NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4871 8.3349 115.2901 57.2075 65.1995 174.5565 2 V 4.0976 7.5081 111.3290 60.6049 33.8480 176.0673 3 G 3.9706 8.8020 114.0415 44.9942 0.0000 172.9503 4 T 4.4357 7.4764 110.7165 61.8110 68.0525 174.1414 5 S 4.1361 7.9173 114.4374 58.4548 63.2921 170.3108 6 C 3.9588 8.6297 125.2599 56.2863 38.0455 173.5958 7 I 4.1768 7.9917 125.5368 60.1452 38.9532 172.9836 8 P 4.5137 0.0000 0.0000 63.6084 30.0204 178.1447 9 G 3.9107 8.8728 110.6113 47.4310 0.0000 173.2697 10 M 4.3961 7.9044 119.2524 54.8363 33.4952 174.2367 11 A 4.3351 9.2400 129.8760 51.9663 17.5465 178.2951 12 I 4.4643 6.9061 115.4650 58.6105 37.2097 173.3298 13 P 4.7807 0.0000 0.0000 61.8135 32.6469 176.7835 14 H 4.2002 8.2842 115.5940 56.8565 29.6007 174.7601 15 N 4.1070 8.6354 118.5172 53.9791 36.2792 172.0274 16 P 4.5033 0.0000 0.0000 63.0249 33.3669 175.8981 17 L 3.7162 8.4563 116.0269 55.9212 39.5716 176.9200 18 D 4.3613 8.0993 119.7845 56.7545 39.7855 177.2981 19 S 4.3128 8.0921 114.0409 61.1310 62.3501 175.5209 20 C 4.5465 8.1464 119.4193 59.5465 34.2590 175.8760 21 R 3.7798 7.7688 117.4147 59.3750 29.0865 179.2030 22 W 4.4847 7.9241 121.5582 58.4815 29.0181 177.9614 23 Y 4.1896 8.1665 119.8272 60.3908 38.1475 178.1413 24 V 2.8281 7.5716 119.4590 65.6092 31.0817 178.0395 25 S 4.1052 7.7436 114.4800 61.9440 62.6988 177.0136 26 T 4.6037 7.7536 119.4175 66.1338 68.1895 177.2264 27 R 3.7238 7.2996 119.0124 58.8058 29.9226 177.5904 28 T 4.2306 7.4281 108.5638 63.1158 70.0331 174.8486 29 C 4.5875 8.0986 117.7403 54.9817 40.5512 174.6958 30 G 3.8799 7.9011 106.6833 46.2008 0.0000 173.8678 31 V 4.2180 8.2961 117.3405 60.5713 33.7736 174.6953 32 G 4.1406 8.4494 108.9403 42.0582 0.0000 170.9474 33 P 4.1728 0.0000 0.0000 62.4140 31.6494 177.0775 34 R 4.2830 7.9776 116.0077 54.5885 28.1238 175.1486 35 L 4.5032 7.6031 124.7926 55.2199 43.7419 175.6861 36 A 4.6192 8.2565 120.6791 51.5416 20.7926 178.5087 37 T 4.2975 8.4129 110.2579 65.0988 69.3883 177.0930 38 Q 4.0067 8.2534 121.0990 58.6485 28.1829 178.7710 39 E 3.9331 8.0905 120.0296 59.3269 29.6711 178.5451 40 M 3.9585 7.6423 116.7756 58.6563 32.5174 177.9731 41 K 3.3554 7.7284 119.4637 59.4524 32.1856 178.4293 42 A 3.9570 7.8631 120.8333 55.1200 18.2776 179.5918 43 R 3.8651 7.8711 117.2436 59.7410 30.1348 178.1830 44 C 4.3643 8.0641 116.4929 60.1262 37.2367 175.4183 45 C 4.1996 8.0509 118.0582 59.7600 36.3574 176.0725 46 R 3.8082 7.9891 120.5480 59.3620 29.6767 178.4649 47 Q 4.1093 8.1380 117.7832 58.1472 28.5047 178.2611 48 L 3.9112 7.6549 121.1463 58.1195 42.2621 178.2341 49 E 4.0768 7.9946 117.7919 58.9745 29.7005 177.8251 50 A 4.3402 7.7572 120.0300 54.1054 18.4801 177.4478 51 I 4.0541 7.3953 118.7944 59.3394 36.4503 174.1992 52 P 4.4046 0.0000 0.0000 62.2012 32.1002 177.2789 53 A 3.8984 8.8117 123.0060 55.4812 18.3127 177.2200 54 Y 4.0066 7.5857 112.5455 59.2257 37.5537 175.3367 55 C 4.0324 9.0544 121.1577 56.9160 35.6813 174.8421 56 R 3.8400 8.0610 118.2039 59.2919 29.1561 178.0754 57 C 3.8303 8.9927 115.0413 59.9700 40.2136 175.8791 58 E 3.8139 8.0369 120.0065 59.5308 28.8120 178.6753 59 A 3.9559 7.6017 118.9844 55.4935 18.6362 179.1580 60 V 3.6796 7.6803 116.2720 66.2999 31.4076 178.0989 61 R 3.8321 7.9546 117.4928 59.7542 30.0254 178.2092 62 I 3.6867 7.6806 119.3930 64.3507 36.9769 178.1097 63 L 3.9934 7.8047 121.2625 57.9428 41.7258 178.5506 64 M 3.9459 7.7203 116.6562 58.8688 32.5938 176.9885 65 D 4.3869 8.3337 117.6693 54.9182 41.5112 