NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 H 4.8490 8.4444 117.8459 55.5386 30.1364 172.7389 1 M 4.1385 8.5821 124.5063 54.9471 33.0580 174.9021 2 K 4.3452 9.1416 125.2080 55.6911 35.3830 177.8574 3 L 4.0041 8.4379 123.0846 58.3569 42.2226 179.5507 4 S 4.0798 8.4450 114.3301 61.3969 62.8210 176.4107 5 E 3.9939 7.9984 121.8425 58.8522 29.2857 178.8562 6 L 3.9572 7.9708 120.4797 58.2179 42.1955 178.6789 7 Q 3.8649 8.1732 118.5758 59.3013 28.5087 179.5609 8 S 4.0666 7.6663 112.8042 60.9840 63.5811 175.7135 9 H 4.3623 8.3864 122.2318 59.3548 29.6126 177.0245 10 I 2.4746 7.5300 121.5230 64.1228 36.6364 178.2946 11 K 3.6784 7.6570 119.0067 59.1976 31.9348 178.0770 12 E 4.0885 7.7103 119.2506 58.3548 29.7270 177.2645 13 F 4.9685 7.5100 109.9015 56.7532 39.3967 175.4834 14 D 4.7278 7.8572 120.8680 52.7575 41.4216 172.2106 15 Y 4.5574 8.0691 121.0954 55.9386 40.0507 173.6525 16 A 4.6584 8.9391 130.5999 47.5703 19.0127 174.5174 17 P 4.0143 0.0000 0.0000 65.3551 31.2182 178.3815 18 E 4.1591 8.0358 115.3971 57.6116 30.6297 176.2365 19 Q 4.7505 8.2133 119.5961 54.9311 29.8225 176.8445 20 S 4.4338 8.1635 115.3377 61.6735 63.8721 176.8632 21 E 3.9050 8.4528 120.3550 59.2510 29.0559 178.3018 22 H 4.1786 7.9791 116.9611 60.0812 29.8293 176.6247 23 Y 4.0073 8.1448 117.5734 60.6077 37.7321 177.9532 24 F 4.1886 8.1379 121.5216 60.9800 39.6099 177.0092 25 F 4.1672 8.1633 117.7626 60.6852 38.7550 177.8287 26 K 3.5659 7.9809 118.0521 58.9719 31.5447 178.9563 27 L 3.8760 7.4348 120.5370 58.4029 41.8776 179.2198 28 I 3.5217 7.1813 119.3604 64.2013 36.9188 178.0901 29 E 3.8834 8.1037 119.4689 59.7540 29.3485 179.4928 30 E 3.9948 8.2155 118.3179 59.1950 29.4798 179.5166 31 V 3.7341 8.1326 118.8669 65.7248 31.6387 178.3372 32 G 3.5751 8.3149 105.7042 47.9358 0.0000 175.3871 33 E 3.9807 8.2772 121.7447 58.8674 29.3911 179.1599 34 L 3.9280 8.3895 120.5488 58.3164 42.0522 178.8623 35 S 4.0597 8.1700 112.9389 61.4208 62.2185 175.7393 36 E 3.9243 8.0965 121.7922 59.4036 29.2437 179.0097 37 S 4.1364 8.1036 114.2929 61.4731 62.9544 176.5619 38 I 3.7281 8.0661 123.6522 64.0162 36.6479 178.0779 39 R 3.8972 8.0270 118.8070 59.4663 29.9682 177.8793 40 K 4.3388 8.1371 114.7442 55.6786 32.3547 176.9592 41 G 3.8942 8.0735 107.5843 46.7303 0.0000 174.9448 42 K 4.2788 7.8531 117.1801 55.3456 31.1983 176.4662 43 S 4.6744 7.4893 115.4690 57.9980 64.9254 174.6448 44 G 3.7672 8.6130 108.1715 45.5115 0.0000 172.3948 45 Q 4.3641 8.1326 119.7550 53.4432 28.8945 173.4048 46 P 4.6285 0.0000 0.0000 62.4949 32.3517 176.2217 47 T 4.2560 8.3877 110.5737 60.5121 70.0118 175.2499 48 L 3.8758 8.6491 122.0829 58.8312 41.5432 178.5659 49 D 4.4289 8.0951 116.0053 56.2608 40.9440 177.2432 50 E 4.4888 7.6345 116.9701 56.0626 30.4258 177.1906 51 L 4.1722 7.5110 121.8102 56.7488 42.0232 176.6535 52 K 4.1515 7.6465 119.4738 58.1883 32.1266 176.6051 53 G 4.0021 9.2061 114.9964 46.2416 0.0000 174.1169 54 S 4.3753 7.8554 115.4180 57.7176 65.1760 175.0816 55 V 3.6732 8.6652 123.9259 65.4806 31.1711 178.1966 56 A 3.9893 8.0127 119.7536 55.3288 18.1955 178.9509 57 E 3.9871 8.1102 117.5011 59.6858 29.1710 178.9739 58 E 4.0363 8.2941 118.5610 59.2245 29.4852 179.2706 59 L 4.0387 8.5299 119.5311 57.9525 41.7390 178.7875 60 Y 4.0234 8.5340 119.8221 60.9922 38.7213 178.0756 61 D 4.4128 8.5819 119.9850 57.1323 40.8095 178.9373 62 V 3.6578 7.9952 118.8722 65.9127 31.5513 177.5849 63 L 3.8437 