NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1671 8.1727 122.0491 56.2969 34.1531 174.0627 2 V 4.5273 8.1537 126.6994 60.8758 32.1869 174.6118 3 F 4.5060 9.9616 128.9401 57.4041 40.3160 175.0516 4 E 4.2497 8.8966 120.5786 55.7776 30.8672 177.1608 5 R 3.2606 8.9352 121.7983 60.4838 29.9915 179.5536 6 C 4.3056 8.0315 115.2444 59.7505 40.2431 175.6807 7 E 3.9067 8.1224 120.5942 59.2938 29.2997 178.5370 8 L 3.5799 7.9669 120.1032 57.7899 42.0237 178.6714 9 A 3.9367 7.8629 120.7850 55.3602 18.3393 179.9135 10 R 3.8882 8.0784 116.4928 59.4974 29.9566 179.4515 11 T 3.8311 7.8490 115.6147 66.6323 68.5265 176.6926 12 L 3.8397 8.1739 121.2907 57.5481 41.5977 179.4958 13 K 3.9139 8.1523 119.6003 59.6557 31.9444 179.1485 14 R 4.0122 7.7627 117.0632 58.6863 30.0012 178.0291 15 L 4.3532 7.2939 116.6896 54.2775 41.7696 177.1047 16 G 3.8538 7.7950 107.0417 46.6730 0.0000 174.9268 17 M 3.9115 7.7567 120.7023 56.2235 32.3555 175.7788 18 D 4.5936 7.9807 118.2469 55.3828 41.2707 175.5938 19 G 3.9194 9.4019 115.3996 45.8007 0.0000 171.4332 20 Y 4.1744 8.1423 121.4523 58.6266 38.9104 176.4456 21 R 3.5797 9.0041 127.1043 57.2705 27.8674 177.1516 22 G 3.7897 8.0239 102.4809 45.7701 0.0000 173.9292 23 I 4.0910 7.6209 121.9157 59.0455 37.9323 175.8822 24 S 4.6286 8.3173 120.4184 57.6115 64.1086 174.7334 25 L 4.1795 9.2859 123.9129 58.8543 41.6799 179.5175 26 A 4.2058 8.1817 119.7770 55.2117 18.2412 179.2676 27 N 4.4512 8.2131 115.3137 56.3196 38.5525 177.6852 28 W 4.2377 8.0644 119.9193 59.9201 29.1114 178.3647 29 M 4.1575 8.3602 118.7351 58.5127 31.4749 177.8404 30 C 3.1823 8.0892 118.5909 59.2337 44.6108 175.3613 31 L 3.9617 8.1780 121.5953 58.3080 41.7951 178.8065 32 A 4.0699 8.4622 121.0345 54.8397 18.2367 179.4184 33 K 2.8623 8.3160 118.4977 59.4271 32.0468 179.1723 34 W 4.2767 7.7290 117.3305 59.2904 29.0248 178.4145 35 E 4.3322 8.3605 118.6677 58.6955 29.2497 177.8269 36 S 4.5224 7.6869 109.2368 56.7057 64.5250 174.3560 37 G 3.6151 8.3702 108.5488 46.9675 0.0000 173.4718 38 Y 3.6102 7.6247 113.4749 58.6365 35.3580 168.7091 39 N 5.2625 7.6641 119.4556 52.0665 39.8052 175.5781 40 T 4.0967 9.0235 117.1064 63.6508 69.2086 175.8884 41 R 4.5241 8.3359 120.1209 55.8486 30.7348 176.2173 42 A 4.4144 7.6930 122.1927 52.2957 19.4530 177.0859 43 T 4.9791 8.2843 110.1397 60.0931 72.4169 172.8258 44 N 4.9076 8.8961 121.7132 52.1567 42.1103 172.2436 45 Y 4.6387 8.7627 127.8794 56.9836 40.3718 174.8463 46 N 4.4891 8.4250 124.9068 51.3590 38.3688 175.3907 47 A 3.6892 8.3532 127.5731 54.8849 18.8351 179.2062 48 G 3.7450 8.0417 103.9078 47.9856 0.0000 173.6874 49 D 4.6848 7.4533 114.8427 52.0391 40.3828 176.1292 50 R 3.9137 8.0104 117.5252 57.0145 28.1344 175.8329 51 S 4.8892 7.6792 113.1533 57.3558 66.0604 172.9308 52 T 5.0700 8.8244 115.5986 61.9954 72.9901 172.7781 53 D 5.4990 8.8266 124.7168 53.0629 43.3006 175.0979 54 Y 4.9689 9.2194 120.8398 57.4362 41.9382 177.1301 55 G 4.3410 9.0608 111.4361 45.4235 0.0000 173.5938 56 I 3.7820 8.1771 116.7566 62.8362 37.8443 176.9689 57 F 4.6881 8.0241 115.6530 56.4145 39.9190 175.3225 58 Q 3.6099 7.9393 119.0245 57.1316 26.3996 173.6248 59 I 4.4086 8.4016 119.3642 60.9946 39.3523 176.7133 60 N 5.4876 9.2229 125.6193 53.3241 40.0846 175.5747 61 S 4.7434 9.0444 119.1512 59.7177 63.3616 175.2482 62 R 3.7825 8.7121 122.3526 58.6987 30.4076 177.5836 63 Y 3.9028 7.7233 115.1513 57.9936 40.0800 176.9547 64 W 4.9111 8.0671 118.6732 57.5834 31.6144 174.0663 65 C 5.6493 8.1859 112.1633 53.5774 44.5158 172.3163 66 N 4.9512 9.0770 119.2781 52.0843 40.2356 174.8005 67 D 4.7695 8.6157 123.4019 52.1748 40.4749 178.3618 68 G 4.0718 8.3762 109.2664 46.4232 0.0000 174.9145 69 K 4.3980 8.1048 116.4472 56.6996 32.9674 175.9135 70 T 4.4972 7.6514 116.8778 61.4888 68.2339 172.8339 71 P 4.2990 0.0000 