NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0684 8.0549 120.3954 62.7207 32.6127 174.2129 2 K 4.5931 8.1400 124.0885 54.8322 36.3117 174.6533 3 C 5.0870 9.1107 117.4720 55.0584 42.7873 173.8782 4 Q 4.3803 8.3467 122.4533 54.7108 29.6870 175.3161 5 S 4.4573 8.7553 115.6244 58.3732 62.7239 172.7308 6 P 3.7852 0.0000 0.0000 61.4537 31.6405 174.0974 7 P 4.2879 0.0000 0.0000 61.6056 32.2863 175.5163 8 S 4.1250 7.9412 114.0341 57.9650 63.9729 172.0771 9 I 4.3145 7.8064 111.7532 59.6379 40.2939 172.2083 10 S 4.1360 8.7729 116.9697 59.6475 61.6153 173.6613 11 N 4.5102 8.4982 121.7135 53.3810 36.5593 173.9900 12 G 4.0594 7.8576 103.8781 44.9079 0.0000 173.2279 13 R 5.0288 8.7476 120.5827 54.7676 33.8022 174.4672 14 H 4.9687 8.1698 115.1004 55.3958 30.9559 173.6750 15 N 4.5151 8.4903 122.7077 52.5722 40.1122 174.4450 16 G 3.9827 8.3095 111.7982 45.0979 0.0000 173.4051 17 Y 5.7812 7.0382 130.1175 57.6697 42.5234 172.3347 18 E 4.7728 7.5744 116.5682 56.4785 32.1330 174.1670 19 D 4.9074 8.4076 116.2760 54.6635 43.9844 176.5036 20 F 5.0601 8.3039 115.5111 55.9826 40.9130 175.4355 21 Y 4.7147 9.6801 119.3056 58.3677 38.7429 179.2015 22 T 3.2377 8.8874 108.5093 62.1948 69.5654 172.4252 23 D 4.7058 8.5428 114.5481 53.4464 45.1729 174.3419 24 G 4.0460 8.5645 110.2077 46.1120 0.0000 173.7412 25 S 4.6475 6.9561 115.2473 57.0559 65.7507 172.7504 26 V 5.3771 7.2645 117.5321 62.2130 34.2839 173.6139 27 V 4.3676 7.9713 123.8337 61.5066 34.6549 174.1083 28 T 4.2915 8.6827 124.9179 63.2893 69.0562 173.3858 29 Y 4.7484 8.3915 125.3653 58.1706 38.3670 176.7611 30 S 4.4424 9.2592 121.3604 58.8151 64.3183 172.6787 31 C 5.3234 8.3568 117.9191 54.7366 44.8034 173.8418 32 N 4.4815 8.0534 117.3699 53.2842 39.5106 174.6965 33 S 4.1650 8.7486 118.3208 62.2919 62.8884 174.5578 34 G 4.0792 9.1332 113.3136 45.0136 0.0000 171.7496 35 Y 4.6666 8.0340 117.0501 56.0759 40.4935 175.4389 36 S 4.3677 9.8175 119.3111 57.5295 64.3123 173.0190 37 L 4.7876 8.1744 128.8885 54.2531 41.6909 175.4044 38 I 4.2032 9.2034 129.3070 61.3548 39.0516 174.9239 39 G 3.8816 8.8604 110.2443 44.0598 0.0000 173.0271 40 N 4.4957 8.4444 116.2522 53.1726 39.4716 176.3396 41 S 4.4219 8.4386 117.1199 56.2867 62.0168 174.1206 42 G 4.1683 7.4181 115.4741 45.5461 0.0000 172.1092 43 V 3.8189 8.5321 126.7579 62.8702 33.6630 174.5403 44 L 5.4223 8.5516 122.3499 52.9064 44.2582 174.0267 45 C 3.7937 7.8794 126.8245 55.3838 44.1272 172.1726 46 S 4.5829 8.4746 121.6804 59.4207 63.8450 173.0875 47 G 3.9168 8.9311 116.4372 45.3266 0.0000 172.2966 48 G 3.7979 7.8418 102.8441 45.1957 0.0000 175.2608 49 E 4.4963 7.6484 119.6828 53.6649 31.0997 174.4126 50 W 4.2408 8.4718 122.1582 57.3670 29.9782 175.7950 51 S 4.5699 8.3897 115.2448 57.5017 65.6860 171.7360 52 D 4.5512 8.5139 122.2611 54.2925 38.3756 170.9111 53 P 4.3807 0.0000 0.0000 60.7543 33.0763 175.1143 54 P 4.8210 0.0000 0.0000 62.7320 32.9612 174.9626 55 T 4.6335 9.7238 110.0648 60.2621 71.7080 172.8616 56 C 5.7990 8.0400 119.9926 54.6971 37.6921 174.0772 57 Q 5.1874 8.1201 124.9099 55.0409 32.6993 173.7290 58 I 4.4289 8.4444 123.0519 60.6916 40.0467 176.2699 59 V 4.4515 7.8478 118.8327 60.5479 32.4861 175.8455 60 K 4.3867 7.5096 119.6941 56.2222 33.0346 176.6819 61 C 5.1230 8.4287 117.2130 54.9854 46.5452 172.4520 62 P 4.5168 0.0000 0.0000 63.3707 31.7678 175.4120 63 H 5.6411 8.0696 125.9163 54.3970 31.5213 174.6146 64 P 3.6019 0.0000 0.0000 61.7510 29.0953 175.1131 65 T 4.3988 7.2383 113.1031 61.7873 71.2822 174.0844 66 I 3.6672 7.3555 119.7868 60.5450 40.3446 173.3289 67 S 4.0408 7.9511 118.1737 58.7042 61.7845 173.8161 68 N 4.1568 8.8917 128.4787 53.6784 36.0278 175.8792 69 G 4.4673 7.9811 100.3239 45.8019 0.0000 173.4617 70 Y 4.8554 8.7186 119.8768 56.8313 38.5742 174.7124 71 L 5.0094 8.2673 117.8803 53.4387 43.2665 176.4669 72 S 4.4810 7.8694 111.0595 58.3474 62.5691 173.9281 73 S 4.4537 7.5485 111.1401 57.4208 64.3291 174.2474 74 G 4.1074 7.6600 111.5341 43.3015 0.0000 171.1771 75 F 5.0465 7.9383 124.8634 57.2986 42.3362 174.5803 76 K 4.2660 6.6088 120.7384 55.0928 36.0934 177.0944 77 R 4.1068 8.4441 120.3776 59.1772 30.1609 176.9222 78 S 4.6223 6.8241 108.2039 56.8180 66.2403 172.8154 79 Y 5.0078 8.1971 121.3629 