7.8988 120.1112 58.4180 41.7588 178.0738 64 Y 3.7051 7.9113 119.5115 61.1888 38.5901 178.0595 65 Y 4.3098 7.9083 116.7170 60.5861 37.9874 178.2447 66 V 3.6378 8.0974 119.7508 66.3067 31.6296 177.9394 67 C 4.0510 8.1630 116.1798 62.6756 27.9626 175.9446 68 A 3.7559 8.0789 122.7603 55.0703 17.8815 179.7130 69 L 3.9694 8.5292 117.7406 57.7146 41.6407 179.4686 70 A 3.9877 8.0599 120.7476 55.2414 18.4288 179.2956 71 N 4.1387 8.1007 114.8105 56.7230 38.4351 177.7506 72 I 3.8446 7.5569 119.5107 64.1461 37.1386 177.2539 73 H 4.7955 8.3149 114.9676 54.6095 28.9768 175.1897 74 G 3.8782 7.8327 107.7142 46.7120 0.0000 174.1652 75 V 4.1214 8.2472 119.2878 60.7330 33.1138 174.8203 76 N 4.6968 8.4327 125.3118 52.1466 39.7932 175.3629 77 L 3.9633 8.5290 129.1636 57.9312 41.9453 179.3593 78 E 3.9550 8.1912 118.0496 59.4396 29.4253 179.4898 79 K 4.0347 8.3094 118.4318 59.4526 32.0183 179.4763 80 T 3.8234 8.1282 116.3853 66.6796 68.3406 176.2332 81 R 3.8648 8.2059 120.7370 59.7926 30.0231 178.2572 82 E 3.9450 8.0495 117.6709 59.3139 29.4198 179.2297 83 L 3.9659 7.8074 119.9621 57.9752 42.1489 178.9717 84 K 3.9316 8.2514 118.6792 59.3933 31.8771 178.7458 85 E 3.8647 8.4915 119.8316 59.2681 29.3358 178.8221 86 V 3.5825 7.4466 116.7904 66.2176 31.7078 177.6680 87 L 4.1465 7.9886 118.3358 57.9719 41.5486 179.1530 88 N 4.3557 8.8388 116.7422 56.4727 38.2547 177.5388 89 K 4.1727 8.2394 118.8609 58.8685 32.2503 179.0665 90 V 3.9425 7.4428 110.8242 62.3936 31.7680 176.8025 91 K 4.0498 7.8598 119.1866 56.6545 32.6061 175.8607 92 Y 3.3840 7.8917 123.6456 58.1654 39.4464 168.3898 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 0 H 8.44 4.85 0.00 3.17 3.30 0.00 5.67 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 1 M 8.58 4.14 0.00 2.09 1.99 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.65 0.00 2 K 9.14 4.35 0.00 1.92 1.87 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.44 7.81 3 L 8.44 4.00 0.00 1.75 1.82 0.90 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 4 S 8.44 4.08 0.00 4.07 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 0.00 5 E 8.00 3.99 0.00 2.21 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 2.39 2.35 0.00 6 L 7.97 3.96 0.00 1.81 1.82 1.08 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 7 Q 8.17 3.86 0.00 2.21 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.60 0.00 0.00 0.00 0.00 0.00 2.28 2.43 0.00 8 S 7.67 4.07 0.00 3.98 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 9 H 8.39 4.36 0.00 3.36 3.54 0.00 5.62 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 10 I 7.53 2.47 1.61 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.53 0.12 0.00 0.00 11 K 7.66 3.68 0.00 1.54 1.76 0.00 1.28 0.00 0.00 1.24 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.01 0.59 7.81 12 E 7.71 4.09 0.00 2.20 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 0.00 2.42 2.36 0.00 13 F 7.51 4.97 0.00 3.13 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 14 D 7.86 4.73 0.00 2.77 2.48 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 0.00 0.00 0.00 0.00 15 Y 8.07 4.56 0.00 2.84 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 16 A 8.94 4.66 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.01 0.00 2.03 1.85 0.00 3.44 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.66 0.00 18 E 8.04 4.16 0.00 2.21 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 0.00 2.34 2.35 0.00 