NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0195 8.0544 114.0518 61.4833 32.9872 174.0636 2 H 4.6157 8.6270 122.2588 54.0044 30.9964 172.5610 3 L 4.8886 7.8768 126.6843 52.5866 45.3324 176.6306 4 T 4.0390 8.6494 113.4814 61.0073 70.7627 173.8857 5 P 4.3086 0.0000 0.0000 65.6881 31.2725 178.7963 6 E 4.0099 8.0684 116.0834 59.1783 29.6774 178.9732 7 E 3.8774 8.1623 119.6756 59.1388 29.5199 179.1701 8 K 3.8417 8.4100 120.1592 59.3136 32.2167 178.6651 9 S 4.0370 8.2063 113.3800 61.4077 62.3888 176.1703 10 A 4.0058 7.8915 123.3910 54.9462 18.1215 179.6659 11 V 3.3885 7.8290 116.8170 66.4675 31.5659 178.3663 12 T 3.9060 8.0637 115.1303 66.7046 68.1137 176.4406 13 A 4.0383 7.9060 121.2427 55.2007 18.6776 179.1472 14 L 3.9371 8.0344 118.4490 57.8800 42.1215 178.9425 15 W 4.3177 8.6550 128.5660 60.1512 30.4372 178.0471 16 G 3.7084 8.1864 104.8209 46.7502 0.0000 174.7079 17 K 4.4121 7.7833 118.6508 55.5479 32.8335 176.5981 18 V 3.6990 7.1051 120.8490 61.9273 32.1046 175.5186 19 N 4.4868 8.3366 125.5963 52.5892 39.1549 175.5458 20 V 3.5718 8.1653 128.7331 65.8687 31.6531 177.0684 21 D 4.3519 8.1998 118.9209 57.6623 40.7064 178.7336 22 E 3.9068 8.0869 118.0937 59.4595 29.6435 179.5263 23 V 3.6156 8.1365 118.8663 65.6435 31.4765 178.3914 24 G 3.6706 8.3052 106.1580 47.7238 0.0000 176.0413 25 G 3.5877 8.1097 108.4106 47.2271 0.0000 175.4967 26 E 3.8604 8.1559 121.4098 59.0190 29.7164 178.8423 27 A 3.9109 8.2336 121.1711 55.0775 18.4884 179.4299 28 L 3.9784 8.1076 119.0920 58.1373 42.1823 179.2671 29 G 3.5923 8.1560 105.7515 48.0499 0.0000 175.9060 30 R 3.9038 8.2747 120.8629 58.5122 29.9899 178.7511 31 L 4.0279 7.9908 120.3483 58.4294 42.0384 179.2366 32 L 4.0579 7.8060 119.8746 56.7260 41.2256 179.6565 33 V 3.5552 7.2792 117.7294 65.7465 31.7063 177.9644 34 V 3.5409 7.8384 117.0003 64.1730 32.8078 175.5867 35 Y 3.8403 7.3063 116.2667 54.4176 37.7723 174.2094 36 P 4.7546 0.0000 0.0000 64.0331 31.8724 178.3514 37 W 4.3299 8.0156 116.8498 59.3460 27.9881 177.6669 38 T 4.2419 7.7163 110.4712 63.8501 68.2201 175.9668 39 Q 4.4436 8.2373 121.5998 57.9145 28.4612 178.0572 40 R 3.7925 7.6621 117.0385 58.5131 29.2736 177.7303 41 F 4.4682 7.1068 115.7188 57.1997 39.5521 175.5924 42 F 4.5548 7.9589 118.4340 56.8250 39.9359 177.1289 43 E 4.0209 8.4965 122.6366 59.2620 29.4217 178.2564 44 S 4.6483 8.0792 110.7366 58.5860 63.3880 174.4053 45 F 4.6743 8.4698 119.1966 57.9915 39.8954 176.7912 46 G 3.9781 8.0498 107.1514 44.8933 0.0000 174.9611 47 D 4.5332 8.5946 126.6562 54.1321 40.9044 175.4936 48 L 4.8925 8.3305 126.3699 54.4734 43.0547 178.0911 49 S 4.3547 8.0036 115.2746 60.4663 63.6041 174.7572 50 T 4.7338 7.4423 110.0922 58.3219 73.0354 172.7469 51 P 4.2039 0.0000 0.0000 65.9678 31.4712 178.6642 52 D 4.3397 8.1125 116.9407 57.3709 40.5168 178.6725 53 A 4.0026 7.7071 120.3563 54.9027 18.7761 179.4595 54 V 3.6857 7.8834 116.8184 66.6845 31.4145 178.3279 55 M 4.2265 8.0843 116.9455 57.5933 31.8832 178.0163 56 G 3.9989 7.5962 102.7756 43.5353 0.0000 173.1718 57 N 4.4978 7.5415 121.4933 52.4907 39.3525 174.0390 58 P 4.3290 0.0000 0.0000 65.5812 31.4953 178.5887 59 K 3.7268 8.4300 118.9003 58.8271 31.7562 179.4090 60 V 3.7324 7.9205 118.3611 65.9088 31.5458 178.0868 61 K 3.9357 7.9944 117.8923 59.4184 32.0123 179.2621 62 A 3.9788 8.1601 121.2312 55.4392 18.3014 179.2296 63 H 4.3807 8.5306 116.9999 59.2045 29.8739 177.6257 64 G 3.7072 8.5252 108.1522 47.7163 0.0000 175.5728 65 K 3.9868 8.0795 121.8983 59.0477 32.2196 179.0754 66 K 3.9817 7.9743 118.5441 59.5331 32.0036 179.3938 