NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 S 4.3714 8.3344 115.2915 58.0681 64.7690 173.2111 6 D 4.2650 8.0075 120.3741 54.1236 41.8680 175.0025 7 K 4.4988 8.6998 123.5513 55.7456 35.0086 175.4388 8 V 3.9284 8.1544 120.4668 62.0174 32.1516 174.8939 9 L 4.6965 8.4690 130.3302 53.4117 43.4809 175.3084 10 K 4.5342 8.6449 126.8283 55.3309 34.0370 175.9479 11 I 4.9621 8.3318 124.5918 59.5417 40.0132 174.4451 12 Q 4.5173 9.2692 129.0059 54.3637 31.0636 174.1899 13 L 4.8285 8.5153 127.1674 53.7918 41.8093 176.7599 14 R 4.3688 9.1675 124.5861 57.6180 30.9895 176.4799 15 S 4.5259 7.7071 112.1336 56.7532 65.8792 174.5343 16 A 4.1154 8.4168 122.3908 54.7230 18.1251 178.9126 17 S 4.2642 7.7091 110.6916 60.2800 63.2797 174.8550 18 A 4.3362 7.5652 123.3958 52.1336 18.6829 176.6772 19 T 4.3869 8.1420 118.1697 61.0317 70.5871 174.7097 20 V 3.5627 8.3886 125.5731 62.7868 31.8010 173.7224 21 P 5.5179 0.0000 0.0000 62.9672 31.9477 175.7191 22 T 4.8848 8.6809 112.3558 59.7412 72.4441 172.9590 23 K 4.2507 8.7415 124.0630 55.8331 32.7641 178.3990 24 G 3.6477 8.9657 114.4742 47.8044 0.0000 173.3580 25 S 4.5103 7.6062 111.1555 57.3405 65.7198 177.4405 26 A 3.8620 8.7737 125.6769 55.3682 18.0388 178.5471 27 T 4.3469 7.6189 108.9036 63.0351 69.2556 174.7122 28 A 4.0454 7.8147 124.9859 51.9395 18.9441 178.0889 29 A 4.0428 8.4984 123.6343 54.5398 18.7365 177.8557 30 G 4.2187 7.3385 100.0105 44.8169 0.0000 171.5541 31 Y 4.7602 8.5441 117.6683 56.3234 39.9854 175.4611 32 D 4.6570 9.6088 125.2859 54.4965 42.4525 175.2527 33 I 4.7968 8.4901 124.0514 59.9913 39.2061 174.1971 34 Y 5.1722 8.8252 124.7450 56.2167 39.7345 175.6216 35 A 4.5001 9.4151 126.3251 52.4227 19.1807 178.1374 36 S 4.9748 9.0369 115.6670 58.8568 64.5069 174.2487 37 Q 4.7025 7.8405 117.6904 53.7922 32.7001 174.7012 38 D 4.7103 8.6607 121.2810 55.0311 41.8046 175.5579 39 I 4.4757 8.4140 120.3705 60.3946 42.0949 172.9990 40 T 5.0136 8.4222 123.4485 61.8453 71.0801 173.8488 41 I 4.2987 8.6093 127.6524 59.3704 38.2547 173.7557 42 P 4.8721 0.0000 0.0000 61.8183 32.6291 175.9915 43 A 4.0210 9.1019 125.4106 54.4520 18.6479 177.3042 44 M 3.5159 8.1678 119.6641 54.9517 30.8331 176.9917 45 G 4.3174 7.7711 106.3656 45.1790 0.0000 171.6622 46 Q 5.2176 8.8413 119.8189 54.7095 32.6779 175.4899 47 G 4.3170 9.0725 111.0386 45.2946 0.0000 170.5614 48 M 5.2453 8.4403 118.4666 53.6004 35.2005 174.3948 49 V 4.3422 9.0466 126.8486 61.1255 33.5555 175.2624 50 S 4.7771 8.7893 124.4118 59.1539 63.4549 174.7599 51 T 4.4661 8.1918 109.4862 60.0580 71.2622 173.7817 52 D 4.4822 8.8462 121.8012 55.1582 39.4211 172.7445 53 I 5.2412 7.6331 109.3343 59.3649 40.9190 174.4140 54 S 5.0717 9.2791 119.5691 56.9556 66.8629 172.9440 55 F 5.1220 7.9402 115.4012 56.0165 41.2538 173.7474 56 T 4.6491 8.6258 117.2069 61.9003 70.1273 174.8080 57 V 4.1432 8.6029 119.9384 60.4430 32.7204 174.6573 58 P 4.6444 0.0000 0.0000 62.1019 32.7465 176.3253 59 V 3.6939 8.6752 122.7464 64.6663 31.9839 176.5936 60 G 4.0209 9.5195 114.9190 45.1976 0.0000 172.0735 61 T 5.9110 7.7515 108.1305 58.9098 72.2934 172.3581 62 Y 4.9376 8.3745 118.9859 55.1465 42.2723 174.3118 63 G 4.2885 8.8460 107.5730 44.8399 0.0000 172.6107 64 R 5.2358 8.7486 127.3643 55.1085 32.0145 175.3829 65 I 4.5340 8.7474 128.2189 60.7860 37.2672 175.0107 66 A 5.0142 9.3833 130.0627 48.7798 22.4229 173.5369 67 P 4.5980 0.0000 0.0000 62.7257 32.0872 176.5605 68 R 4.1286 8.4746 121.4633 56.1048 31.0913 178.0687 69 S 4.2254 8.7708 118.6887 61.3539 62.8106 177.1250 70 G 3.6131 8.0004 108.0471 47.9605 0.0000 175.5022 71 L 3.8332 7.8976 121.2767 57.0799 41.5102 179.4462 72 A 4.3005 7.5698 121.6648 54.6263 18.1611 179.8671 73 V 3.4450 7.5318 115.1277 66.2316 31.8036 178.0171 74 K 4.2389 8.1985 116.5937 57.7824 32.2539 177.3290 75 N 4.7637 7.7801 