0.0000 63.4406 32.0186 176.6783 72 G 3.9442 8.6502 108.5025 46.4567 0.0000 173.4656 73 A 4.4290 7.1786 119.1710 51.3819 19.2285 178.2945 74 V 4.3386 8.6543 113.6753 59.2384 35.2256 175.5681 75 N 4.9942 8.1185 118.8499 51.8116 37.6535 174.5119 76 A 4.0787 8.8630 124.9151 55.1164 19.1264 178.5066 77 C 4.3941 8.6579 111.2234 57.2758 41.0248 173.0253 78 H 4.1377 8.0243 116.4103 56.5369 26.3507 174.2866 79 L 4.8028 8.1945 117.4599 52.8505 46.4930 176.6368 80 S 4.6363 8.4131 115.7391 58.1179 63.2260 176.0164 81 C 4.1003 8.7880 124.8300 59.7194 40.2411 176.3422 82 S 3.9344 7.9233 114.9945 61.3852 61.6513 175.9304 83 A 4.0137 7.8257 122.3843 54.6697 18.0813 178.0034 84 L 4.4458 7.7343 115.8350 55.1713 41.8567 177.6296 85 L 5.3055 7.8405 117.0162 53.7319 42.3039 176.6842 86 Q 4.3925 7.7811 117.7593 55.3178 29.5735 175.9573 87 D 4.4021 8.5171 119.6956 56.9532 41.1558 176.5676 88 N 4.6202 8.0367 118.1668 53.0109 39.0571 174.5309 89 I 4.2579 8.4770 119.1890 61.1325 37.8717 177.0195 90 A 3.9390 8.6200 125.3330 55.9664 18.0926 180.1592 91 D 4.2604 8.0957 116.3974 57.5333 40.9990 178.7550 92 A 4.0751 7.9980 120.7623 55.1303 18.3697 179.7359 93 V 3.2769 8.1980 116.8809 66.0492 31.4932 178.2064 94 A 3.7942 8.1207 120.6941 55.0407 18.0384 178.8967 95 C 4.1735 8.3472 117.1134 59.7582 38.6136 175.5030 96 A 3.8743 8.2986 122.7693 55.2056 17.9286 179.7541 97 K 3.7991 7.9463 117.0807 59.4063 31.7559 179.5807 98 R 3.9097 7.3032 118.3223 59.2598 30.1046 178.2399 99 V 2.5320 7.3219 117.1465 65.9662 31.6690 178.3022 100 V 3.8011 7.7523 111.3808 63.9700 31.1165 178.3817 101 R 4.2919 7.7056 113.6736 56.2066 29.1261 175.8620 102 D 4.8443 7.6982 120.9043 53.8207 41.6986 178.4424 103 G 4.0303 7.5618 117.5501 47.0202 0.0000 174.3044 104 Q 4.2784 9.6870 118.2970 55.1889 34.2027 176.2143 105 G 3.6473 7.9323 106.5304 46.0253 0.0000 175.4159 106 I 3.4915 7.7168 118.9738 63.5662 38.0812 178.3284 107 R 4.2320 7.0268 116.8064 57.9488 30.0087 177.3563 108 A 4.0515 7.6574 120.9717 54.3237 18.4399 177.5989 109 W 4.7443 8.2853 116.3776 55.4391 29.9945 177.8101 110 V 3.7882 8.6854 117.8397 64.2774 30.8951 178.2093 111 A 4.0485 8.3302 120.3217 54.9217 18.1138 179.2609 112 W 3.9936 8.2552 126.5977 60.7547 30.6091 178.3732 113 R 3.6717 8.2465 116.2077 59.3425 29.6090 178.3903 114 N 4.3479 8.0352 115.2086 55.5898 38.6868 176.8279 115 R 4.0242 7.7950 116.5778 55.8609 31.7680 176.0858 116 C 4.5321 7.5492 115.3711 57.7486 42.5094 174.3957 117 Q 3.3305 6.4894 119.1444 57.3135 28.6331 175.5229 118 N 4.1517 8.6403 119.9321 54.0165 36.3108 173.8300 119 R 4.4004 7.4818 116.9113 54.2176 32.3991 175.7462 120 D 4.5697 8.3871 118.8695 54.0025 40.4483 175.8855 121 V 4.5399 8.2166 119.2705 61.4805 32.3804 178.5045 122 R 4.0575 8.3116 121.7745 59.2881 29.7772 178.5081 123 Q 3.9579 8.2367 117.0207 59.9045 27.9029 178.7308 124 Y 4.3267 7.7716 116.8592 59.8973 38.3054 177.0990 125 V 4.3537 7.8239 111.2571 60.4543 32.8876 175.4496 126 Q 4.1440 7.5380 118.2559 57.7201 28.3970 177.3639 127 G 3.9547 8.9318 110.1476 45.8500 0.0000 174.5743 128 C 4.3432 8.0111 116.2489 57.6178 40.5280 174.6915 129 G 3.8864 8.3147 107.0663 45.9258 0.0000 173.9139 130 V 3.9800 7.6880 117.9067 61.1204 31.8876 175.8071 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 4.17 0.00 1.72 1.72 0.00 1.27 0.00 0.00 1.20 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.83 1.09 7.81 2 V 8.15 4.53 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 0.90 0.00 0.00 0.95 0.00 0.00 3 F 9.96 4.51 0.00 2.85 2.82 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 0.00 0.00 0.00 0.00 4 E 8.90 4.25 0.00 1.93 1.86 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 2.30 2.39 0.00 5 R 8.94 3.26 0.00 1.91 1.90 0.00 3.42 0.00 0.00 3.45 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.78 