67 V 3.6466 8.1511 118.7781 66.1236 31.4677 177.8064 68 L 4.3359 8.4786 120.1488 57.6801 41.9141 179.0421 69 G 3.7809 8.6376 106.3382 47.7461 0.0000 175.6441 70 A 4.1656 8.1014 122.3776 54.7870 18.8066 179.1209 71 F 4.3351 8.7316 119.4725 61.5508 39.5291 177.4016 72 S 4.0877 8.9403 115.2418 61.9772 62.6506 176.5759 73 D 4.5765 8.3316 120.9958 56.7731 40.4276 178.9769 74 G 3.4882 7.8803 106.4996 47.3787 0.0000 175.7247 75 L 3.7674 7.2674 119.6522 56.6922 41.6074 178.3358 76 A 4.2537 7.3054 118.9921 52.6619 19.7548 176.6002 77 H 4.8840 8.0730 115.0462 54.7650 29.7181 175.4011 78 L 3.9671 7.9302 119.4838 57.3346 41.9082 178.3445 79 D 4.6640 7.8408 116.0443 54.5677 42.0438 176.5172 80 N 5.0084 8.0461 117.7743 51.6090 40.1213 174.7859 81 L 4.0926 7.8289 122.5665 57.6096 42.2021 179.3700 82 K 4.0794 8.0641 118.2310 59.5919 31.8852 179.4940 83 G 3.6979 8.0773 104.4115 47.7726 0.0000 175.6170 84 T 3.7917 7.7658 117.3682 65.7176 68.6082 175.6895 85 F 4.7137 7.8346 116.8029 57.0662 39.3706 177.3773 86 A 4.0796 7.5932 121.8957 55.6501 18.1922 180.3937 87 T 3.8455 7.8514 113.6159 66.9149 68.6148 176.8503 88 L 4.1710 7.9729 120.3064 57.4871 41.7056 179.3624 89 S 4.2867 8.4905 113.8887 61.4854 62.3910 175.8261 90 E 3.8686 8.3347 122.0245 59.0340 29.3497 178.4382 91 L 3.9178 8.0237 120.4314 58.6519 42.1394 178.8268 92 H 4.2480 8.5300 116.0159 58.5383 28.7408 177.4102 93 C 3.5181 7.7936 120.7791 62.3836 31.1769 175.2731 94 D 4.4330 8.2129 119.5117 56.0595 40.6190 178.0488 95 K 4.2626 7.7492 116.9278 57.6268 33.5683 177.7856 96 L 4.2487 7.7589 116.9170 54.1058 42.7335 176.1515 97 H 4.1215 7.3021 113.8300 56.6530 26.5788 175.4057 98 V 3.6903 7.8879 118.7399 60.9157 32.3070 174.8416 99 D 4.3336 8.8467 127.1701 54.1654 41.5348 175.2496 100 P 3.1746 0.0000 0.0000 63.8970 31.8359 177.7831 101 E 3.8491 8.2684 119.5715 59.4219 29.1961 178.4076 102 N 4.3004 7.9590 116.3822 56.2084 38.4924 177.3175 103 F 4.4323 7.5306 119.3303 60.4850 38.9182 177.9628 104 R 3.9887 7.9516 117.4154 59.1503 29.8895 178.8721 105 L 3.8125 7.8241 118.8334 57.7161 41.5492 179.3730 106 L 4.0692 8.3418 120.6680 57.8554 41.9479 179.2101 107 G 3.6591 8.1999 105.8590 48.0162 0.0000 175.4964 108 N 4.4558 8.2393 119.3378 55.8931 38.4532 177.7744 109 V 3.6476 8.1308 119.9373 65.7749 31.5337 177.7837 110 L 3.8691 8.3423 120.6431 58.1328 41.9143 179.1340 111 V 3.5700 7.8518 118.1534 66.2528 31.3925 177.7842 112 C 4.1241 8.1085 116.4944 62.7746 27.8601 176.3206 113 V 3.5116 7.9766 120.1728 65.8431 31.0118 178.0569 114 L 3.8599 8.0615 118.9557 57.6389 41.3423 179.3545 115 A 3.7294 7.3480 120.5668 55.3217 18.0852 179.1731 116 H 4.0796 8.1041 115.9136 59.5714 29.9761 176.7539 117 H 3.9265 8.1127 119.2976 58.6628 29.8965 176.5155 118 F 4.5744 8.4248 118.2668 56.3210 39.7624 177.1415 119 G 3.8892 8.8126 108.1257 46.3797 0.0000 177.7050 120 K 4.0975 8.8324 123.3365 58.8572 32.6512 177.8746 121 E 4.0684 7.9422 120.4031 58.6585 29.9589 177.0790 122 F 4.5312 8.0805 123.1520 57.0497 37.7787 175.1906 123 T 4.2237 7.3786 115.9527 60.1362 71.4306 173.5444 124 P 4.1681 0.0000 0.0000 65.5137 31.3200 177.2524 125 P 4.2368 0.0000 0.0000 65.3018 31.2540 178.8757 126 V 3.5185 7.4050 117.3357 65.8486 31.4384 177.7072 127 Q 3.6215 7.7804 119.4232 59.2129 28.9494 178.3533 128 A 4.1147 8.0934 121.3543 54.9759 18.3628 179.5114 129 A 3.8879 7.9528 119.2510 55.6755 18.4614 179.5425 130 Y 3.9109 8.2722 115.2513 61.2301 37.9095 178.8380 131 Q 4.1794 8.8427 119.5818 58.9268 28.8011 178.9464 132 K 4.0380 8.0759 119.3633 59.2589 31.9479 