113.1945 51.8637 40.3212 174.9408 76 G 3.8369 7.9927 106.5192 46.1483 0.0000 172.6813 77 I 4.6408 7.3732 120.7246 60.0841 38.6584 174.5433 78 Q 4.9020 9.1294 128.7850 54.1724 31.9015 174.8425 79 T 4.4747 8.7225 116.3136 61.8577 70.0441 173.5315 80 G 4.1435 8.1144 109.9971 43.8938 0.0000 175.0201 81 A 3.6090 9.9329 123.7515 53.4283 18.4173 179.0535 82 G 3.9021 9.0287 108.3101 47.1005 0.0000 172.2327 83 V 4.4610 7.4432 119.6525 61.7451 32.1322 175.2925 84 V 4.1681 8.7055 129.9229 61.1444 32.8891 175.0609 85 D 4.8906 8.5669 128.1023 53.9696 41.6302 177.8148 86 R 4.0092 8.9123 121.2353 59.0985 30.2044 176.9701 87 D 4.7019 7.9943 114.6053 53.1076 40.0332 175.3773 88 Y 4.3340 7.9998 122.8780 57.6781 39.0984 174.9401 89 T 4.1792 7.6392 115.4932 61.0201 70.3683 174.1106 90 G 3.3817 5.8275 110.9345 44.5728 0.0000 172.5076 91 E 4.1737 8.1941 119.5254 55.2648 30.2677 176.0402 92 V 4.0047 9.0396 126.6636 62.6702 32.3624 174.9312 93 K 4.8544 8.6854 127.3074 54.9332 34.5870 176.1866 94 V 4.1788 8.4827 123.7407 61.2108 33.2841 175.0016 95 V 4.1437 8.2342 129.2275 62.6181 32.6101 174.4934 96 L 5.0797 8.7987 128.0600 52.8793 45.0209 175.3891 97 F 5.4366 9.2584 122.0292 55.8338 41.8847 174.3539 98 N 5.2656 9.0906 121.6825 52.4892 40.3371 174.3262 99 H 4.6670 9.7511 125.0569 57.0216 29.7808 176.1872 100 S 4.5211 8.2012 113.9738 57.7131 64.5490 174.9844 101 Q 4.3114 8.6919 117.1402 56.5465 28.7526 176.0235 102 R 4.7539 7.6444 117.9515 53.9426 32.3628 175.7833 103 D 4.7299 8.9287 123.6677 54.6932 41.9421 175.5483 104 F 4.9855 9.1805 125.1788 56.5159 41.2126 174.1049 105 A 4.4797 8.2363 128.6101 51.1390 19.7811 176.2136 106 I 4.4032 8.3385 122.6624 59.2077 40.8652 174.8120 107 K 4.9807 9.0063 125.2224 53.8040 35.3717 175.5800 108 K 3.9784 9.1201 124.4197 58.3781 32.4104 177.0433 109 G 4.1072 9.4207 114.3234 45.3989 0.0000 173.3954 110 D 4.6873 8.1981 120.3949 54.1993 42.3009 175.6357 111 R 4.4429 8.3944 120.8850 55.7750 30.5901 176.6954 112 V 4.4940 8.1981 115.7155 61.1055 33.7678 174.7907 113 A 4.5400 7.2950 121.1402 51.4383 22.6050 174.6766 114 Q 4.9412 8.8964 116.4750 54.5406 32.5524 174.1019 115 L 4.9540 9.0264 124.0964 53.8393 44.0792 174.9049 116 I 4.6459 8.9863 128.2502 59.5304 39.7069 175.4537 117 L 4.6285 8.6068 127.7414 54.2249 40.5965 175.0746 118 E 4.1140 8.4874 123.2849 55.5417 30.7225 176.2526 119 K 4.9062 8.6185 124.5016 56.4567 33.0028 176.1538 120 I 4.7492 8.4804 116.6818 59.4644 41.4991 174.8024 121 V 4.0393 8.4160 122.6436 61.9574 31.0340 175.0432 122 D 4.8630 8.6517 126.6708 53.3875 40.2221 176.0276 123 D 4.8852 7.6327 119.3068 52.9056 39.9228 175.7142 124 A 4.1764 8.0471 121.6106 53.1631 19.2389 177.8824 125 Q 4.2409 8.4083 120.2781 55.3443 29.6202 175.8959 126 I 4.1157 8.2302 124.0290 60.3189 38.0674 175.3303 127 V 4.2944 8.2197 124.5605 60.8661 33.6282 174.5259 128 V 4.1464 8.3491 127.0743 61.7680 32.4416 175.1957 129 V 4.6213 7.9103 118.9010 59.3943 35.5636 175.5678 130 D 4.4983 8.7744 121.5118 57.0412 40.9202 177.1908 131 S 4.6877 7.7065 110.4616 56.4424 65.5403 173.5125 132 L 4.1484 8.7418 128.3159 57.2346 42.4220 178.2336 133 E 4.7002 7.5576 113.8351 55.0250 29.4060 179.1558 134 E 4.3435 7.8186 122.8433 56.6103 29.7843 176.4377 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 5 S 8.33 4.37 0.00 3.85 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 6 D 8.01 4.26 0.00 2.75 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.70 4.50 0.00 1.74 1.78 0.00 1.80 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.33 1.38 7.81 8 V 8.15 3.93 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 0.69 0.00 0.00 0.93 0.00 0.00 9 L 8.47 4.70 0.00 1.46 1.36 0.70 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 10 K 8.64 4.53 0.00 1.80 1.71 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.41 