0.00 6 C 8.03 4.31 0.00 2.99 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 7 E 8.12 3.91 0.00 2.06 2.24 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 2.56 2.42 0.00 8 L 7.97 3.58 0.00 1.36 1.37 -0.02 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.86 3.94 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 10 R 8.08 3.89 0.00 1.88 1.98 0.00 3.13 0.00 0.00 3.31 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 11 T 7.85 3.83 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 1.19 0.00 0.00 12 L 8.17 3.84 0.00 1.69 1.56 0.92 0.38 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 13 K 8.15 3.91 0.00 1.91 1.90 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.49 7.81 14 R 7.76 4.01 0.00 1.96 1.96 0.00 3.20 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.83 0.00 15 L 7.29 4.35 0.00 1.53 1.55 0.84 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.79 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 17 M 7.76 3.91 0.00 1.19 1.90 0.00 0.00 0.00 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.21 0.00 18 D 7.98 4.59 0.00 2.67 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 9.40 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 8.14 4.17 0.00 3.32 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 21 R 9.00 3.58 0.00 1.84 1.80 0.00 3.24 0.00 0.00 2.99 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.31 0.00 22 G 8.02 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 7.62 4.09 1.85 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.59 -0.29 0.00 0.00 24 S 8.32 4.63 0.00 4.07 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 25 L 9.29 4.18 0.00 2.02 1.82 0.98 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.18 4.21 1.53 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 0.00 0.00 0.00 27 N 8.21 4.45 0.00 2.82 2.71 0.00 0.00 6.91 7.84 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 28 W 8.06 4.24 0.00 3.58 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 M 8.36 4.16 0.00 2.20 2.37 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.95 0.00 30 C 8.09 3.18 0.00 2.66 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 31 L 8.18 3.96 0.00 1.79 1.84 0.68 -0.32 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 32 A 8.46 4.07 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 33 K 8.32 2.86 0.00 1.70 1.52 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.26 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.61 1.43 7.81 34 W 7.73 4.28 0.00 3.33 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 35 E 8.36 4.33 0.00 2.02 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 0.00 2.54 2.46 0.00 36 S 7.69 4.52 0.00 4.11 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 37 G 8.37 3.62 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 0.00 0.00 0.00 38 Y 7.62 3.61 0.00 3.25 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.66 5.26 0.00 2.68 2.81 0.00 0.00 7.01 7.84 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 40 T 9.02 4.10 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 1.48 0.00 0.00 41 R 8.34 4.52 0.00 1.94 2.03 0.00 3.19 0.00 0.00 3.24 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 42 A 7.69 4.41 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 43 T 8.28 4.98 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 1.30 0.00 0.00 44 N 8.90 4.91 0.00 2.84 2.75 0.00 0.00 6.83 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Y 8.76 4.64 0.00 2.98 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 46 N 8.43 4.49 0.00 2.68 2.61 0.00 0.00 6.53 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.35 3.69 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 48 G 8.04 3.74 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 0.00 0.00 0.00 49 D 7.45 