177.7381 66 G 4.6285 8.2396 104.4662 44.6923 0.0000 172.6145 67 V 4.5307 7.8601 119.9926 59.5982 34.8028 174.5516 68 V 4.7754 8.2494 120.6431 61.3284 34.4093 174.3856 69 T 4.7201 8.2806 114.2116 59.5677 71.4823 175.1701 70 S 4.1566 8.8125 117.0774 61.2847 62.5833 175.6432 71 S 4.1606 7.9258 113.5803 59.6956 63.0621 174.9297 72 G 4.0238 8.2045 109.4106 45.1672 0.0000 172.9601 73 Q 4.7521 8.0476 118.2881 54.4972 31.4030 174.3862 74 H 5.4548 8.6880 117.3636 54.6549 32.1878 173.0691 75 E 4.4595 8.6141 118.7816 56.0050 34.5662 175.4655 76 G 3.7064 9.1890 107.5906 46.3303 0.0000 174.7749 77 R 4.4554 8.5399 123.2532 56.3691 28.6052 177.6624 78 L 4.0932 7.3658 115.1138 55.6474 41.8448 176.9758 79 L 3.9786 7.7165 119.9996 55.4204 40.3230 175.1472 80 Q 4.5415 7.7903 122.7645 53.3288 32.8007 175.0273 81 D 4.6213 8.4166 118.4944 54.0643 40.0532 176.8065 82 L 4.2677 8.3992 125.5259 52.8836 42.5325 175.3443 83 P 4.4431 0.0000 0.0000 66.1882 29.8805 176.4082 84 G 4.0159 9.5637 112.2109 45.5231 0.0000 173.0016 85 C 4.7407 8.1574 117.3404 54.2148 37.8391 171.9916 86 P 4.9140 0.0000 0.0000 61.7442 32.2175 178.0095 87 R 3.9327 8.5916 118.1182 59.7008 29.8170 179.3564 88 Q 3.9759 8.0309 117.2941 59.0534 28.7737 178.9216 89 V 3.6375 7.7605 119.1093 66.1207 31.6101 178.1438 90 Q 4.1074 8.0439 117.2490 58.6979 28.3178 178.4364 91 R 4.0014 7.7737 119.1408 58.8876 30.1865 178.0801 92 A 4.1355 7.7014 119.9733 55.1779 18.5587 179.1170 93 F 4.1638 8.2375 117.4449 60.4054 39.5016 176.8780 94 A 4.2680 7.8202 120.6776 55.1259 18.4670 176.2052 95 P 4.3349 0.0000 0.0000 63.1644 32.8974 176.9079 96 K 3.9134 8.5684 116.7081 57.4377 28.9754 176.7822 97 L 3.9902 6.6185 121.8191 57.5178 42.5524 178.4415 98 V 3.7824 7.6006 110.1849 62.7463 32.1632 176.5227 99 T 4.7014 7.3888 111.4819 60.1902 70.1504 175.1613 100 E 4.3411 8.5332 118.6070 57.5174 29.1686 178.0690 101 V 4.0043 7.3889 117.8555 63.1523 31.5785 175.4322 102 E 4.6252 7.6247 117.1183 57.3723 32.3140 174.2678 103 C 4.9676 7.7695 118.8296 55.9204 40.5033 175.7223 104 N 4.6897 8.4785 117.6275 55.8463 36.9408 176.1114 105 L 3.4416 8.8712 115.5872 53.8666 39.6924 171.0043 106 A 3.6927 7.5205 126.7269 51.6453 19.6675 178.4553 107 T 4.7580 7.1206 111.5957 60.0425 71.1948 174.5801 108 I 3.3952 8.0737 119.4967 64.8175 37.9307 177.6005 109 H 4.1613 8.0596 115.7098 55.8595 28.3770 175.8125 110 G 4.0527 7.6688 107.4272 45.6554 0.0000 173.4622 111 G 3.9778 6.8433 106.9469 43.4722 0.0000 172.4603 112 P 4.6906 0.0000 0.0000 59.3245 29.5271 175.3339 113 F 4.6813 6.8924 119.8351 58.0751 39.6972 172.6563 114 C 4.6773 8.8477 114.3328 55.0072 41.0532 174.6132 115 L 3.3426 8.9713 121.0904 55.6538 40.4214 174.6144 116 S 3.7657 8.7558 109.4644 59.3329 62.3451 174.5095 117 L 4.2829 7.2505 120.7038 55.0109 41.4487 177.7527 118 L 3.8177 8.5901 119.7611 57.8158 42.0952 177.8219 119 G 3.9734 7.7036 106.6833 46.9677 0.0000 173.3372 120 A 3.6540 7.6117 124.1578 53.3809 15.6661 177.6949 121 G 4.1148 7.8349 105.7254 44.6774 0.0000 171.7846 122 E 4.2140 8.1368 124.9104 56.1548 29.6806 176.2630 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 S 8.33 4.49 0.00 3.85 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 2 V 7.51 4.10 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.94 0.00 0.00 3 G 8.80 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 T 7.48 4.44 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 5 S 7.92 4.14 0.00 4.02 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 6 C 8.63 