NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3813 0.0000 0.0000 61.8945 32.6432 176.0230 3 K 3.9370 8.6034 121.5128 55.8758 32.6934 175.1285 4 K 4.2270 9.0291 125.2663 56.5128 34.1434 175.6098 5 V 4.8386 8.3047 124.9053 61.4791 33.7967 174.4036 6 L 4.7822 8.9310 128.0738 53.1864 45.0745 175.5162 7 T 4.9872 8.1439 117.4294 61.9916 70.8970 173.7741 8 G 4.1843 8.9245 112.2889 45.4457 0.0000 172.0122 9 V 4.7175 8.3161 119.6472 60.2594 34.1001 175.5133 10 V 4.2334 8.7564 123.5963 62.4145 32.2915 176.3464 11 V 4.2878 8.0482 120.7602 60.4297 32.8824 175.5523 12 S 4.6602 7.3180 112.2245 57.5766 65.5342 176.4008 13 D 4.8758 8.1211 125.7795 53.3342 39.9795 176.0844 14 K 4.4726 7.8055 115.8281 57.5559 31.9470 176.6516 15 M 4.8381 7.6275 118.7268 53.1503 35.1821 175.1539 16 Q 4.1782 8.6941 121.5594 57.0347 29.3286 176.0995 17 K 4.7002 9.1676 120.5568 56.5689 30.4784 174.5801 18 T 5.1916 7.7551 114.0534 62.0817 72.4216 173.8798 19 V 4.6763 8.6585 118.7418 59.7949 35.5212 174.9787 20 T 4.6766 8.6601 122.1116 62.9716 69.6385 173.9157 21 V 4.5186 8.9169 128.3491 61.0885 33.4583 174.4056 22 L 4.4515 9.2162 132.0373 54.4562 43.3923 175.3730 23 V 4.7066 9.0805 126.5795 61.1913 34.1596 174.4101 24 E 5.2847 8.6050 126.6386 55.0962 32.6342 175.2890 25 R 4.7630 8.5130 115.1890 55.4449 32.9427 173.8636 26 Q 5.2507 8.4562 120.2997 54.6680 31.7340 174.3801 27 F 4.7602 8.2016 113.2421 55.3627 41.6885 171.3555 28 P 4.7696 0.0000 0.0000 62.5763 31.9577 175.7721 29 H 4.2645 8.9931 125.3964 55.4706 30.2260 174.3383 30 P 4.3193 0.0000 0.0000 65.1401 31.1624 176.3572 31 L 4.3524 8.1307 117.6695 56.4264 43.7181 176.3570 32 Y 4.5539 7.5381 112.2641 57.6851 38.3558 175.8703 33 G 4.2953 7.7968 114.5013 46.4853 0.0000 173.6496 34 K 4.2670 7.4251 120.2299 53.4588 33.3544 174.7661 35 V 4.0794 8.5118 128.3651 63.1439 31.9021 175.3614 36 I 4.2426 7.9398 122.5125 59.5451 40.3981 174.6504 37 K 4.8919 8.2086 122.4655 55.0619 34.4947 175.2083 38 R 5.0408 8.9575 126.3072 54.6183 34.0465 174.8022 39 S 5.1537 8.4429 114.0694 57.4226 66.6573 172.6635 40 K 4.6486 9.3374 120.4388 55.1534 35.9516 174.3583 41 K 5.0874 8.4201 123.9065 54.9695 34.1928 175.2312 42 Y 4.5467 8.8910 122.1873 56.0310 41.0705 174.8486 43 L 4.8617 8.7090 123.8657 54.0859 42.5099 175.9702 44 A 5.0943 9.0502 126.6484 50.3199 22.5161 174.7658 45 H 4.9022 9.0580 120.4812 55.8252 31.2921 174.2844 46 D 5.0339 9.1887 125.4809 51.3301 40.5815 173.5142 47 P 4.1371 0.0000 0.0000 65.4010 31.5364 178.2085 48 E 4.2153 8.1763 114.7873 55.6631 29.7561 175.8626 49 E 3.9959 7.6980 117.1210 57.1368 27.7699 176.1357 50 K 3.8996 8.5208 121.2282 58.9866 32.5928 176.5283 51 Y 4.5287 8.5591 116.5057 56.8122 39.0244 175.0547 52 K 4.6166 10.0793 123.9285 53.8848 34.7171 175.6217 53 L 4.1470 7.8250 121.9408 56.9028 42.2185 177.5089 54 G 4.0819 8.9748 114.3610 45.1013 0.0000 172.9342 55 D 4.5742 8.2800 120.6657 54.2807 42.4622 175.8753 56 V 4.6058 8.7627 123.4111 61.8396 32.6103 174.9820 57 V 4.8675 8.5656 121.2098 59.5636 35.5089 174.5550 58 E 4.9103 8.9438 121.4779 55.1358 31.7482 175.5423 59 I 4.9641 9.1345 124.6061 59.5187 40.9502 174.4415 60 I 5.2738 8.6001 125.0083 58.9116 41.4885 174.0973 61 E 3.0531 9.2295 128.3713 57.2968 29.7874 176.7776 62 S 4.5725 7.9763 117.9983 56.7090 67.7201 174.1756 63 R 3.8267 8.5342 122.1528 55.7345 30.2787 174.4741 64 P 4.2494 0.0000 0.0000 63.4810 31.6969 175.8524 65 I 4.1074 8.1793 123.5910 62.5110 38.4183 175.3431 66 S 4.4776 7.2534 112.6957 57.2314 64.9394 174.7320 67 K 4.1313 8.5280 121.5132 57.3485 32.2511 176.0645 68 R 3.7353 8.7302 120.8015 56.6823 28.8933 176.2468 69 K 4.6456 7.9015 117.3563 55.9068 33.3546 175.6546 70 R 5.0102 8.5287 128.2786 55.4555 31.8935 174.8546 71 F 5.2541 8.3778 115.3811 56.1067 43.9853 173.9248 72 R 5.0549 8.7064 120.4066 54.1027 33.6887 175.3436 73 V 3.7419 8.0425 122.8733 63.1089 31.2799 175.5850 74 L 4.2817 