NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3218 8.2644 123.5847 52.3224 18.7149 175.9128 3 R 4.0302 8.2867 121.8565 58.0336 32.4063 175.8453 4 R 4.2406 8.9357 115.4362 56.5838 29.4003 179.0941 5 R 4.1561 8.9469 124.1756 56.6265 31.0989 178.0700 6 R 4.0204 8.5118 119.3773 56.1402 29.2985 177.6338 7 A 3.6885 8.5598 121.6790 52.0311 18.3079 176.8934 8 E 4.5255 8.1538 114.4547 55.0981 33.3306 175.5593 9 V 3.6495 8.3823 123.5895 62.3856 31.1345 175.3137 10 R 3.8885 8.4483 127.4719 56.8009 30.3937 175.5196 11 Q 4.4114 8.3680 123.7413 55.1083 30.3043 174.6486 12 L 4.6660 8.1964 122.3276 52.8571 43.8968 175.8460 13 Q 4.3265 8.6657 124.4149 54.6357 29.5819 173.0028 14 P 4.1644 0.0000 0.0000 60.7195 33.2269 174.9911 15 D 4.6483 8.4859 119.7100 54.6161 41.7101 176.5315 16 L 4.6716 8.4047 119.3665 54.5323 43.4778 177.4750 17 V 4.0160 8.0710 116.3988 64.4927 32.4714 176.1736 18 Y 4.2301 8.6544 114.2285 57.0965 38.5925 175.6579 19 G 4.2962 8.0529 107.6689 46.4901 0.0000 172.9927 20 D 4.9959 7.7529 116.8692 51.8442 44.1809 176.6229 21 V 3.6640 8.5576 120.0331 64.5977 31.7471 178.4309 22 L 4.1163 8.3551 120.0267 58.0612 41.9306 179.2757 23 V 3.6070 7.8578 118.2768 66.1056 31.5873 177.9755 24 T 3.9704 7.9795 108.9751 64.6682 68.5334 176.1629 25 A 4.0669 7.9660 123.3044 55.0967 18.1782 179.3683 26 F 4.4560 8.1010 117.6394 61.0816 39.6885 177.4603 27 I 3.6136 7.6269 119.3669 64.3079 36.9259 177.7816 28 N 4.2370 8.6436 117.6359 56.4036 38.1893 176.7760 29 K 4.3317 7.3979 114.8431 57.3849 32.1578 177.9926 30 I 4.3226 7.7574 120.8235 61.4283 38.6694 173.9261 31 M 3.8332 7.1337 118.0370 56.1647 31.7041 175.9734 32 R 4.3200 7.8145 128.5856 52.5410 27.3593 175.2153 33 D 4.8822 8.7635 122.5998 54.3763 39.5314 177.2297 34 G 3.7870 8.3517 104.4391 46.3761 0.0000 176.0004 35 K 4.3237 7.1154 119.6624 54.4520 30.9059 177.4817 36 K 3.8181 7.7938 123.5460 59.5519 32.7719 177.5371 37 N 4.5035 8.1073 113.9056 54.6357 38.7433 174.9243 38 L 4.4647 7.9312 118.3641 56.9090 43.2716 177.8819 39 A 3.9508 7.7078 120.2537 54.7008 18.5741 178.9883 40 A 3.6568 8.2588 119.7621 56.1632 17.5578 179.1622 41 R 3.9607 8.2718 115.9831 58.1287 29.7365 179.1370 42 I 4.0374 7.5298 122.2242 64.9082 37.7242 177.4831 43 F 4.3477 8.1735 121.4556 61.7614 39.0556 176.8093 44 Y 4.3738 7.7647 115.3084 61.3918 37.7251 177.8259 45 D 4.4018 9.4757 117.4769 57.2808 41.4013 177.8611 46 A 4.4465 7.8977 120.4020 54.2118 19.4579 178.8983 47 C 4.4454 8.5918 115.4680 63.0168 28.4268 175.8125 48 K 4.4535 8.1978 115.5775 56.9794 31.4369 177.2346 49 I 4.5694 8.3505 120.4727 61.1481 39.3049 177.7512 50 I 4.0945 8.2323 121.1102 63.7856 37.5679 177.5413 51 Q 4.2866 8.1924 118.1668 58.6890 28.9954 176.6094 52 E 3.9344 8.0309 118.1003 58.5290 29.3094 178.5782 53 K 4.2495 6.4600 114.1122 55.1679 32.3694 176.8344 54 T 4.5237 8.4583 121.5624 61.7514 70.6819 172.9717 55 G 3.7800 8.6611 117.6793 47.7038 0.0000 173.5528 56 Q 3.9813 7.3719 118.6092 56.1720 29.5008 176.8203 57 E 4.4527 8.4545 117.8903 55.3669 29.6611 176.6053 58 P 3.6945 0.0000 0.0000 62.7249 33.4182 177.7029 59 L 4.0208 8.4921 118.7198 58.8767 42.2441 179.5040 60 K 3.9709 8.0561 118.7457 59.6911 31.8309 178.7855 61 V 3.6457 7.6639 117.4721 66.1384 31.6521 177.4009 62 F 4.0642 8.1859 120.1934 60.8982 38.5008 176.6671 63 K 3.8011 8.7106 119.4549 59.6322 31.7881 178.5698 64 Q 4.2362 8.1646 119.4984 58.5950 28.7923 177.4921 65 A 4.1352 7.7594 120.9455 54.3559 18.6240 179.3356 66 V 3.5182 7.3228 116.8363 65.7636 31.1822 177.6399 67 E 3.9792 7.6321 119.6146 58.9959 29.2850 177.9310 68 N 4.3213 7.6561 113.2157 54.5840 38.7118 175.6574 69 V 4.2601 6.9490 118.4317 63.0974 33.7689 174.9700 70 K 3.7511 8.2881 119.5721 55.8536 31.8104 174.6573 71 P 4.5233 0.0000 0.0000 62.2189 32.0156 176.1090 72 R 4.0796 8.9718 124.4960 59.5500 30.1902 175.7756 73 M 5.0475 7.8015 114.1535 54.2074 36.7206 