3.96 0.00 3.17 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 7 I 7.99 4.18 2.09 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.00 0.90 0.00 0.00 8 P 0.00 4.51 0.00 2.11 1.98 0.00 3.89 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.91 0.00 9 G 8.87 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 10 M 7.90 4.40 0.00 2.00 1.98 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 2.53 2.44 0.00 11 A 9.24 4.34 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 12 I 6.91 4.46 2.02 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.07 0.90 0.00 0.00 13 P 0.00 4.78 0.00 2.19 2.07 0.00 3.76 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 14 H 8.28 4.20 0.00 3.23 3.37 0.00 5.83 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 15 N 8.64 4.11 0.00 2.86 2.89 0.00 0.00 7.11 7.72 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 16 P 0.00 4.50 0.00 2.23 2.03 0.00 3.98 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 17 L 8.46 3.72 0.00 1.88 1.79 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 18 D 8.10 4.36 0.00 3.03 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.09 4.31 0.00 3.98 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 20 C 8.15 4.55 0.00 3.26 3.28 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 21 R 7.77 3.78 0.00 1.85 2.26 0.00 2.43 0.00 0.00 2.93 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.86 0.00 22 W 7.92 4.48 0.00 3.52 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 23 Y 8.17 4.19 0.00 3.27 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 24 V 7.57 2.83 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 0.72 0.00 0.00 0.72 0.00 0.00 25 S 7.74 4.11 0.00 4.49 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 26 T 7.75 4.60 4.11 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 1.15 0.00 0.00 27 R 7.30 3.72 0.00 0.86 1.33 0.00 3.03 0.00 0.00 3.36 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.48 0.00 28 T 7.43 4.23 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 1.01 0.00 0.00 29 C 8.10 4.59 0.00 3.03 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 30 G 7.90 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 V 8.30 4.22 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 0.97 0.00 0.00 0.96 0.00 0.00 32 G 8.45 4.14 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 0.00 33 P 0.00 4.17 0.00 2.00 1.74 0.00 3.46 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.45 0.00 34 R 7.98 4.28 0.00 1.90 1.96 0.00 2.97 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.55 0.00 35 L 7.60 4.50 0.00 1.71 1.65 0.95 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 36 A 8.26 4.62 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 37 T 8.41 4.30 4.53 0.00 0.00 0.00 0.00 0.00 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 38 Q 8.25 4.01 0.00 2.30 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.99 0.00 0.00 0.00 0.00 0.00 2.44 2.48 0.00 39 E 8.09 3.93 0.00 2.17 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 2.41 2.31 0.00 40 M 7.64 3.96 0.00 2.30 2.20 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.85 0.00 41 K 7.73 3.36 0.00 1.07 1.56 0.00 1.66 0.00 0.00 1.55 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.30 1.21 7.81 42 A 7.86 3.96 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 43 R 7.87 3.87 0.00 1.96 2.16 0.00 3.16 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.74 0.00 44 C 8.06 4.36 0.00 3.15 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 