8.9608 132.1573 57.3673 42.2110 176.7897 75 R 4.7729 7.5432 112.2999 55.4237 33.0607 172.0947 76 L 4.8305 8.5646 121.1572 54.2518 42.6817 175.9345 77 V 4.2727 8.6618 125.9186 64.2480 33.2425 174.8921 78 E 4.9606 7.7150 116.3310 56.6636 32.2619 174.9208 79 S 4.8494 8.3745 113.0687 58.2721 65.7249 173.0156 80 G 3.9348 8.5962 105.3223 47.5993 0.0000 174.3521 81 R 4.6863 7.3956 114.1028 55.3878 30.2122 178.0735 82 M 4.3043 7.7573 117.9210 57.2017 32.3667 178.0499 83 D 4.3446 7.9593 120.1690 56.3895 39.8535 178.3869 84 L 3.9727 7.9626 120.5486 57.3983 41.6717 179.5237 85 V 3.6739 7.8012 117.6566 66.0556 31.4745 177.3963 86 E 3.9212 8.4042 118.4793 59.5903 29.2978 179.2614 87 K 3.8056 7.9686 118.0974 59.8948 32.2091 178.3439 88 Y 4.1418 7.8896 118.8854 60.9298 38.6917 178.3451 89 L 3.6081 8.3510 119.8917 57.8280 41.6220 179.7125 90 I 3.6315 8.0682 120.0773 64.0924 36.9097 178.1927 91 R 3.8003 7.9271 119.8385 59.5265 29.5705 178.5040 92 R 3.0323 7.0373 116.6782 59.0534 30.1799 177.7613 93 Q 3.9934 8.1350 119.7373 59.1101 28.7734 177.5806 94 N 4.2164 8.5637 117.9557 57.3072 39.2457 175.6209 95 Y 4.5960 7.7003 117.5066 61.3610 37.8408 178.4445 96 E 4.3085 8.0355 116.6562 56.7986 29.0203 177.4280 97 S 4.9121 8.1604 112.2817 58.1962 63.5858 174.6230 98 L 4.6679 8.2571 121.5274 55.3883 44.2637 176.9981 99 S 4.8872 7.6642 113.9192 57.5965 64.0818 174.5757 100 K 4.3594 8.6386 121.4247 57.4340 31.9446 177.0372 101 R 4.6705 7.6389 117.8949 55.8302 31.2847 176.9643 102 G 4.4161 8.0589 109.6764 47.5567 0.0000 172.5770 103 G 4.0252 7.4951 114.8166 46.7043 0.0000 173.1423 104 K 4.0565 7.8661 120.4442 55.1991 33.1663 177.3419 105 A 4.1832 8.5143 125.0820 52.4951 18.4517 177.1096 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 P 0.00 4.38 0.00 2.19 2.12 0.00 3.75 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 1.88 1.99 0.00 3 K 8.60 3.94 0.00 1.72 1.73 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.80 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.47 7.81 4 K 9.03 4.23 0.00 2.00 1.87 0.00 1.48 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.51 1.47 7.81 5 V 8.30 4.84 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 0.92 0.00 0.00 0.94 0.00 0.00 6 L 8.93 4.78 0.00 1.05 1.19 0.08 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.14 4.99 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 1.21 0.00 0.00 8 G 8.92 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 0.00 0.00 0.00 9 V 8.32 4.72 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 0.68 0.00 0.00 0.92 0.00 0.00 10 V 8.76 4.23 2.21 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 1.01 0.00 0.00 0.97 0.00 0.00 11 V 8.05 4.29 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 0.48 0.00 0.00 0.54 0.00 0.00 12 S 7.32 4.66 0.00 3.89 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 13 D 8.12 4.88 0.00 2.91 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 14 K 7.81 4.47 0.00 1.87 1.88 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.57 7.81 15 M 7.63 4.84 0.00 2.02 2.07 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 2.52 2.48 0.00 16 Q 8.69 4.18 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 17 K 9.17 4.70 0.00 2.03 1.84 0.00 1.65 0.00 0.00 1.78 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.56 1.36 7.81 18 T 7.76 5.19 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 1.32 0.00 0.00 19 V 8.66 4.68 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 0.79 0.00 0.00 0.93 0.00 0.00 20 T 8.66 4.68 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 1.12 0.00 0.00 21 V 8.92 4.52 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 0.88 0.00 0.00 0.83 0.00 0.00 22 L 9.22 4.45 0.00 1.48 1.38 0.90 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 23 V 9.08 4.71 2.15 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 0.91 0.00 0.00 0.70 0.00 0.00 24 E 8.61 