179.6780 133 V 3.5186 7.6792 118.5725 66.1560 31.4547 178.6531 134 V 3.8330 8.4569 112.3675 64.2173 31.2574 178.4675 135 A 4.1203 8.2846 121.0396 54.9867 18.1800 179.9395 136 G 3.4812 8.0813 104.3770 47.8604 0.0000 176.2212 137 V 3.3512 8.1173 120.8927 65.5396 31.6187 177.9403 138 A 3.8942 8.1296 120.6385 55.3474 17.9927 179.4216 139 N 4.3299 8.2684 114.0010 56.2539 38.7461 177.2553 140 A 4.1618 8.1072 122.3625 55.1836 18.2877 179.7119 141 L 3.8793 7.7548 116.2174 57.1062 41.8491 178.6840 142 A 4.2907 7.8390 119.3828 53.4519 18.5744 178.6698 143 H 4.3490 8.0734 116.5853 58.3783 29.9866 175.7781 144 K 4.4254 8.0122 117.9632 56.2121 32.1348 176.3050 145 Y 4.1658 7.9803 117.6305 58.3965 38.4199 175.6651 146 H 4.4506 8.4086 117.7707 56.1897 28.2374 173.3021 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 V 8.05 4.02 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 0.83 0.00 0.00 0.87 0.00 0.00 2 H 8.63 4.62 0.00 3.14 3.15 0.00 5.67 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.88 4.89 0.00 1.53 1.43 0.79 0.86 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 4 T 8.65 4.04 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 1.24 0.00 0.00 5 P 0.00 4.31 0.00 2.15 2.12 0.00 3.56 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 2.09 2.11 0.00 6 E 8.07 4.01 0.00 2.14 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 2.33 2.32 0.00 7 E 8.16 3.88 0.00 2.19 1.96 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 2.29 2.27 0.00 8 K 8.41 3.84 0.00 1.70 1.74 0.00 1.55 0.00 0.00 1.49 0.00 0.00 2.81 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.35 7.81 9 S 8.21 4.04 0.00 3.99 3.99 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 0.00 0.00 0.00 10 A 7.89 4.01 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 11 V 7.83 3.39 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 0.65 0.00 0.00 0.44 0.00 0.00 12 T 8.06 3.91 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 1.25 0.00 0.00 13 A 7.91 4.04 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 14 L 8.03 3.94 0.00 1.99 1.96 0.15 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.65 4.32 0.00 3.83 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 16 G 8.19 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 17 K 7.78 4.41 0.00 1.94 2.09 0.00 1.70 0.00 0.00 1.54 0.00 0.00 3.21 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.59 7.81 18 V 7.11 3.70 1.05 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 0.05 0.00 0.00 0.68 0.00 0.00 19 N 8.34 4.49 0.00 2.71 2.58 0.00 0.00 6.85 7.71 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 20 V 8.17 3.57 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 1.26 0.00 0.00 1.00 0.00 0.00 21 D 8.20 4.35 0.00 2.88 2.68 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 22 E 8.09 3.91 0.00 1.86 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 0.00 2.33 2.23 0.00 23 V 8.14 3.62 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 0.99 0.00 0.00 0.67 0.00 0.00 24 G 8.31 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 25 G 8.11 3.59 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 0.00 0.00 0.00 26 E 8.16 3.86 0.00 2.14 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 0.00 2.25 2.40 0.00 27 A 8.23 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.11 3.98 0.00 1.75 1.63 0.84 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.16 3.59 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 0.00 0.00 0.00 30 R 8.27 3.90 0.00 1.88 1.92 0.00 3.08 0.00 0.00 3.01 