45 C 8.05 4.20 0.00 3.13 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 46 R 7.99 3.81 0.00 1.94 2.00 0.00 3.13 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 47 Q 8.14 4.11 0.00 2.29 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.52 0.00 48 L 7.65 3.91 0.00 1.86 1.81 0.97 0.76 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 49 E 7.99 4.08 0.00 2.02 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 50 A 7.76 4.34 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 51 I 7.40 4.05 2.05 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.69 0.92 0.00 0.00 52 P 0.00 4.40 0.00 2.39 2.25 0.00 3.75 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.99 0.00 53 A 8.81 3.90 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 7.59 4.01 0.00 3.01 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 C 9.05 4.03 0.00 3.21 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 R 8.06 3.84 0.00 1.94 1.73 0.00 3.20 0.00 0.00 3.33 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 57 C 8.99 3.83 0.00 3.03 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 58 E 8.04 3.81 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 59 A 7.60 3.96 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 60 V 7.68 3.68 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 0.95 0.00 0.00 0.94 0.00 0.00 61 R 7.95 3.83 0.00 1.96 2.07 0.00 3.30 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 62 I 7.68 3.69 2.09 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.65 0.94 0.00 0.00 63 L 7.80 3.99 0.00 1.78 1.82 0.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 64 M 7.72 3.95 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.62 0.00 65 D 8.33 4.39 0.00 2.69 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 66 G 8.24 4.63 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 67 V 7.86 4.53 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 0.82 0.00 0.00 0.93 0.00 0.00 68 V 8.25 4.78 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 0.78 0.00 0.00 0.51 0.00 0.00 69 T 8.28 4.72 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 70 S 8.81 4.16 0.00 3.86 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 71 S 7.93 4.16 0.00 4.01 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 72 G 8.20 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 0.00 0.00 0.00 73 Q 8.05 4.75 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.37 6.64 0.00 0.00 0.00 0.00 0.00 2.30 2.45 0.00 74 H 8.69 5.45 0.00 2.97 3.19 0.00 5.69 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 E 8.61 4.46 0.00 1.92 1.84 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 2.23 2.25 0.00 76 G 9.19 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 77 R 8.54 4.46 0.00 1.94 1.98 0.00 3.26 0.00 0.00 3.90 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 78 L 7.37 4.09 0.00 1.70 1.61 0.90 0.87 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 L 7.72 3.98 0.00 1.57 1.61 0.92 0.64 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 80 Q 7.79 4.54 0.00 1.98 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.92 0.00 0.00 0.00 0.00 0.00 2.22 2.25 0.00 81 D 8.42 4.62 0.00 2.64 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 82 L 8.40 4.27 0.00 1.71 1.65 0.69 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 83 P 0.00 4.44 0.00 2.20 2.14 0.00 3.80 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.01 0.00 84 G 9.56 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 