NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 18 Q 4.2037 8.2033 121.7048 55.7090 30.5467 175.6838 19 M 3.4973 8.4020 122.6501 57.7313 31.7333 175.6046 20 E 3.8904 8.6830 120.1768 59.6455 30.2529 178.4731 21 T 3.9544 7.8073 115.1889 66.8956 68.5061 176.6886 22 S 4.1982 8.5892 117.5155 61.4931 62.7472 175.9155 23 Y 4.1544 8.4172 122.6608 60.9612 38.4868 178.5911 24 V 3.5356 8.2303 119.0900 66.0547 31.6362 178.1432 25 S 4.2320 8.3725 115.0386 61.4285 62.6041 176.4418 26 L 4.0793 8.2732 123.1753 58.0909 41.8379 178.6643 27 K 3.6813 7.9914 119.7712 59.9208 31.7674 178.7856 28 T 3.8433 7.9246 114.6451 66.3615 68.8687 176.1559 29 W 4.1693 8.1930 130.2071 60.6224 30.4937 177.9652 30 I 3.2434 8.4908 120.3229 64.3544 36.2989 178.2418 31 E 3.9645 8.2355 118.3514 58.4684 29.3665 177.9357 32 D 4.6396 7.2877 116.7407 53.4214 41.3965 176.3977 33 S 4.2910 6.7920 115.4073 56.3368 64.7720 173.4551 34 L 4.0513 8.1617 121.9928 54.5610 42.7795 176.7155 35 D 4.2358 8.7739 124.5020 57.6530 40.7349 178.2891 36 L 3.7163 7.5987 119.1223 57.9223 42.1129 178.0949 37 F 4.8589 7.8352 116.7895 59.0237 39.6081 177.8971 38 K 3.8443 8.0331 118.9988 59.4526 31.6579 177.8121 39 N 4.2507 7.7946 116.3837 56.7416 38.8963 175.4270 40 D 4.6651 8.0590 115.5740 56.1664 41.6446 177.9562 41 L 4.4123 7.8532 119.1988 57.0264 41.8195 178.9894 42 L 4.0530 8.2957 119.4742 57.3489 41.4434 177.5928 43 P 4.5293 0.0000 0.0000 64.6521 31.2198 178.1785 44 L 4.0646 7.9629 119.8891 57.9425 41.9820 178.6249 45 L 4.2361 8.1278 119.2930 57.9110 41.5117 178.6211 46 Y 3.7824 7.7736 119.3596 60.2424 38.7938 176.5360 47 P 3.9693 0.0000 0.0000 65.4330 31.3912 177.9740 48 L 4.0605 7.8834 119.8243 58.0499 42.0798 178.5585 49 F 4.1489 8.9303 120.8409 61.5655 39.1813 177.2285 50 I 2.9205 7.4651 119.1243 64.3983 36.6708 178.2078 51 H 4.1909 8.1780 117.0481 58.8656 28.4104 178.0244 52 I 3.6689 7.8972 121.7683 64.2422 36.8504 177.5957 53 Y 4.1415 7.6701 120.3366 61.0389 38.5542 178.3694 54 F 4.3685 8.0707 118.5685 60.6766 38.9696 177.5646 55 D 4.3759 8.4045 118.6879 57.2798 40.5500 178.7160 56 L 3.9054 8.0843 119.7999 57.7356 41.5837 179.5400 57 I 3.5710 7.5536 119.6953 64.5667 36.8538 178.3212 58 Q 3.9935 8.0718 119.0741 58.7430 28.8185 177.1888 59 Q 4.3718 7.7548 117.1418 54.7584 28.9967 175.1359 60 N 4.1896 7.9651 115.7948 54.6454 37.3224 175.4903 61 K 4.5214 7.7864 116.0645 55.3202 31.7552 177.4041 62 T 3.8409 7.7338 119.5653 66.6577 68.9790 176.0033 63 D 4.3320 7.9850 120.3306 57.4489 40.9054 178.5783 64 E 4.0470 8.1679 118.4364 59.0643 29.4493 179.0292 65 A 4.1858 7.9807 120.8840 55.2759 18.4862 179.9147 66 K 4.1706 8.3741 117.1203 59.4459 32.0195 179.2284 67 E 3.9852 8.4509 119.7409 59.1986 29.5657 178.6296 68 F 4.2660 8.5173 120.6071 61.3279 39.6192 176.5705 69 F 3.7861 8.5984 120.3178 61.6469 38.9397 177.0910 70 E 4.1107 8.3739 116.4219 59.0407 29.2589 178.9648 71 K 3.9486 7.5416 119.0669 58.3395 32.3793 176.9153 72 Y 4.7362 7.4795 114.0711 57.2388 39.3801 177.4901 73 R 3.3151 7.7949 118.8552 58.7163 29.5397 179.2614 74 G 3.6185 7.7642 106.4326 47.9632 0.0000 174.3927 75 D 4.4175 7.5420 119.0255 56.6454 41.3753 176.3717 76 H 5.0295 7.5207 116.8908 54.4310 29.2879 175.2728 77 Y 4.3031 8.2789 119.9352 60.1504 37.9627 178.4945 78 N 4.1422 7.0041 116.0265 54.3910 37.5653 175.3451 79 K 4.4489 8.0074 119.5929 55.7080 33.1244 178.3098 80 S 4.1537 7.8653 117.6316 61.7769 62.4177 175.6767 81 E 3.9269 8.0167 120.6777 59.1671 29.5320 178.7190 82 E 3.9466 7.9657 117.9519 59.2845 29.9378 178.9823 83 I 4.1586 8.4553 120.1688 64.4964 36.9086 178.3748 84 K 4.3829 7.9217 120.9900 58.9467 32.0297 178.6462 85 Q 3.9408 7.6067 117.9531 58.5504 28.8151 177.9844 86 F 4.8595 7.8450 118.0488 59.4189 39.1481 177.4144 87 E 3.3492 8.3493 116.7880 58.5047 29.3741 178.4232 88 S 4.1806 7.8181 111.6814 58.1169 63.7978 173.7951 89 I 4.0994 7.6881 123.6458 61.1694 37.3839 175.1581 90 Y 