57.3123 41.6649 173.7873 80 S 5.1609 7.9792 120.1237 59.5969 65.7128 173.8401 81 Y 4.5186 9.1815 118.3746 55.9222 40.0279 173.4610 82 N 4.4592 8.6595 121.1133 52.1259 44.1948 174.8504 83 D 4.5122 6.0500 111.9936 54.7327 40.3037 169.6181 84 N 4.8498 8.1555 118.4986 53.4376 40.4127 174.1065 85 V 4.2655 9.6151 120.2284 59.4622 34.4068 174.6115 86 D 4.7994 8.3421 125.8892 53.8905 42.1832 175.3552 87 F 4.5114 9.9210 122.8767 56.4308 40.1702 175.8451 88 K 4.1687 9.3942 126.2519 54.0860 31.9873 174.0835 89 C 3.5637 8.7008 125.4431 57.3479 43.4492 172.5869 90 K 3.6375 9.4790 123.6474 60.1771 31.2358 175.9755 91 Y 4.6641 8.6068 117.7543 58.6601 42.8784 175.0382 92 G 3.8239 8.9238 112.0639 45.9247 0.0000 172.1489 93 Y 5.1986 7.2871 111.6956 57.0240 42.6272 175.7031 94 K 4.5178 9.9489 124.2681 54.6729 34.6881 175.7260 95 L 4.3270 8.5792 127.2919 54.5621 41.0724 175.7273 96 S 3.7357 10.2930 118.9893 62.5674 62.3625 172.0442 97 G 3.9800 8.1432 122.2460 43.9520 0.0000 172.3824 98 S 4.3695 7.9652 115.8101 57.1069 65.3581 174.1673 99 S 4.7481 8.8264 123.4989 59.6627 63.7193 174.0315 100 S 4.7805 8.0331 114.7970 57.4529 64.5958 173.3408 101 S 5.1527 9.1251 120.5209 56.9797 67.4346 173.2457 102 T 5.2740 9.3478 116.3313 61.3443 72.7116 173.0872 103 C 3.6568 9.1102 125.9384 56.2272 42.1696 173.3182 104 S 4.4088 8.0177 123.2570 56.5679 64.8042 171.4498 105 P 4.5288 0.0000 0.0000 63.0281 31.2670 175.7049 106 G 3.3751 10.2979 112.4054 44.4813 0.0000 170.5742 107 N 4.7986 8.4196 122.5205 53.6968 37.3019 173.4447 108 T 4.0342 6.6209 111.3990 61.3633 72.5747 172.4910 109 W 5.1007 8.5725 120.6438 55.9085 31.4810 174.1187 110 K 4.7930 8.6836 124.1775 53.7393 34.1779 174.7572 111 P 4.7200 0.0000 0.0000 61.6504 32.8710 175.2416 112 E 3.7806 8.7921 119.3521 56.4341 29.6408 176.3975 113 L 3.5670 8.5793 125.3924 54.1221 42.2645 175.2196 114 P 4.5385 0.0000 0.0000 62.4907 32.1710 175.4957 115 K 4.1963 8.2172 120.1175 54.4338 34.7212 174.3815 116 C 4.7379 8.4381 127.6932 57.4213 41.1833 172.7452 117 V 4.4286 9.5176 121.7064 59.0071 35.0804 176.4734 118 R 4.4140 8.3594 116.8824 56.9093 29.5703 175.1243 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 4.07 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 2 K 8.14 4.59 0.00 1.96 1.79 0.00 1.89 0.00 0.00 2.05 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.60 1.61 7.81 3 C 9.11 5.09 0.00 2.72 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 4 Q 8.35 4.38 0.00 1.83 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.80 0.00 0.00 0.00 0.00 0.00 1.74 1.83 0.00 5 S 8.76 4.46 0.00 3.87 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 6 P 0.00 3.79 0.00 1.73 0.49 0.00 3.87 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.40 0.00 7 P 0.00 4.29 0.00 2.07 2.01 0.00 3.43 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.90 0.00 8 S 7.94 4.12 0.00 3.83 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 I 7.81 4.31 1.85 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.11 0.74 0.93 0.00 0.00 10 S 8.77 4.14 0.00 3.88 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.50 4.51 0.00 2.61 2.23 0.00 0.00 6.26 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 12 G 7.86 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.75 5.03 0.00 1.64 1.73 0.00 3.05 0.00 0.00 3.12 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.45 0.00 14 H 8.17 4.97 0.00 2.95 2.53 0.00 5.73 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 N 8.49 4.52 0.00 2.68 2.61 0.00 0.00 6.76 7.35 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 16 G 8.31 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 17 Y 7.04 5.78 0.00 3.14 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 18 E 7.57 4.77 0.00 1.82 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.47 0.00 19 D 8.41 4.91 0.00 2.85 2.87 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 20 F 8.30 5.06 0.00 2.82 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 21 Y 9.68 4.71 0.00 3.21 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 22 T 8.89 3.24 4.28 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 1.34 0.00 0.00 23 D 8.54 4.71 0.00 2.59 2.43 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 