0.00 0.00 0.00 85 C 8.16 4.74 0.00 2.93 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 86 P 0.00 4.91 0.00 2.21 2.18 0.00 3.72 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 2.07 1.98 0.00 87 R 8.59 3.93 0.00 1.91 2.05 0.00 3.23 0.00 0.00 3.15 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.76 0.00 88 Q 8.03 3.98 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.92 0.00 0.00 0.00 0.00 0.00 2.45 2.49 0.00 89 V 7.76 3.64 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 0.98 0.00 0.00 0.93 0.00 0.00 90 Q 8.04 4.11 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.70 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 91 R 7.77 4.00 0.00 2.04 1.96 0.00 3.32 0.00 0.00 3.23 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 92 A 7.70 4.14 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 93 F 8.24 4.16 0.00 3.12 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 94 A 7.82 4.27 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 95 P 0.00 4.33 0.00 2.17 2.20 0.00 3.81 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 1.96 0.00 96 K 8.57 3.91 0.00 1.69 1.84 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.26 1.29 7.81 97 L 6.62 3.99 0.00 1.70 1.48 0.97 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.60 3.78 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 0.76 0.00 0.00 0.91 0.00 0.00 99 T 7.39 4.70 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 1.21 0.00 0.00 100 E 8.53 4.34 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.21 0.00 101 V 7.39 4.00 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 0.68 0.00 0.00 0.91 0.00 0.00 102 E 7.62 4.63 0.00 2.02 1.74 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 2.24 2.33 0.00 103 C 7.77 4.97 0.00 2.97 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 0.00 104 N 8.48 4.69 0.00 2.78 3.14 0.00 0.00 6.90 6.76 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 0.00 105 L 8.87 3.44 0.00 1.82 1.72 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 106 A 7.52 3.69 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 T 7.12 4.76 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 1.14 0.00 0.00 108 I 8.07 3.40 1.36 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.33 0.56 0.00 0.00 109 H 8.06 4.16 0.00 2.63 2.87 0.00 5.82 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 G 7.67 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 0.00 111 G 6.84 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 0.00 112 P 0.00 4.69 0.00 2.26 2.11 0.00 4.04 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 2.11 2.00 0.00 113 F 6.89 4.68 0.00 3.09 3.05 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 0.00 114 C 8.85 4.68 0.00 3.07 3.02 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 0.00 115 L 8.97 3.34 0.00 1.87 1.72 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.76 3.77 0.00 4.05 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 0.00 117 L 7.25 4.28 0.00 1.72 1.66 0.91 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 118 L 8.59 3.82 0.00 1.62 1.76 0.91 0.90 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 0.00 119 G 7.70 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 A 7.61 3.65 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 0.00 121 G 7.83 4.11 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 0.00 0.00 0.00 122 E 8.14 4.21 0.00 1.98 1.87 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 2.27 2.30 0.00