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 31 L 7.99 4.03 0.00 1.87 1.88 0.98 0.51 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 32 L 7.81 4.06 0.00 1.83 1.65 0.68 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.28 3.56 1.98 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 0.71 0.00 0.00 0.93 0.00 0.00 34 V 7.84 3.54 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 -0.01 0.00 0.00 0.73 0.00 0.00 35 Y 7.31 3.84 0.00 2.60 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 36 P 0.00 4.75 0.00 2.31 2.28 0.00 3.71 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.89 0.00 37 W 8.02 4.33 0.00 3.56 3.49 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.72 4.24 4.42 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 1.13 0.00 0.00 39 Q 8.24 4.44 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 40 R 7.66 3.79 0.00 1.66 1.96 0.00 2.99 0.00 0.00 2.70 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.50 0.00 41 F 7.11 4.47 0.00 1.93 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 0.00 0.00 0.00 0.00 42 F 7.96 4.55 0.00 2.88 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 0.00 0.00 0.00 0.00 43 E 8.50 4.02 0.00 1.96 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 2.26 2.21 0.00 44 S 8.08 4.65 0.00 4.11 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 0.00 45 F 8.47 4.67 0.00 3.17 3.12 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 0.00 0.00 0.00 46 G 8.05 3.98 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 0.00 0.00 0.00 47 D 8.59 4.53 0.00 2.67 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 48 L 8.33 4.89 0.00 1.65 1.61 1.03 1.01 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 49 S 8.00 4.35 0.00 4.04 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 50 T 7.44 4.73 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 1.21 0.00 0.00 51 P 0.00 4.20 0.00 2.14 2.10 0.00 3.58 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 2.08 2.14 0.00 52 D 8.11 4.34 0.00 2.67 2.71 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 53 A 7.71 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.88 3.69 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 1.00 0.00 0.00 0.98 0.00 0.00 55 M 8.08 4.23 0.00 2.00 2.08 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.84 0.00 56 G 7.60 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 0.00 0.00 0.00 57 N 7.54 4.50 0.00 2.99 2.88 0.00 0.00 6.90 7.48 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 58 P 0.00 4.33 0.00 2.25 2.26 0.00 3.72 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 59 K 8.43 3.73 0.00 1.60 0.74 0.00 1.57 0.00 0.00 1.33 0.00 0.00 2.68 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.16 1.26 7.81 60 V 7.92 3.73 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 1.12 0.00 0.00 1.02 0.00 0.00 61 K 7.99 3.94 0.00 1.98 1.82 0.00 1.69 0.00 0.00 1.62 0.00 0.00 3.10 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.43 7.81 62 A 8.16 3.98 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 63 H 8.53 4.38 0.00 3.58 3.56 0.00 5.80 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 64 G 8.53 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 65 K 8.08 3.99 0.00 1.87 2.01 0.00 1.66 0.00 0.00 1.77 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.69 7.81 66 K 7.97 3.98 0.00 2.07 1.90 0.00 1.81 0.00 0.00 1.64 0.00 0.00 3.08 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.51 1.68 7.81 67 V 8.15 3.65 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 1.12 0.00 0.00 0.93 0.00 0.00 68 L 8.48 4.34 