4.9910 8.8285 121.5867 57.6091 40.7009 175.8038 91 T 4.7243 7.4591 108.4522 59.0120 73.4538 175.0440 92 V 3.5899 8.1442 114.0801 64.3106 31.3997 178.7381 93 Q 3.9156 7.8996 119.1243 59.5362 29.0040 177.5208 94 H 4.2874 7.8217 117.3563 59.0646 28.4483 177.8425 95 I 3.5943 7.4493 120.6674 64.5507 36.9712 177.6544 96 H 4.3010 7.8832 117.9329 59.3170 29.7869 176.8563 97 E 4.1892 8.5104 119.8936 57.6567 29.4418 176.6929 98 N 4.7699 7.6438 118.4161 52.1000 39.7542 175.0983 99 N 4.3978 8.7637 124.7079 56.6898 38.5840 176.6673 100 F 4.2478 8.5547 119.2176 60.3301 38.8511 177.4335 101 A 4.7174 8.5330 120.2604 55.1473 18.4982 178.8314 102 Y 3.9865 7.9056 118.4440 61.2423 39.0291 178.5452 103 T 3.9362 8.3978 110.5796 64.4366 68.5928 176.3273 104 F 4.1344 8.0125 122.2176 61.1805 39.6154 176.8433 105 K 4.3154 8.4461 118.2751 59.1336 31.9966 178.1497 106 N 4.4880 7.6064 115.6814 55.1930 39.2123 175.7887 107 S 4.5223 7.6124 112.7833 57.1937 64.9216 172.9688 108 K 4.5605 8.2175 119.1672 55.7794 33.4275 175.8727 109 Y 4.4601 8.7701 125.3579 56.4086 40.6622 173.8588 110 H 5.3052 8.0649 123.7536 54.5882 30.4359 174.3390 111 L 5.0699 8.8889 121.9358 52.9654 46.2779 175.2771 112 S 5.3022 8.5716 114.2240 56.9699 65.2239 172.7816 113 M 5.1029 8.8057 122.5973 53.8026 34.9831 174.6243 114 G 4.1654 10.3881 111.1204 45.2820 0.0000 174.5992 115 R 3.9688 8.9211 123.1586 59.9143 29.8564 178.4261 116 Y 3.8789 8.2277 118.2134 60.4753 38.9625 177.2571 117 A 3.9293 8.3323 121.3138 55.1797 18.5415 179.0124 118 F 4.1380 8.5715 119.1760 61.6954 39.5251 176.9712 119 D 4.1698 8.4497 118.5725 57.2758 40.6339 178.5711 120 L 3.8691 7.8238 119.6419 58.1833 41.6130 178.8626 121 L 3.7169 8.4147 120.0141 58.7300 41.9229 178.9525 122 I 3.4479 7.6683 118.9814 64.3288 37.0214 178.0880 123 N 4.1541 7.8008 116.9795 56.3430 38.4009 177.0775 124 F 3.7799 7.8759 121.5589 61.3157 39.2905 177.1873 125 L 3.6650 7.9961 118.6853 57.3914 41.3267 179.4488 126 E 3.8778 7.9578 118.5503 59.0518 29.4088 178.8757 127 E 3.8189 7.9516 117.5318 59.5021 29.5222 178.4852 128 R 3.7940 7.5004 114.5662 55.9270 30.7991 175.6250 129 N 4.0403 7.2430 115.9654 54.5565 37.8387 176.7216 130 L 4.4656 7.8212 121.6334 53.6605 40.1446 177.1751 131 T 3.9438 7.8236 113.5884 64.2166 69.1694 176.1427 132 Y 3.9493 7.9290 122.5010 60.8361 39.0354 177.5492 133 I 3.6681 7.8328 120.2673 64.2062 37.2460 178.2384 134 L 3.9598 7.7821 119.8489 57.5929 41.4035 179.7240 135 K 3.9177 7.7582 118.3670 59.7781 32.5729 179.1936 136 I 3.4217 7.2366 121.0058 63.9430 36.5229 177.7894 137 L 3.9205 7.7700 120.8628 58.6222 41.6711 178.9689 138 N 4.3903 7.9554 114.6064 55.9915 38.5048 177.2440 139 Q 4.1112 8.1688 118.9920 58.3167 29.3774 176.4888 140 H 4.9910 8.6049 113.9961 55.1973 30.8840 173.2967 141 L 5.1913 7.7301 118.2734 52.9990 44.5223 175.7779 142 D 4.7164 8.7246 124.3829 53.1103 42.2466 175.5712 143 I 4.8175 8.2209 125.2730 59.3327 39.1414 175.4610 144 K 4.1661 8.8425 130.0022 55.7063 33.2630 175.5466 145 V 4.5845 8.0926 128.2011 61.5191 32.6575 174.5661 146 Y 4.2646 8.7637 130.4284 57.3407 40.0682 175.9957 147 V 3.9497 7.2380 118.3089 61.5093 32.4207 175.4122 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 18 Q 8.20 4.20 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.80 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 19 M 8.40 3.50 0.00 1.60 1.69 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.00 0.00 20 E 8.68 3.89 0.00 1.86 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 2.60 2.81 0.00 21 T 7.81 3.95 4.45 0.00 0.00 0.00 0.00 0.00 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 22 S 8.59 4.20 0.00 4.05 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 23 Y 8.42 4.15 0.00 3.25 3.30 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 24 V 8.23 3.54 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 1.18 0.00 0.00 1.23 0.00 0.00 25 S 8.37 4.23 0.00 4.18 