1.41 7.81 11 I 8.33 4.96 1.88 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.84 0.96 0.00 0.00 12 Q 9.27 4.52 0.00 2.08 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.82 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 13 L 8.52 4.83 0.00 1.56 1.62 0.91 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 14 R 9.17 4.37 0.00 1.74 1.97 0.00 3.13 0.00 0.00 3.23 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.73 0.00 15 S 7.71 4.53 0.00 3.94 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 16 A 8.42 4.12 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 17 S 7.71 4.26 0.00 4.01 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 A 7.57 4.34 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 19 T 8.14 4.39 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 0.65 0.00 0.00 20 V 8.39 3.56 2.06 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 0.80 0.00 0.00 0.91 0.00 0.00 21 P 0.00 5.52 0.00 1.91 2.15 0.00 3.72 0.00 0.00 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.04 0.00 22 T 8.68 4.88 4.35 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 1.37 0.00 0.00 23 K 8.74 4.25 0.00 1.60 1.74 0.00 1.25 0.00 0.00 0.74 0.00 0.00 2.66 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.69 1.06 7.81 24 G 8.97 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 25 S 7.61 4.51 0.00 4.06 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 26 A 8.77 3.86 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 27 T 7.62 4.35 4.21 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 1.18 0.00 0.00 28 A 7.81 4.05 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 29 A 8.50 4.04 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 30 G 7.34 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 0.00 0.00 0.00 0.00 31 Y 8.54 4.76 0.00 2.97 2.93 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 32 D 9.61 4.66 0.00 2.49 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 0.00 0.00 0.00 0.00 33 I 8.49 4.80 1.98 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.16 1.01 0.00 0.00 34 Y 8.83 5.17 0.00 2.86 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 9.42 4.50 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 0.00 0.00 0.00 0.00 0.00 0.00 36 S 9.04 4.97 0.00 3.89 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 37 Q 7.84 4.70 0.00 1.90 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.99 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 38 D 8.66 4.71 0.00 2.52 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.41 4.48 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.99 0.91 0.00 0.00 40 T 8.42 5.01 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 1.23 0.00 0.00 41 I 8.61 4.30 2.07 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 1.10 1.02 0.00 0.00 42 P 0.00 4.87 0.00 2.10 1.99 0.00 3.83 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.12 0.00 43 A 9.10 4.02 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 44 M 8.17 3.52 0.00 2.17 2.14 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 2.55 2.74 0.00 45 G 7.77 4.32 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 0.00 46 Q 8.84 5.22 0.00 2.33 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.70 0.00 0.00 0.00 0.00 0.00 2.27 2.45 0.00 47 G 9.07 4.32 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 0.00 48 M 8.44 5.25 0.00 1.98 1.88 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.50 0.00 49 V 9.05 4.34 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 1.03 0.00 0.00 0.99 0.00 0.00 50 S 8.79 4.78 0.00 3.84 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 51 T 8.19 4.47 4.35 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 1.34 0.00 0.00 52 D 8.85 4.48 0.00 2.86 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 