24 G 8.56 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 25 S 6.96 4.65 0.00 3.20 4.16 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 26 V 7.26 5.38 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 0.82 0.00 0.00 0.95 0.00 0.00 27 V 7.97 4.37 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.83 0.00 0.00 28 T 8.68 4.29 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 1.21 0.00 0.00 29 Y 8.39 4.75 0.00 2.70 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 30 S 9.26 4.44 0.00 3.65 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 C 8.36 5.32 0.00 2.81 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 32 N 8.05 4.48 0.00 2.24 2.70 0.00 0.00 7.15 7.35 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 33 S 8.75 4.17 0.00 3.88 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 34 G 9.13 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 Y 8.03 4.67 0.00 3.13 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 36 S 9.82 4.37 0.00 3.91 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.17 4.79 0.00 1.60 1.41 0.93 0.95 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 38 I 9.20 4.20 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.05 1.04 0.00 0.00 39 G 8.86 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 40 N 8.44 4.50 0.00 2.70 2.87 0.00 0.00 6.98 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 S 8.44 4.42 0.00 3.97 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 42 G 7.42 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 V 8.53 3.82 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 0.84 0.00 0.00 -0.72 0.00 0.00 44 L 8.55 5.42 0.00 1.71 1.60 0.86 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 45 C 7.88 3.79 0.00 1.23 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 S 8.47 4.58 0.00 3.75 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 G 8.93 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 48 G 7.84 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.65 4.50 0.00 1.86 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.47 0.00 50 W 8.47 4.24 0.00 3.31 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 51 S 8.39 4.57 0.00 3.83 3.75 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 52 D 8.51 4.55 0.00 2.81 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 P 0.00 4.38 0.00 2.30 2.09 0.00 3.82 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 1.98 1.99 0.00 54 P 0.00 4.82 0.00 2.08 2.15 0.00 3.36 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 55 T 9.72 4.63 4.41 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 1.24 0.00 0.00 56 C 8.04 5.80 0.00 3.12 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 57 Q 8.12 5.19 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.90 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 58 I 8.44 4.43 1.75 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.17 0.59 0.00 0.00 59 V 7.85 4.45 2.22 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 0.86 0.00 0.00 0.99 0.00 0.00 60 K 7.51 4.39 0.00 1.80 1.81 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.48 1.40 7.81 61 C 8.43 5.12 0.00 2.94 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 62 P 0.00 4.52 0.00 2.36 2.19 0.00 3.76 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.00 0.00 63 H 8.07 5.64 0.00 3.48 3.53 0.00 5.72 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 64 P 0.00 3.60 0.00 1.27 0.49 0.00 3.87 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.44 0.00 65 T 7.24 4.40 4.27 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 1.27 0.00 0.00 66 I 7.36 3.67 1.46 0.00 0.00 0.56 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 0.47 1.06 0.00 0.00 67 S 7.95 4.04 0.00 3.81 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 68 N 8.89 4.16 0.00 2.79 2.78 0.00 0.00 6.71 7.96 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 69 G 7.98 4.47 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 0.00 0.00 0.00 70 Y 8.72 4.86 0.00 3.04 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 71 L 8.27 5.01 0.00 1.13 0.22 0.77 0.62 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 72 S 7.87 4.48 0.00 3.48 3.61 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 