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 26 L 8.27 4.08 0.00 1.97 1.81 1.04 0.78 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 27 K 7.99 3.68 0.00 1.39 1.78 0.00 1.49 0.00 0.00 1.60 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.36 7.81 28 T 7.92 3.84 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 1.27 0.00 0.00 29 W 8.19 4.17 0.00 3.09 2.86 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 30 I 8.49 3.24 1.95 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.89 0.85 0.00 0.00 31 E 8.24 3.96 0.00 2.07 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 2.30 2.41 0.00 32 D 7.29 4.64 0.00 2.64 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 6.79 4.29 0.00 3.65 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 34 L 8.16 4.05 0.00 1.81 1.45 0.85 0.82 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 35 D 8.77 4.24 0.00 2.74 2.56 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 0.00 0.00 0.00 0.00 36 L 7.60 3.72 0.00 1.22 0.65 0.75 0.28 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 37 F 7.84 4.86 0.00 3.07 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 38 K 8.03 3.84 0.00 1.74 1.92 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.56 7.81 39 N 7.79 4.25 0.00 2.88 2.86 0.00 0.00 7.27 7.75 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 40 D 8.06 4.67 0.00 3.01 2.84 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 41 L 7.85 4.41 0.00 1.76 1.81 0.89 0.76 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 42 L 8.30 4.05 0.00 1.71 1.76 0.93 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 43 P 0.00 4.53 0.00 2.29 2.21 0.00 3.74 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.19 0.00 44 L 7.96 4.06 0.00 1.81 1.94 1.03 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 45 L 8.13 4.24 0.00 2.03 1.94 0.78 0.63 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 46 Y 7.77 3.78 0.00 3.08 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 47 P 0.00 3.97 0.00 2.27 1.60 0.00 3.98 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.01 0.00 48 L 7.88 4.06 0.00 2.05 2.18 1.13 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 49 F 8.93 4.15 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 50 I 7.47 2.92 1.15 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 -0.36 -1.40 0.00 0.00 51 H 8.18 4.19 0.00 3.46 3.46 0.00 5.62 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 52 I 7.90 3.67 1.58 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.03 0.14 0.00 0.00 53 Y 7.67 4.14 0.00 2.82 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 54 F 8.07 4.37 0.00 3.00 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 D 8.40 4.38 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 56 L 8.08 3.91 0.00 1.70 1.78 0.67 0.80 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 57 I 7.55 3.57 1.90 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.38 0.81 0.00 0.00 58 Q 8.07 3.99 0.00 2.23 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.29 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 59 Q 7.75 4.37 0.00 2.14 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.58 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 60 N 7.97 4.19 0.00 2.84 2.86 0.00 0.00 6.73 7.21 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 61 K 7.79 4.52 0.00 1.73 2.01 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.41 7.81 62 T 7.73 3.84 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 1.18 0.00 0.00 63 D 7.98 4.33 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 64 E 8.17 4.05 0.00 2.04 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 0.00 2.39 2.44 0.00 65 A 7.98 4.19 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 66 K 8.37 4.17 0.00 1.81 1.89 0.00 1.39 0.00 0.00 0.61 0.00 0.00 2.36 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.56 1.55 7.81 67 E 8.45 3.99 0.00 2.23 2.18 