173.9027 74 E 5.0031 8.7362 119.1950 54.7376 34.0250 174.7774 75 V 5.1933 8.2601 112.2727 59.2320 33.1464 175.9748 76 R 4.3431 8.5765 125.6289 55.0010 30.8598 176.9195 77 S 4.3397 8.5533 119.3469 59.4579 63.0038 172.6976 78 R 4.0083 7.4180 116.5778 55.8231 34.1241 173.0642 79 R 4.8587 8.3550 123.6767 53.9014 31.1317 175.4539 80 V 3.8594 8.1160 125.6239 62.0123 33.4249 175.7516 81 G 3.8688 7.8667 107.0040 49.6249 0.0000 172.7003 82 G 3.9329 8.6348 113.1448 44.8148 0.0000 172.0085 83 A 4.1634 6.9213 120.2708 52.1210 21.4534 175.4088 84 N 5.5168 7.3864 116.6477 50.8445 38.0337 173.8200 85 Y 4.2100 6.6835 116.5561 58.5175 39.4004 177.5227 86 Q 4.5600 8.0646 124.3483 54.1253 27.7012 175.6494 87 V 3.7710 7.5476 120.5359 62.3282 32.7239 173.2410 88 P 5.2634 0.0000 0.0000 61.1847 33.2730 173.6424 89 M 4.2294 8.0714 115.4628 54.5458 33.8802 174.1898 90 E 4.0870 8.8066 118.8522 56.8871 30.4250 176.7409 91 V 4.2878 7.6456 121.6101 61.0518 32.4263 175.6926 92 S 4.2885 8.6973 123.1642 57.8343 63.2817 172.8569 93 P 4.3815 0.0000 0.0000 66.3118 30.8957 178.5981 94 R 3.8540 8.0124 117.6702 59.0615 29.9773 178.4692 95 R 3.7575 7.9952 117.4660 59.3816 30.0518 177.8336 96 Q 3.7618 9.2608 119.6849 59.4824 29.1009 179.2448 97 Q 3.8520 8.4183 120.5635 59.1363 29.0082 178.2272 98 S 3.9974 7.8692 116.0690 61.6051 62.9436 176.5114 99 L 3.3188 8.1327 121.4609 58.3424 41.2404 178.6579 100 A 3.6777 7.7622 118.7642 55.4905 17.8953 179.2146 101 L 3.9018 8.6019 115.1908 57.7545 42.3016 179.8311 102 R 3.8978 8.0771 118.1455 59.3904 29.9741 178.0404 103 W 4.6615 8.4156 118.8081 60.4393 29.1007 177.9794 104 L 3.9640 8.0680 118.0406 58.3390 41.0676 179.5563 105 V 3.6723 7.9279 117.4235 66.5328 31.5041 177.9825 106 Q 3.9846 8.1240 116.8280 59.1126 28.4449 178.7382 107 A 3.9914 8.4063 120.2035 55.4734 18.4239 179.1501 108 A 4.0922 8.0022 117.3566 55.6334 18.6675 179.4144 109 N 4.3384 8.3749 113.7204 55.3521 39.9469 176.5172 110 Q 4.5859 7.6599 121.1059 53.4540 26.0319 174.4930 111 R 4.7528 6.6858 117.9974 53.9931 34.9076 174.3303 112 P 4.4161 0.0000 0.0000 64.2294 31.9298 176.6432 113 E 3.9681 8.1903 119.0024 57.0735 29.6327 177.3959 114 R 3.9701 8.7285 123.0170 58.2250 30.6365 176.5893 115 R 4.3868 7.5193 116.9295 54.7430 30.4059 177.1273 116 A 3.8223 7.9768 125.8203 54.3563 19.1389 178.7965 117 A 3.9627 7.9750 119.2777 55.5329 18.5635 180.1186 118 V 3.5619 7.9482 110.9702 64.3890 31.4079 179.0445 119 R 3.8812 7.8727 117.3425 59.4697 30.0303 178.7255 120 I 3.7530 7.6930 118.8611 65.0956 37.0228 177.6761 121 A 4.1216 8.1395 121.6802 54.8957 18.1777 178.8993 122 H 4.0694 8.9315 113.4543 58.9532 29.0434 177.7528 123 E 3.9158 8.5940 120.9748 59.4598 29.6459 178.7093 124 L 4.0593 8.3145 119.3730 58.7627 41.5042 178.7629 125 M 4.1978 8.6079 119.4023 57.0970 31.7402 178.0540 126 D 4.3754 8.5879 118.4182 58.0144 41.1314 179.2032 127 A 4.1069 8.2594 119.8312 55.1607 18.4571 178.8661 128 A 4.0255 7.9786 118.3070 55.2756 18.5381 179.1651 129 E 4.0412 8.7797 117.6220 60.5073 29.9287 176.7945 130 G 3.4142 7.6376 111.1202 44.9492 0.0000 173.7920 131 K 4.4842 7.6625 121.4814 55.9731 32.4680 176.4405 132 G 4.2373 7.4506 105.7961 43.9130 0.0000 173.4194 133 G 3.6385 8.5730 107.9080 47.4019 0.0000 175.9762 134 A 4.1176 7.8723 121.8963 54.2729 18.5126 179.3997 135 V 3.7558 7.5173 116.7473 65.4874 31.8404 177.3433 136 K 3.7882 8.2764 119.5291 59.8159 31.8580 178.1088 137 K 3.4659 7.4910 117.1417 59.5482 31.4881 178.8766 138 K 3.6841 7.1726 119.3509 60.0310 31.9584 178.2709 139 E 4.0515 8.0548 118.4125 59.1384 29.2399 179.0829 140 D 4.2595 7.6865 118.6539 57.3385 40.8814 178.6908 141 V 3.6707 7.7975 117.2562 65.0639 31.6138 177.3579 142 E 4.1258 7.7346 118.4083 59.5062 29.1669 178.3333 143 R 3.9183 7.9759 118.1424 59.7445 30.2209 178.9108 144 M 4.0858 7.9504 117.7729 57.6927 32.2466 176.5871 145 A 4.4958 7.9168 121.2612 52.2796 