73 S 7.55 4.45 0.00 3.78 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 7.66 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 75 F 7.94 5.05 0.00 3.07 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 K 6.61 4.27 0.00 1.10 1.18 0.00 1.62 0.00 0.00 1.49 0.00 0.00 2.88 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.25 1.26 7.81 77 R 8.44 4.11 0.00 1.74 1.97 0.00 3.20 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.74 0.00 78 S 6.82 4.62 0.00 3.70 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 79 Y 8.20 5.01 0.00 2.77 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 80 S 7.98 5.16 0.00 3.95 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 81 Y 9.18 4.52 0.00 2.97 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 82 N 8.66 4.46 0.00 2.96 2.49 0.00 0.00 7.16 8.15 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 83 D 6.05 4.51 0.00 3.03 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 84 N 8.16 4.85 0.00 2.83 2.75 0.00 0.00 7.15 7.74 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 85 V 9.62 4.27 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 0.76 0.00 0.00 -0.06 0.00 0.00 86 D 8.34 4.80 0.00 2.44 2.46 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 87 F 9.92 4.51 0.00 2.96 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 88 K 9.39 4.17 0.00 1.19 0.92 0.00 1.67 0.00 0.00 1.47 0.00 0.00 2.82 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.16 1.15 7.81 89 C 8.70 3.56 0.00 3.03 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 90 K 9.48 3.64 0.00 1.98 1.98 0.00 1.89 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.61 1.56 7.81 91 Y 8.61 4.66 0.00 3.06 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 92 G 8.92 3.82 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 0.00 93 Y 7.29 5.20 0.00 2.93 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 94 K 9.95 4.52 0.00 1.87 1.68 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.41 7.81 95 L 8.58 4.33 0.00 1.57 1.60 1.01 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 96 S 10.29 3.74 0.00 3.89 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 97 G 8.14 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 98 S 7.97 4.37 0.00 3.82 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 S 8.83 4.75 0.00 3.85 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 0.00 100 S 8.03 4.78 0.00 3.92 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 0.00 101 S 9.13 5.15 0.00 4.12 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 0.00 102 T 9.35 5.27 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 1.30 0.00 0.00 103 C 9.11 3.66 0.00 1.23 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 0.00 104 S 8.02 4.41 0.00 3.68 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 0.00 105 P 0.00 4.53 0.00 2.17 2.32 0.00 3.65 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.28 0.00 106 G 10.30 3.38 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 0.00 107 N 8.42 4.80 0.00 2.88 2.85 0.00 0.00 6.99 7.07 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 0.00 108 T 6.62 4.03 4.19 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 1.20 0.00 0.00 109 W 8.57 5.10 0.00 3.17 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 0.00 110 K 8.68 4.79 0.00 1.70 1.71 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.31 7.81 111 P 0.00 4.72 0.00 2.09 2.10 0.00 4.01 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.99 0.00 112 E 8.79 3.78 0.00 1.92 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.43 0.00 113 L 8.58 3.57 0.00 1.53 1.31 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 114 P 0.00 4.54 0.00 1.86 2.02 0.00 2.20 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.69 0.00 115 K 8.22 4.20 0.00 1.75 1.73 0.00 1.57 0.00 0.00 1.52 0.00 0.00 2.71 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.24 1.25 7.81 116 C 8.44 4.74 0.00 3.10 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 0.00 117 V 9.52 4.43 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 0.67 0.00 0.00 1.08 0.00 0.00 118 R 8.36 4.41 0.00 2.02 2.36 0.00 3.24 0.00 0.00 3.36 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00