 3.21 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 78 H 7.94 4.10 0.00 3.35 3.35 0.00 5.60 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 7.51 4.84 0.00 1.67 1.50 0.95 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.36 4.70 0.00 3.83 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 81 C 8.81 4.17 0.00 2.16 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 82 S 7.78 3.87 0.00 4.03 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 A 7.86 4.09 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 84 L 7.86 4.44 0.00 1.93 1.82 1.04 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.74 5.04 0.00 1.82 1.71 1.15 1.19 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 86 Q 7.79 4.45 0.00 2.19 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.39 7.09 0.00 0.00 0.00 0.00 0.00 2.56 2.33 0.00 87 D 8.57 4.42 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 88 N 8.02 4.68 0.00 2.70 2.73 0.00 0.00 6.90 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 89 I 8.35 4.38 1.84 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.07 1.09 0.00 0.00 90 A 8.41 3.96 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 91 D 8.09 4.31 0.00 2.72 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 92 A 8.01 4.11 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 93 V 8.26 3.37 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 0.72 0.00 0.00 0.91 0.00 0.00 94 A 7.93 3.86 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 95 C 8.29 4.21 0.00 3.13 3.24 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 96 A 8.17 3.95 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 97 K 7.51 3.77 0.00 1.63 1.50 0.00 1.26 0.00 0.00 0.67 0.00 0.00 2.23 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.30 0.90 7.81 98 R 7.59 4.02 0.00 1.92 2.03 0.00 3.25 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.81 0.00 99 V 7.66 2.18 1.78 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 -0.17 0.00 0.00 -0.45 0.00 0.00 100 V 7.95 3.87 2.41 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 1.05 0.00 0.00 1.40 0.00 0.00 101 R 7.75 4.16 0.00 1.99 2.03 0.00 3.23 0.00 0.00 3.37 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.06 0.00 102 D 7.57 4.68 0.00 3.18 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 0.00 103 P 0.00 4.23 0.00 2.02 2.13 0.00 3.68 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 2.03 2.11 0.00 104 Q 8.20 4.13 0.00 2.22 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.87 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 105 G 7.94 3.71 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.09 4.02 1.38 0.00 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.99 0.24 0.00 0.00 107 R 7.85 4.13 0.00 2.07 2.05 0.00 3.23 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.69 0.00 108 A 7.87 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.15 4.83 0.00 3.47 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 0.00 110 V 8.42 3.73 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 0.88 0.00 0.00 0.97 0.00 0.00 111 A 8.40 3.99 1.57 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 0.00 112 W 8.50 3.95 0.00 3.38 3.39 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 0.00 113 R 8.22 3.62 0.00 1.98 2.18 0.00 3.29 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 114 N 8.10 4.34 0.00 2.57 2.67 0.00 0.00 6.93 7.22 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 0.00 115 R 7.80 4.03 0.00 1.13 0.66 0.00 2.21 0.00 0.00 2.42 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.50 0.00 116 C 7.17 4.55 0.00 2.03 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 0.00 117 Q 6.62 3.06 0.00 0.93 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.76 0.00 0.00 0.00 0.00 0.00 2.06 1.90 0.00 118 N 8.62 4.22 0.00 2.78 2.81 0.00 0.00 6.82 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 0.00 119 R 7.26 4.61 0.00 1.76 1.76 0.00 3.06 0.00 0.00 3.06 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.52 0.00 120 D 8.64 4.45 0.00 2.63 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 0.00 121 V 8.33 4.56 2.23 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 0.81 0.00 0.00 1.01 0.00 0.00 122 R 8.29 3.98 0.00 2.00 2.12 0.00 3.20 0.00 0.00 3.25 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 123 Q 8.19 4.07 0.00 2.09 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.89 0.00 0.00 0.00 0.00 0.00 2.30 2.17 0.00 124 Y 8.17 4.21 0.00 3.19 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 0.00 125 V 7.73 4.35 2.14 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 0.95 0.00 0.00 1.07 0.00 0.00 126 Q 7.91 4.08 0.00 2.17 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.02 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 127 G 8.87 3.94 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 0.00 0.00 0.00 128 C 8.17 4.50 0.00 3.11 3.14 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 0.00 129 G 8.02 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 V 7.90 4.00 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 0.79 0.00 0.00 0.96 0.00 0.00