5.28 0.00 1.88 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 2.25 2.28 0.00 25 R 8.51 4.76 0.00 1.95 2.02 0.00 2.68 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.77 0.00 26 Q 8.46 5.25 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.89 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 27 F 8.20 4.76 0.00 3.19 3.17 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 28 P 0.00 4.77 0.00 2.06 2.11 0.00 3.92 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.98 0.00 29 H 8.99 4.26 0.00 3.31 3.27 0.00 5.61 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.32 0.00 2.18 2.21 0.00 3.29 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.92 0.00 31 L 8.13 4.35 0.00 1.30 0.96 0.79 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 7.54 4.55 0.00 2.84 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 33 G 7.80 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 34 K 7.43 4.27 0.00 1.88 1.70 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.79 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.49 7.81 35 V 8.51 4.08 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 0.80 0.00 0.00 0.93 0.00 0.00 36 I 7.94 4.24 1.70 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 -0.28 0.96 0.00 0.00 37 K 8.21 4.89 0.00 1.68 1.66 0.00 1.70 0.00 0.00 2.09 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.46 7.81 38 R 8.96 5.04 0.00 2.10 1.91 0.00 3.24 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 39 S 8.44 5.15 0.00 3.97 3.83 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 40 K 9.34 4.65 0.00 1.78 1.69 0.00 0.61 0.00 0.00 1.04 0.00 0.00 2.72 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.08 1.29 7.81 41 K 8.42 5.09 0.00 1.58 1.62 0.00 1.62 0.00 0.00 1.39 0.00 0.00 2.77 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.16 1.34 7.81 42 Y 8.89 4.55 0.00 2.68 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.71 4.86 0.00 1.72 1.67 0.94 0.78 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 44 A 9.05 5.09 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 45 H 9.06 4.90 0.00 3.29 3.23 0.00 5.73 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 9.19 5.03 0.00 2.77 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.14 0.00 2.23 2.20 0.00 3.82 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.05 0.00 48 E 8.18 4.22 0.00 1.97 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 49 E 7.70 4.00 0.00 2.09 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 2.26 2.37 0.00 50 K 8.52 3.90 0.00 1.52 1.52 0.00 1.12 0.00 0.00 1.39 0.00 0.00 2.90 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.57 1.13 7.81 51 Y 8.56 4.53 0.00 2.99 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 52 K 10.08 4.62 0.00 1.99 1.71 0.00 1.57 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 1.39 7.81 53 L 7.83 4.15 0.00 1.85 1.61 1.02 1.16 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 54 G 8.97 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 55 D 8.28 4.57 0.00 2.79 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 V 8.76 4.61 2.19 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 0.82 0.00 0.00 0.93 0.00 0.00 57 V 8.57 4.87 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 0.73 0.00 0.00 0.80 0.00 0.00 58 E 8.94 4.91 0.00 1.85 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 2.22 2.26 0.00 59 I 9.13 4.96 1.63 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.70 0.57 0.00 0.00 60 I 8.60 5.27 1.90 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 1.21 1.66 0.96 0.00 0.00 61 E 9.23 3.05 0.00 1.77 1.69 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 1.90 2.22 0.00 62 S 7.98 4.57 0.00 3.62 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 63 R 8.53 3.83 0.00 1.72 1.80 0.00 3.41 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 64 P 0.00 4.25 0.00 2.05 2.01 0.00 3.68 