19 Q 8.21 4.75 0.00 2.20 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.82 0.00 0.00 0.00 0.00 0.00 2.28 2.26 0.00 20 S 8.16 4.43 0.00 3.99 4.09 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 21 E 8.45 3.91 0.00 2.16 1.83 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 2.38 2.39 0.00 22 H 7.98 4.18 0.00 3.30 3.52 0.00 5.78 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 23 Y 8.14 4.01 0.00 3.41 3.25 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 24 F 8.14 4.19 0.00 3.15 3.04 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 25 F 8.16 4.17 0.00 3.17 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 26 K 7.98 3.57 0.00 0.79 0.74 0.00 1.61 0.00 0.00 1.38 0.00 0.00 2.87 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.10 1.03 7.81 27 L 7.43 3.88 0.00 1.88 1.58 1.01 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 28 I 7.18 3.52 1.79 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.35 0.83 0.00 0.00 29 E 8.10 3.88 0.00 2.04 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 2.25 2.49 0.00 30 E 8.22 3.99 0.00 2.16 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 0.00 2.58 2.91 0.00 31 V 8.13 3.73 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 1.00 0.00 0.00 0.94 0.00 0.00 32 G 8.31 3.58 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 0.00 0.00 0.00 33 E 8.28 3.98 0.00 2.15 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 0.00 2.33 2.48 0.00 34 L 8.39 3.93 0.00 1.80 1.93 0.94 0.84 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 35 S 8.17 4.06 0.00 4.01 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 36 E 8.10 3.92 0.00 2.11 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 0.00 2.31 2.32 0.00 37 S 8.10 4.14 0.00 4.25 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 38 I 8.07 3.73 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.80 0.92 0.00 0.00 39 R 8.03 3.90 0.00 1.86 2.17 0.00 3.25 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 40 K 8.14 4.34 0.00 1.77 1.83 0.00 1.89 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.53 7.81 41 G 8.07 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 0.00 0.00 0.00 42 K 7.85 4.28 0.00 1.86 1.79 0.00 1.70 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.41 7.81 43 S 7.49 4.67 0.00 3.86 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 44 G 8.61 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 8.13 4.36 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.98 0.00 0.00 0.00 0.00 0.00 2.26 2.38 0.00 46 P 0.00 4.63 0.00 2.21 2.04 0.00 3.82 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 47 T 8.39 4.26 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 1.21 0.00 0.00 48 L 8.65 3.88 0.00 1.75 1.71 0.89 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 49 D 8.10 4.43 0.00 2.68 2.71 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 0.00 0.00 0.00 0.00 50 E 7.63 4.49 0.00 1.94 1.97 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 2.26 2.28 0.00 51 L 7.51 4.17 0.00 2.00 1.73 0.90 0.26 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 52 K 7.65 4.15 0.00 1.75 1.74 0.00 1.87 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.46 7.81 53 G 9.21 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 0.00 0.00 0.00 54 S 7.86 4.38 0.00 4.09 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 55 V 8.67 3.67 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 