0.00 2.04 1.80 0.81 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.64 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 70 A 8.10 4.17 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.73 4.34 0.00 3.29 3.34 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 72 S 8.94 4.09 0.00 4.38 4.12 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 0.00 0.00 0.00 73 D 8.33 4.58 0.00 2.67 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 74 G 7.88 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.27 3.77 0.00 1.44 1.48 0.35 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.31 4.25 1.18 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 0.00 0.00 77 H 8.07 4.88 0.00 3.07 3.13 0.00 5.82 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.93 3.97 0.00 1.54 1.65 0.76 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.84 4.66 0.00 2.61 2.67 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 80 N 8.05 5.01 0.00 2.65 2.60 0.00 0.00 7.14 6.15 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 81 L 7.83 4.09 0.00 1.75 1.80 0.85 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.06 4.08 0.00 1.75 1.81 0.00 1.47 0.00 0.00 1.26 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.46 7.81 83 G 8.08 3.70 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 0.00 0.00 0.00 84 T 7.77 3.79 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 0.47 0.00 0.00 85 F 7.83 4.71 0.00 3.24 2.92 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 86 A 7.59 4.08 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.85 3.85 4.25 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 1.22 0.00 0.00 88 L 7.97 4.17 0.00 2.02 1.86 1.12 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.49 4.29 0.00 4.14 4.12 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 0.00 0.00 0.00 90 E 8.33 3.87 0.00 2.08 2.07 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 2.28 2.45 0.00 91 L 8.02 3.92 0.00 1.90 1.88 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.53 4.25 0.00 3.71 3.75 0.00 5.86 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.79 3.52 0.00 1.23 2.36 0.00 0.00 0.00 0.00 0.00 0.00 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 8.21 4.43 0.00 2.68 2.67 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 95 K 7.75 4.26 0.00 1.72 1.80 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.30 1.40 7.81 96 L 7.76 4.25 0.00 1.71 1.61 0.71 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.30 4.12 0.00 3.52 3.43 0.00 5.64 0.00 0.00 0.00 0.00 8.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.89 3.69 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 0.07 0.00 0.00 0.40 0.00 0.00 99 D 8.85 4.33 0.00 2.83 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 0.00 100 P 0.00 3.17 0.00 1.94 1.81 0.00 3.38 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.44 0.00 101 E 8.27 3.85 0.00 2.03 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 2.32 2.40 0.00 102 N 7.96 4.30 0.00 2.47 2.73 0.00 0.00 6.94 7.50 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 0.00 103 F 7.53 4.43 0.00 3.06 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 0.00 104 R 7.95 3.99 0.00 1.96 1.97 0.00 3.22 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.00 105 L 7.82 3.81 0.00 1.71 1.32 0.70 -0.00 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 0.00 106 L 8.34 4.07 0.00 1.79 1.73 0.93 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.20 3.66 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 0.00 0.00 0.00 108 N 8.24 4.46 