19.9199 176.7206 146 E 4.0679 9.0203 123.2496 57.7512 28.1351 177.0406 147 A 3.8875 7.4092 118.3623 54.8699 18.5837 178.0973 148 N 5.0670 7.7836 110.4471 53.1266 39.0940 176.4017 149 R 3.9623 8.6228 120.5316 58.2984 30.4061 178.4310 150 A 3.7761 8.0183 119.6050 56.2588 18.5228 178.0703 151 Y 3.8505 8.2985 112.0351 57.8429 38.2396 177.6089 152 A 4.0481 7.7467 126.9980 55.7660 18.4070 180.0887 153 H 4.5764 8.2235 107.3228 57.2914 28.6236 175.1017 154 Y 5.0016 8.1894 118.3421 58.3463 37.8537 177.4586 155 R 3.9671 8.2014 118.5901 57.7201 30.6985 176.7885 156 W 4.2447 8.5820 121.2541 56.8679 30.2362 174.4286 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 2 A 8.26 4.32 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 3 R 8.29 4.03 0.00 1.88 1.97 0.00 3.23 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 4 R 8.94 4.24 0.00 1.83 1.39 0.00 3.26 0.00 0.00 3.22 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 5 R 8.95 4.16 0.00 1.91 1.84 0.00 3.18 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 6 R 8.51 4.02 0.00 1.75 1.91 0.00 3.37 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 7 A 8.56 3.69 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 8 E 8.15 4.53 0.00 1.91 1.81 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 2.21 2.29 0.00 9 V 8.38 3.65 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 0.75 0.00 0.00 0.93 0.00 0.00 10 R 8.45 3.89 0.00 1.80 1.86 0.00 3.28 0.00 0.00 3.15 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 11 Q 8.37 4.41 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.47 0.00 0.00 0.00 0.00 0.00 2.31 2.44 0.00 12 L 8.20 4.67 0.00 1.67 1.57 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 8.67 4.33 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.78 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 14 P 0.00 4.16 0.00 2.11 2.00 0.00 3.75 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 15 D 8.49 4.65 0.00 2.97 2.83 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.40 4.67 0.00 1.69 1.68 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.07 4.02 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 0.40 0.00 0.00 0.69 0.00 0.00 18 Y 8.65 4.23 0.00 2.93 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 G 8.05 4.30 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 0.00 20 D 7.75 5.00 0.00 2.73 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 21 V 8.56 3.66 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 0.95 0.00 0.00 0.98 0.00 0.00 22 L 8.36 4.12 0.00 1.88 2.02 1.05 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.86 3.61 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 1.03 0.00 0.00 0.63 0.00 0.00 24 T 7.98 3.97 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 1.26 0.00 0.00 25 A 7.97 4.07 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 26 F 8.10 4.46 0.00 3.29 3.27 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 27 I 7.63 3.61 2.04 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.23 0.84 0.00 0.00 28 N 8.64 4.24 0.00 2.83 2.86 0.00 0.00 7.09 7.55 0.00 0.00 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 K 7.40 4.33 0.00 1.79 1.79 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.67 1.63 7.81 30 I 7.76 4.32 1.73 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.24 0.74 0.00 0.00 31 M 7.13 3.83 0.00 2.05 2.00 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 2.59 2.56 0.00 32 R 7.81 4.32 0.00 1.89 1.80 0.00 3.24 0.00 0.00 3.21 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 33 D 8.76 4.88 0.00 2.79 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 G 8.35 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 35 K 7.12 4.32 0.00 1.81 1.75 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.40 7.81 36 K 7.79 3.82 0.00 1.76 1.79 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.41 7.81 37 N 8.11 4.50 0.00 2.70 2.81 0.00 0.00 6.76 7.78 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 38 L 7.93 4.46 0.00 1.77 1.81 0.91 0.96 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 39 A 7.71 3.95 1.23 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 0.00 0.00 40 A 8.26 3.66 1.28 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 0.00 0.00 41 R 8.27 3.96 0.00 2.07 1.88 0.00 3.17 0.00 0.00 3.35 8.