1.17 0.00 0.00 0.95 0.00 0.00 56 A 8.01 3.99 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 57 E 8.11 3.99 0.00 2.19 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 2.37 2.44 0.00 58 E 8.29 4.04 0.00 2.08 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 0.00 2.64 2.69 0.00 59 L 8.53 4.04 0.00 1.90 1.77 0.95 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 60 Y 8.53 4.02 0.00 3.14 3.26 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 61 D 8.58 4.41 0.00 2.94 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 62 V 8.00 3.66 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 1.10 0.00 0.00 1.04 0.00 0.00 63 L 7.90 3.84 0.00 1.72 1.64 0.89 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 64 Y 7.91 3.71 0.00 2.63 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 65 Y 7.91 4.31 0.00 3.23 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 66 V 8.10 3.64 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 1.03 0.00 0.00 0.97 0.00 0.00 67 C 8.16 4.05 0.00 2.89 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 68 A 8.08 3.76 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 69 L 8.53 3.97 0.00 1.98 1.84 1.18 1.16 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 70 A 8.06 3.99 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 71 N 8.10 4.14 0.00 2.82 2.67 0.00 0.00 7.09 6.65 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 72 I 7.56 3.84 1.79 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 -0.13 0.68 0.00 0.00 73 H 8.31 4.80 0.00 3.20 3.29 0.00 5.80 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 7.83 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 75 V 8.25 4.12 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 0.77 0.00 0.00 0.99 0.00 0.00 76 N 8.43 4.70 0.00 2.76 2.66 0.00 0.00 7.23 6.66 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 77 L 8.53 3.96 0.00 1.74 1.68 0.89 0.55 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 78 E 8.19 3.95 0.00 2.11 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 0.00 2.39 2.39 0.00 79 K 8.31 4.03 0.00 1.96 1.84 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.46 7.81 80 T 8.13 3.82 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 1.20 0.00 0.00 81 R 8.21 3.86 0.00 1.84 2.07 0.00 3.09 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 82 E 8.05 3.95 0.00 2.24 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 0.00 2.32 2.53 0.00 83 L 7.81 3.97 0.00 2.01 1.75 0.92 0.87 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 84 K 8.25 3.93 0.00 2.01 1.85 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.64 7.81 85 E 8.49 3.86 0.00 2.00 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 2.29 2.30 0.00 86 V 7.45 3.58 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 0.90 0.00 0.00 0.96 0.00 0.00 87 L 7.99 4.15 0.00 1.91 1.71 0.92 0.50 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 88 N 8.84 4.36 0.00 2.83 2.86 0.00 0.00 7.08 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 89 K 8.24 4.17 0.00 1.95 1.92 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.55 7.81 90 V 7.44 3.94 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 0.72 0.00 0.00 0.98 0.00 0.00 91 K 7.86 4.05 0.00 2.05 1.95 0.00 1.90 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.40 7.81 92 Y 7.89 3.38 0.00 3.22 3.21 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 0.00