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 2.36 2.35 0.00 68 F 8.52 4.27 0.00 3.42 3.32 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 69 F 8.60 3.79 0.00 2.82 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 70 E 8.37 4.11 0.00 2.04 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 2.68 2.56 0.00 71 K 7.54 3.95 0.00 1.66 1.58 0.00 1.58 0.00 0.00 1.54 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.30 0.97 7.81 72 Y 7.48 4.74 0.00 2.73 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 73 R 7.79 3.32 0.00 1.70 1.66 0.00 2.71 0.00 0.00 3.30 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.45 0.00 74 G 7.76 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 75 D 7.54 4.42 0.00 2.26 2.54 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 76 H 7.52 5.03 0.00 3.06 3.09 0.00 5.64 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 Y 8.28 4.30 0.00 3.08 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 78 N 7.00 4.14 0.00 2.56 2.47 0.00 0.00 5.82 7.13 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 79 K 8.01 4.45 0.00 1.20 1.28 0.00 1.32 0.00 0.00 0.80 0.00 0.00 2.78 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.92 0.55 7.81 80 S 7.87 4.15 0.00 4.01 4.26 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 81 E 8.02 3.93 0.00 1.88 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 0.00 2.29 2.44 0.00 82 E 7.97 3.95 0.00 2.11 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 0.00 2.36 2.36 0.00 83 I 8.46 4.16 2.01 0.00 0.00 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 1.83 1.33 0.95 0.00 0.00 84 K 7.92 4.38 0.00 1.94 2.00 0.00 1.65 0.00 0.00 1.57 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.35 7.81 85 Q 7.61 3.94 0.00 1.56 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.76 0.00 0.00 0.00 0.00 0.00 1.84 2.23 0.00 86 F 7.84 4.86 0.00 3.48 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 87 E 8.35 3.35 0.00 2.35 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 2.47 2.29 0.00 88 S 7.82 4.18 0.00 3.75 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 89 I 7.69 4.10 2.12 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.85 0.91 0.00 0.00 90 Y 8.83 4.99 0.00 2.98 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 91 T 7.46 4.72 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 1.17 0.00 0.00 92 V 8.14 3.59 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 0.79 0.00 0.00 0.89 0.00 0.00 93 Q 7.90 3.92 0.00 2.13 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.86 0.00 0.00 0.00 0.00 0.00 2.42 2.53 0.00 94 H 7.82 4.29 0.00 3.31 3.29 0.00 5.69 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 95 I 7.45 3.59 1.90 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.41 0.59 0.00 0.00 96 H 7.88 4.30 0.00 3.14 3.48 0.00 5.95 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 97 E 8.51 4.19 0.00 1.97 2.02 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 2.38 2.51 0.00 98 N 7.64 4.77 0.00 2.84 2.95 0.00 0.00 6.82 7.93 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 99 N 8.76 4.40 0.00 2.77 2.54 0.00 0.00 7.18 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 0.00 100 F 8.55 4.25 0.00 3.30 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 0.00 101 A 8.53 4.72 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 0.00 102 Y 7.91 3.99 0.00 3.03 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 0.00 103 T 8.40 3.94 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 1.40 0.00 0.00 104 F 8.01 4.13 0.00 3.64 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 0.00 105 K 8.45 4.32 0.00 2.09 1.77 0.00 1.84 0.00 0.00 1.48 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.51 1.70 7.81 106 N 7.61 4.49 0.00 2.52 2.67 0.00 0.00 7.04 7.26 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 0.00 107 S 7.61 4.52 0.00 4.00 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 