0.00 2.80 2.95 0.00 0.00 6.71 7.67 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 0.00 109 V 8.13 3.65 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 1.14 0.00 0.00 1.16 0.00 0.00 110 L 8.34 3.87 0.00 1.74 1.79 0.90 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.85 3.57 2.34 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 1.29 0.00 0.00 1.17 0.00 0.00 112 C 8.11 4.12 0.00 3.18 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 0.00 113 V 7.98 3.51 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 1.01 0.00 0.00 0.97 0.00 0.00 114 L 8.06 3.86 0.00 0.96 1.12 0.62 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.35 3.73 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 0.00 116 H 8.10 4.08 0.00 3.16 3.44 0.00 5.78 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.11 3.93 0.00 2.93 2.71 0.00 5.99 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 0.00 118 F 8.42 4.57 0.00 3.35 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 0.00 119 G 8.81 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 0.00 0.00 0.00 120 K 8.83 4.10 0.00 1.92 2.00 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.48 7.81 121 E 7.94 4.07 0.00 2.00 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 2.34 2.28 0.00 122 F 8.08 4.53 0.00 3.04 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 0.00 123 T 7.38 4.22 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 1.30 0.00 0.00 124 P 0.00 4.17 0.00 2.16 2.14 0.00 3.58 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 2.11 2.19 0.00 125 P 0.00 4.24 0.00 2.11 2.06 0.00 3.49 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 2.08 2.11 0.00 126 V 7.40 3.52 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 0.96 0.00 0.00 0.90 0.00 0.00 127 Q 7.78 3.62 0.00 1.74 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.43 2.60 0.00 128 A 8.09 4.11 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 0.00 129 A 7.95 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 130 Y 8.27 3.91 0.00 3.45 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 0.00 131 Q 8.84 4.18 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.75 2.62 0.00 132 K 8.08 4.04 0.00 1.99 1.84 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.61 7.81 133 V 7.68 3.52 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 0.95 0.00 0.00 0.74 0.00 0.00 134 V 8.46 3.83 2.20 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 0.96 0.00 0.00 1.12 0.00 0.00 135 A 8.28 4.12 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 0.00 136 G 8.08 3.48 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 0.00 137 V 8.12 3.35 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 0.61 0.00 0.00 0.66 0.00 0.00 138 A 8.13 3.89 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 0.00 139 N 8.27 4.33 0.00 2.88 2.90 0.00 0.00 7.03 8.18 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 0.00 140 A 8.11 4.16 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 141 L 7.75 3.88 0.00 0.97 0.56 -0.01 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.84 4.29 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 H 8.07 4.35 0.00 3.30 3.54 0.00 5.75 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.01 4.43 0.00 1.83 1.82 0.00 1.74 0.00 0.00 1.79 0.00 0.00 3.01 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.51 1.69 7.81 145 Y 7.98 4.17 0.00 3.12 2.99 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 0.00 0.00 0.00 146 H 8.41 4.45 0.00 3.22 3.24 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00