I 7.63 5.24 2.00 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 1.37 1.16 1.03 0.00 0.00 54 S 9.28 5.07 0.00 3.78 3.59 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.94 5.12 0.00 2.99 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 T 8.63 4.65 4.29 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 1.29 0.00 0.00 57 V 8.60 4.14 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 0.85 0.00 0.00 1.10 0.00 0.00 58 P 0.00 4.64 0.00 2.08 1.96 0.00 3.59 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.11 0.00 59 V 8.68 3.69 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 0.76 0.00 0.00 0.98 0.00 0.00 60 G 9.52 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 T 7.75 5.91 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 1.21 0.00 0.00 62 Y 8.37 4.94 0.00 3.24 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 63 G 8.85 4.29 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 0.00 64 R 8.75 5.24 0.00 1.72 1.74 0.00 3.23 0.00 0.00 3.39 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.77 0.00 65 I 8.75 4.53 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 0.80 0.94 0.00 0.00 66 A 9.38 5.01 1.20 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 0.00 0.00 67 P 0.00 4.60 0.00 2.07 2.06 0.00 3.78 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.19 0.00 68 R 8.47 4.13 0.00 1.86 1.85 0.00 3.12 0.00 0.00 3.31 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 69 S 8.77 4.23 0.00 3.84 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 70 G 8.00 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 0.00 0.00 0.00 71 L 7.90 3.83 0.00 1.58 1.42 1.01 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 72 A 7.57 4.30 1.38 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 73 V 7.53 3.44 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 0.85 0.00 0.00 0.93 0.00 0.00 74 K 8.20 4.24 0.00 1.71 1.84 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.59 7.81 75 N 7.78 4.76 0.00 2.35 2.33 0.00 0.00 7.03 7.79 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 76 G 7.99 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 0.00 0.00 0.00 77 I 7.37 4.64 1.72 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.55 0.82 0.00 0.00 78 Q 9.13 4.90 0.00 2.26 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.98 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 79 T 8.72 4.47 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 1.20 0.00 0.00 80 G 8.11 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 9.93 3.61 1.05 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 82 G 9.03 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 0.00 0.00 0.00 83 V 7.44 4.46 1.99 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 0.46 0.00 0.00 0.84 0.00 0.00 84 V 8.71 4.17 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 0.81 0.00 0.00 1.04 0.00 0.00 85 D 8.57 4.89 0.00 2.85 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 86 R 8.91 4.01 0.00 1.85 2.03 0.00 3.35 0.00 0.00 3.32 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.82 0.00 87 D 7.99 4.70 0.00 2.85 2.79 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 88 Y 8.00 4.33 0.00 2.88 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 89 T 7.64 4.18 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 1.12 0.00 0.00 90 G 5.83 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 91 E 8.19 4.17 0.00 1.92 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 2.32 2.33 0.00 92 V 9.04 4.00 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 0.46 0.00 0.00 93 K 8.69 4.85 0.00 1.67 1.71 0.00 1.81 0.00 0.00 1.79 0.00 0.00 3.11 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.37 7.81 94 V 8.48 4.18 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 0.92 0.00 0.00 0.98 