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.90 0.00 42 I 7.53 4.04 1.84 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 1.40 0.69 0.93 0.00 0.00 43 F 8.17 4.35 0.00 2.95 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 Y 7.76 4.37 0.00 3.09 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 45 D 9.48 4.40 0.00 2.74 2.91 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 46 A 7.90 4.45 1.62 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 47 C 8.59 4.45 0.00 3.30 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 48 K 8.20 4.45 0.00 1.98 1.88 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.52 7.81 49 I 8.35 4.57 2.13 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.61 0.99 0.00 0.00 50 I 8.23 4.09 2.08 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.91 1.03 0.00 0.00 51 Q 8.19 4.29 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.11 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 52 E 8.03 3.93 0.00 2.16 1.77 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 0.00 2.40 2.31 0.00 53 K 6.46 4.25 0.00 2.09 1.86 0.00 1.99 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.51 1.43 7.81 54 T 8.46 4.52 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 1.31 0.00 0.00 55 G 8.66 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 56 Q 7.37 3.98 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.74 0.00 0.00 0.00 0.00 0.00 2.44 2.52 0.00 57 E 8.45 4.45 0.00 2.16 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 0.00 2.30 2.35 0.00 58 P 0.00 3.69 0.00 2.51 2.26 0.00 3.71 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.25 0.00 59 L 8.49 4.02 0.00 2.15 1.90 1.13 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 60 K 8.06 3.97 0.00 2.07 1.86 0.00 1.63 0.00 0.00 1.61 0.00 0.00 3.07 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.54 7.81 61 V 7.66 3.65 2.31 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 0.89 0.00 0.00 1.00 0.00 0.00 62 F 8.19 4.06 0.00 3.16 3.22 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 0.00 63 K 8.71 3.80 0.00 2.07 1.89 0.00 1.61 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.54 7.81 64 Q 8.16 4.24 0.00 2.31 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.35 2.51 0.00 65 A 7.76 4.14 1.23 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 0.00 0.00 66 V 7.32 3.52 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 1.00 0.00 0.00 0.43 0.00 0.00 67 E 7.63 3.98 0.00 2.28 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 0.00 2.30 2.38 0.00 68 N 7.66 4.32 0.00 2.90 2.85 0.00 0.00 6.74 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 69 V 6.95 4.26 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 1.23 0.00 0.00 1.06 0.00 0.00 70 K 8.29 3.75 0.00 1.76 2.09 0.00 1.74 0.00 0.00 1.88 0.00 0.00 2.98 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.44 1.58 7.81 71 P 0.00 4.52 0.00 2.42 2.66 0.00 3.86 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.91 0.00 72 R 8.97 4.08 0.00 1.94 2.29 0.00 3.28 0.00 0.00 3.35 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 73 M 7.80 5.05 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.66 0.00 74 E 8.74 5.00 0.00 2.12 2.17 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 2.24 2.33 0.00 75 V 8.26 5.19 2.30 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 0.69 0.00 0.00 0.96 0.00 0.00 76 R 8.58 4.34 0.00 1.93 2.03 0.00 3.38 0.00 0.00 3.42 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.77 