0.00 108 K 8.22 4.56 0.00 1.56 1.63 0.00 1.71 0.00 0.00 1.62 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.33 7.81 109 Y 8.77 4.46 0.00 2.91 2.85 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 0.00 110 H 8.06 5.31 0.00 2.86 3.16 0.00 5.89 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 0.00 111 L 8.89 5.07 0.00 1.68 1.65 1.11 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 112 S 8.57 5.30 0.00 3.85 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 0.00 113 M 8.81 5.10 0.00 2.40 2.27 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.65 0.00 114 G 10.39 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 0.00 115 R 8.92 3.97 0.00 2.12 2.12 0.00 3.14 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.80 0.00 116 Y 8.23 3.88 0.00 3.18 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 0.00 117 A 8.33 3.93 1.63 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 0.00 118 F 8.57 4.14 0.00 3.16 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 0.00 119 D 8.45 4.17 0.00 2.57 2.50 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 0.00 120 L 7.82 3.87 0.00 1.92 2.03 0.65 0.42 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 0.00 121 L 8.41 3.72 0.00 1.89 1.74 1.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 122 I 7.67 3.45 1.50 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.22 0.77 0.00 0.00 123 N 7.80 4.15 0.00 2.96 2.80 0.00 0.00 6.67 8.04 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 0.00 124 F 7.88 3.78 0.00 2.31 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 0.00 0.00 0.00 125 L 8.00 3.67 0.00 1.71 1.57 0.87 1.07 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 0.00 126 E 7.96 3.88 0.00 2.09 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 2.21 2.40 0.00 127 E 7.95 3.82 0.00 1.76 1.88 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 2.26 2.35 0.00 128 R 7.50 3.79 0.00 1.15 1.57 0.00 3.27 0.00 0.00 2.99 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.50 0.00 129 N 7.24 4.04 0.00 2.74 2.72 0.00 0.00 7.08 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 0.00 130 L 7.82 4.47 0.00 1.62 1.59 0.79 0.48 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 0.00 131 T 7.82 3.94 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 1.18 0.00 0.00 132 Y 7.93 3.95 0.00 3.11 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 0.00 133 I 7.83 3.67 1.90 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.94 0.95 0.00 0.00 134 L 7.78 3.96 0.00 1.80 1.65 0.84 0.45 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 0.00 135 K 7.76 3.92 0.00 1.87 1.97 0.00 1.25 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.30 1.18 7.81 136 I 7.24 3.42 1.80 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.43 0.80 0.00 0.00 137 L 7.77 3.92 0.00 1.98 1.75 0.98 0.49 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 0.00 138 N 7.96 4.39 0.00 2.68 2.82 0.00 0.00 7.15 7.08 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 0.00 139 Q 8.17 4.11 0.00 1.64 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.78 0.00 0.00 0.00 0.00 0.00 2.25 2.40 0.00 140 H 8.60 4.99 0.00 2.98 3.19 0.00 5.55 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 0.00 141 L 7.73 5.19 0.00 1.72 1.64 1.00 1.16 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 0.00 142 D 8.72 4.72 0.00 2.36 2.56 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 0.00 0.00 0.00 0.00 143 I 8.22 4.82 1.89 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.67 0.94 0.00 0.00 144 K 8.84 4.17 0.00 1.86 1.71 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.38 7.81 145 V 8.09 4.58 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 0.70 0.00 0.00 0.05 0.00 0.00 146 Y 8.76 4.26 0.00 3.18 2.84 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 0.00 147 V 7.24 3.95 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 0.74 0.00 0.00 0.71 0.00 0.00