4.68 0.00 2.70 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 50 R 8.01 3.91 0.00 2.03 2.20 0.00 3.17 0.00 0.00 3.34 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.58 0.00 51 S 7.68 4.89 0.00 3.92 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 52 T 8.82 5.07 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 0.66 0.00 0.00 53 D 8.83 5.50 0.00 2.73 2.82 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 0.00 0.00 0.00 0.00 54 Y 9.22 4.97 0.00 2.99 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 55 G 9.06 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 8.18 3.78 1.70 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 1.79 0.24 0.00 0.00 57 F 8.02 4.69 0.00 3.22 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 58 Q 7.94 3.61 0.00 2.50 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 6.82 0.00 0.00 0.00 0.00 0.00 2.52 2.70 0.00 59 I 8.40 4.41 2.14 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 1.32 1.12 1.13 0.00 0.00 60 N 9.22 5.49 0.00 3.10 3.04 0.00 0.00 6.98 7.25 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 61 S 9.04 4.74 0.00 4.08 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 0.00 62 R 8.71 3.78 0.00 1.62 1.57 0.00 2.54 0.00 0.00 2.80 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.99 0.00 63 Y 7.72 3.90 0.00 1.86 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 64 W 8.07 4.91 0.00 3.56 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 65 C 8.19 5.65 0.00 3.08 3.23 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 66 N 9.08 4.95 0.00 2.84 2.71 0.00 0.00 7.08 8.06 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 67 D 8.62 4.77 0.00 2.87 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 68 G 8.38 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 0.00 0.00 0.00 69 K 8.10 4.40 0.00 1.92 1.94 0.00 1.62 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.57 1.49 7.81 70 T 7.65 4.50 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 1.16 0.00 0.00 71 P 0.00 4.30 0.00 2.15 1.95 0.00 3.72 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 72 G 8.65 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 73 A 7.18 4.43 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 74 V 8.65 4.34 2.01 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 0.62 0.00 0.00 0.87 0.00 0.00 75 N 8.12 4.99 0.00 2.80 2.66 0.00 0.00 6.79 7.98 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 76 A 8.86 4.08 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 77 C 8.66 4.39 0.00 3.17 3.18 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 78 H 8.02 4.14 0.00 3.32 3.34 0.00 5.63 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 79 L 8.19 4.80 0.00 1.69 1.50 0.95 0.65 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 8.41 4.64 0.00 3.83 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 81 C 8.79 4.10 0.00 2.22 1.21 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 82 S 7.92 3.93 0.00 3.87 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 83 A 7.83 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 84 L 7.73 4.45 0.00 1.96 1.84 1.07 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.84 5.31 0.00 1.78 1.72 1.12 1.32 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 86 Q 7.78 4.39 0.00 2.25 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.56 7.11 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 87 D 8.52 4.40 0.00 2.65 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 88 N 8.04 4.62 0.00 2.70 2.76 0.00 0.00 6.98 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 8.48 4.26 1.84 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.80 0.95 0.00 0.00 90 A 8.62 3.94 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 91 D 8.10 4.26 0.00 2.75 