0.00 0.00 95 V 8.23 4.14 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 0.42 0.00 0.00 0.85 0.00 0.00 96 L 8.80 5.08 0.00 1.56 1.49 1.02 0.83 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 97 F 9.26 5.44 0.00 2.97 2.73 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 98 N 9.09 5.27 0.00 2.80 2.89 0.00 0.00 7.05 7.42 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 99 H 9.75 4.67 0.00 3.13 3.35 0.00 5.90 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 S 8.20 4.52 0.00 3.96 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 0.00 101 Q 8.69 4.31 0.00 2.08 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.72 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 102 R 7.64 4.75 0.00 1.73 1.87 0.00 3.21 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 103 D 8.93 4.73 0.00 2.60 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 0.00 104 F 9.18 4.99 0.00 3.01 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 A 8.24 4.48 1.10 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 0.00 0.00 106 I 8.34 4.40 1.91 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.15 0.88 0.00 0.00 107 K 9.01 4.98 0.00 1.60 1.65 0.00 1.69 0.00 0.00 1.53 0.00 0.00 2.74 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.28 1.45 7.81 108 K 9.12 3.98 0.00 1.66 1.77 0.00 1.83 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.59 7.81 109 G 9.42 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 0.00 110 D 8.20 4.69 0.00 2.70 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 0.00 111 R 8.39 4.44 0.00 1.53 1.57 0.00 2.97 0.00 0.00 3.03 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.25 0.00 112 V 8.20 4.49 2.16 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 0.78 0.00 0.00 1.00 0.00 0.00 113 A 7.29 4.54 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 Q 8.90 4.94 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.73 0.00 0.00 0.00 0.00 0.00 2.39 2.26 0.00 115 L 9.03 4.95 0.00 1.71 1.60 0.81 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 116 I 8.99 4.65 1.81 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.55 0.88 0.00 0.00 117 L 8.61 4.63 0.00 1.53 1.60 0.88 0.82 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 0.00 118 E 8.49 4.11 0.00 1.16 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.98 0.00 119 K 8.62 4.91 0.00 1.65 1.76 0.00 1.71 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.43 7.81 120 I 8.48 4.75 1.97 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.68 1.26 0.00 0.00 121 V 8.42 4.04 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 0.91 0.00 0.00 0.95 0.00 0.00 122 D 8.65 4.86 0.00 2.82 2.80 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 0.00 123 D 7.63 4.89 0.00 2.76 2.73 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 0.00 124 A 8.05 4.18 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 0.00 125 Q 8.41 4.24 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 126 I 8.23 4.12 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.49 0.91 0.00 0.00 127 V 8.22 4.29 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 0.80 0.00 0.00 0.93 0.00 0.00 128 V 8.35 4.15 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 0.87 0.00 0.00 0.93 0.00 0.00 129 V 7.91 4.62 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 0.81 0.00 0.00 0.97 0.00 0.00 130 D 8.77 4.50 0.00 2.64 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 0.00 131 S 7.71 4.69 0.00 3.75 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 0.00 132 L 8.74 4.15 0.00 1.66 1.70 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 133 E 7.56 4.70 0.00 2.01 1.75 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 2.16 2.08 0.00 134 E 7.82 4.34 0.00 2.02 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 2.31 2.25 0.00