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.12 0.00 65 I 8.18 4.11 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 1.15 0.25 0.81 0.00 0.00 66 S 7.25 4.48 0.00 3.94 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 K 8.53 4.13 0.00 1.74 1.76 0.00 1.93 0.00 0.00 1.64 0.00 0.00 2.77 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.43 1.43 7.81 68 R 8.73 3.74 0.00 1.95 1.98 0.00 3.31 0.00 0.00 3.15 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.66 0.00 69 K 7.90 4.65 0.00 1.81 1.86 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.69 7.81 70 R 8.53 5.01 0.00 1.84 1.67 0.00 3.22 0.00 0.00 3.36 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 0.00 71 F 8.38 5.25 0.00 2.93 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 72 R 8.71 5.05 0.00 1.77 1.82 0.00 3.17 0.00 0.00 3.10 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.54 0.00 73 V 8.04 3.74 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 -0.56 0.00 0.00 0.65 0.00 0.00 74 L 8.96 4.28 0.00 1.65 1.66 0.92 0.85 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 75 R 7.54 4.77 0.00 1.95 2.05 0.00 3.02 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 76 L 8.56 4.83 0.00 1.81 1.66 1.20 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 77 V 8.66 4.27 2.26 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 0.84 0.00 0.00 0.93 0.00 0.00 78 E 7.72 4.96 0.00 2.03 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.17 0.00 79 S 8.37 4.85 0.00 4.00 3.97 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 80 G 8.60 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 81 R 7.40 4.69 0.00 1.96 2.00 0.00 3.35 0.00 0.00 3.22 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00 82 M 7.76 4.30 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.55 0.00 83 D 7.96 4.34 0.00 2.87 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 84 L 7.96 3.97 0.00 1.89 1.77 0.92 0.87 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 85 V 7.80 3.67 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 1.05 0.00 0.00 1.01 0.00 0.00 86 E 8.40 3.92 0.00 2.24 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 2.64 2.52 0.00 87 K 7.97 3.81 0.00 2.03 1.90 0.00 1.70 0.00 0.00 1.58 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.67 7.81 88 Y 7.89 4.14 0.00 3.07 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 L 8.35 3.61 0.00 1.77 1.60 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 90 I 8.07 3.63 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 1.36 1.07 0.86 0.00 0.00 91 R 7.93 3.80 0.00 1.83 1.88 0.00 3.05 0.00 0.00 2.81 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.61 0.00 92 R 7.04 3.03 0.00 1.25 1.64 0.00 3.05 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.44 0.00 93 Q 8.13 3.99 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.51 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 94 N 8.56 4.22 0.00 2.84 3.00 0.00 0.00 7.28 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 95 Y 7.70 4.60 0.00 3.16 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 96 E 8.04 4.31 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 2.36 2.40 0.00 97 S 8.16 4.91 0.00 3.94 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 98 L 8.26 4.67 0.00 1.64 1.69 0.81 0.92 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 99 S 7.66 4.89 0.00 3.95 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 0.00 100 K 8.64 4.36 0.00 1.77 1.88 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.45 7.81 101 R 7.64 4.67 0.00 1.70 1.88 0.00 3.32 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 102 G 8.06 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 G 7.50 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 K 7.87 4.06 0.00 1.76 1.76 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.37 7.81 105 A 8.51 4.18 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