0.00 77 S 8.55 4.34 0.00 3.82 3.73 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.42 4.01 0.00 1.55 1.57 0.00 2.80 0.00 0.00 2.67 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.29 0.00 79 R 8.36 4.86 0.00 1.67 1.64 0.00 3.12 0.00 0.00 2.69 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.26 0.00 80 V 8.12 3.86 1.73 0.00 0.00 0.00 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 0.73 0.00 0.00 81 G 7.87 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 0.00 0.00 0.00 82 G 8.63 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 0.00 0.00 0.00 83 A 6.92 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 N 7.39 5.52 0.00 2.62 2.68 0.00 0.00 7.58 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 85 Y 6.68 4.21 0.00 3.04 2.44 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 86 Q 8.06 4.56 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.94 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 87 V 7.55 3.77 2.35 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 1.31 0.00 0.00 1.14 0.00 0.00 88 P 0.00 5.26 0.00 2.26 2.07 0.00 4.00 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.12 0.00 89 M 8.07 4.23 0.00 2.31 2.24 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 90 E 8.81 4.09 0.00 1.89 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 2.34 2.34 0.00 91 V 7.65 4.29 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 0.72 0.00 0.00 1.01 0.00 0.00 92 S 8.70 4.29 0.00 3.93 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 93 P 0.00 4.38 0.00 2.29 2.29 0.00 3.76 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 2.06 2.06 0.00 94 R 8.01 3.85 0.00 1.85 2.02 0.00 3.12 0.00 0.00 3.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 95 R 8.00 3.76 0.00 1.84 2.04 0.00 3.22 0.00 0.00 3.27 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 96 Q 9.26 3.76 0.00 2.23 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.58 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 97 Q 8.42 3.85 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.57 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 98 S 7.87 4.00 0.00 3.98 3.81 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 99 L 8.13 3.32 0.00 0.77 0.13 0.73 0.76 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 0.00 100 A 7.76 3.68 1.24 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 0.00 0.00 101 L 8.60 3.90 0.00 1.80 1.91 0.99 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.08 3.90 0.00 1.89 1.91 0.00 3.14 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 103 W 8.42 4.66 0.00 3.55 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 0.00 104 L 8.07 3.96 0.00 2.05 1.85 0.87 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 105 V 7.93 3.67 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 1.06 0.00 0.00 0.99 0.00 0.00 106 Q 8.12 3.98 0.00 2.44 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.45 0.00 0.00 0.00 0.00 0.00 2.44 2.57 0.00 107 A 8.41 3.99 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 0.00 108 A 8.00 4.09 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 0.00 109 N 8.37 4.34 0.00 2.83 2.92 0.00 0.00 7.08 7.24 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 0.00 110 Q 7.66 4.59 0.00 2.21 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.69 0.00 0.00 0.00 0.00 0.00 2.32 2.56 0.00 111 R 6.69 4.75 0.00 2.05 1.78 0.00 3.35 0.00 0.00 3.30 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 112 P 0.00 4.42 0.00 2.19 2.18 0.00 3.81 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 2.00 1.99 0.00 113 E 8.19 3.97 0.00 1.97 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 2.34 2.30 0.00 114 R 8.73 3.97 0.00 1.81 2.00 0.00 3.34 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 115 R 7.52 4.39 0.00 1.85 1.87 0.00 3.17 0.00 0.00 3.35 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 