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 92 A 8.00 4.08 1.46 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 93 V 8.20 3.28 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 0.74 0.00 0.00 0.86 0.00 0.00 94 A 8.12 3.79 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 8.35 4.17 0.00 3.11 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 8.30 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.95 3.80 0.00 1.66 1.43 0.00 1.22 0.00 0.00 0.68 0.00 0.00 2.21 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.30 0.90 7.81 98 R 7.30 3.91 0.00 1.74 2.12 0.00 3.42 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.90 0.00 99 V 7.32 2.53 1.86 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 -0.36 0.00 0.00 -0.52 0.00 0.00 100 V 7.75 3.80 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 1.13 0.00 0.00 1.40 0.00 0.00 101 R 7.71 4.29 0.00 2.04 2.02 0.00 3.19 0.00 0.00 3.39 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.14 0.00 102 D 7.70 4.84 0.00 3.04 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 0.00 103 G 7.56 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 0.00 104 Q 9.69 4.28 0.00 2.14 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.59 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 105 G 7.93 3.65 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 0.00 0.00 0.00 106 I 7.72 3.49 0.99 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.23 -0.36 -0.57 0.00 0.00 107 R 7.03 4.23 0.00 2.11 2.06 0.00 3.26 0.00 0.00 3.30 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.54 0.00 108 A 7.66 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.29 4.74 0.00 3.55 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 0.00 110 V 8.69 3.79 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 0.96 0.00 0.00 1.01 0.00 0.00 111 A 8.33 4.05 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 0.00 112 W 8.26 3.99 0.00 3.38 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 R 8.25 3.67 0.00 2.05 1.98 0.00 3.34 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.03 0.00 114 N 8.04 4.35 0.00 2.68 2.69 0.00 0.00 6.93 7.00 0.00 0.00 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 7.79 4.02 0.00 1.09 0.66 0.00 2.21 0.00 0.00 2.36 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.12 0.00 116 C 7.55 4.53 0.00 1.67 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 0.00 117 Q 6.49 3.33 0.00 0.93 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.62 0.00 0.00 0.00 0.00 0.00 2.12 2.22 0.00 118 N 8.64 4.15 0.00 2.80 2.83 0.00 0.00 6.96 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 7.48 4.40 0.00 1.87 1.83 0.00 3.24 0.00 0.00 3.07 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.54 0.00 120 D 8.39 4.57 0.00 2.63 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 0.00 121 V 8.22 4.54 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 0.94 0.00 0.00 1.05 0.00 0.00 122 R 8.31 4.06 0.00 1.92 2.02 0.00 3.17 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.83 0.00 123 Q 8.24 3.96 0.00 2.07 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.90 0.00 0.00 0.00 0.00 0.00 2.06 1.76 0.00 124 Y 7.77 4.33 0.00 3.12 3.18 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 0.00 125 V 7.82 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 1.05 0.00 0.00 1.05 0.00 0.00 126 Q 7.54 4.14 0.00 2.21 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.73 0.00 0.00 0.00 0.00 0.00 2.35 2.32 0.00 127 G 8.93 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 0.00 0.00 0.00 128 C 8.01 4.34 0.00 3.11 3.15 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 0.00 129 G 8.31 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 0.00 130 V 7.69 3.98 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 0.74 0.00 0.00 0.96 0.00 0.00