116 A 7.98 3.82 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 0.00 117 A 7.98 3.96 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 0.00 118 V 7.95 3.56 1.91 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 0.81 0.00 0.00 0.99 0.00 0.00 119 R 7.87 3.88 0.00 1.97 1.99 0.00 3.15 0.00 0.00 3.62 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.92 0.00 120 I 7.69 3.75 2.05 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.92 1.15 0.00 0.00 121 A 8.14 4.12 1.42 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 0.00 0.00 0.00 122 H 8.93 4.07 0.00 3.18 3.39 0.00 5.64 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.59 3.92 0.00 2.21 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 0.00 2.34 2.41 0.00 124 L 8.31 4.06 0.00 2.03 1.73 0.82 0.86 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 0.00 125 M 8.61 4.20 0.00 2.07 2.24 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.62 0.00 126 D 8.59 4.38 0.00 2.86 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 0.00 127 A 8.26 4.11 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 0.00 128 A 7.98 4.03 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 0.00 129 E 8.78 4.04 0.00 2.03 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 0.00 2.32 2.33 0.00 130 G 7.64 3.41 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 0.00 131 K 7.66 4.48 0.00 1.84 1.84 0.00 1.55 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.43 0.00 0.00 0.00 0.00 1.45 1.39 7.81 132 G 7.45 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 0.00 0.00 0.00 0.00 133 G 8.57 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 0.00 0.00 0.00 134 A 7.87 4.12 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 0.00 0.00 135 V 7.52 3.76 2.30 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 1.08 0.00 0.00 0.95 0.00 0.00 136 K 8.28 3.79 0.00 1.85 1.74 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.61 7.81 137 K 7.49 3.47 0.00 1.01 0.86 0.00 1.52 0.00 0.00 0.93 0.00 0.00 2.41 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.17 1.15 7.81 138 K 7.17 3.68 0.00 2.01 2.06 0.00 1.74 0.00 0.00 1.67 0.00 0.00 3.13 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.64 1.79 7.81 139 E 8.05 4.05 0.00 2.20 1.94 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 2.30 2.40 0.00 140 D 7.69 4.26 0.00 2.74 2.62 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 0.00 141 V 7.80 3.67 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 0.96 0.00 0.00 0.74 0.00 0.00 142 E 7.73 4.13 0.00 2.35 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 2.31 2.40 0.00 143 R 7.98 3.92 0.00 2.03 1.98 0.00 3.17 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.83 0.00 144 M 7.95 4.09 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.83 0.00 145 A 7.92 4.50 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 0.00 146 E 9.02 4.07 0.00 2.19 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 0.00 2.30 2.24 0.00 147 A 7.41 3.89 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 0.00 148 N 7.78 5.07 0.00 3.06 2.90 0.00 0.00 6.59 7.54 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 0.00 149 R 8.62 3.96 0.00 1.80 1.98 0.00 3.54 0.00 0.00 3.17 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 150 A 8.02 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.30 3.85 0.00 2.94 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 0.00 152 A 7.75 4.05 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 0.00 153 H 8.22 4.58 0.00 3.36 3.42 0.00 5.50 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 8.19 5.00 0.00 3.30 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 0.00 155 R 8.20 3.97 0.00 1.92 2.08 0.00 3.28 0.00 0.00 3.33 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 156 W 8.58 4.24 0.00 3.63 3.35 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