NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5351 8.2893 120.3450 55.5037 33.5867 173.5482 2 R 4.5739 8.9206 117.0316 53.0163 32.5934 174.8286 3 M 4.3146 8.3703 118.0246 58.2192 33.5431 178.7869 4 D 4.4378 8.0191 117.4546 55.2815 40.7187 178.4733 5 E 3.9424 8.9862 120.8841 59.4142 29.4268 178.2748 6 F 4.0317 8.4086 120.1074 61.9514 39.3378 176.3345 7 Y 3.5210 8.8520 115.9502 61.3704 37.6385 179.0802 8 T 3.8212 7.9048 116.2255 66.6693 68.4026 176.6643 9 K 4.0388 8.3355 120.4571 59.4157 32.0771 179.3751 10 V 3.6512 7.2820 118.3953 66.4289 31.3223 177.7918 11 Y 4.4868 7.4330 116.1196 61.0650 37.4179 178.2407 12 D 4.3935 8.3603 119.4653 57.1895 41.1338 177.9868 13 A 4.3386 8.9834 122.4377 55.7181 18.2808 180.0061 14 V 3.3543 7.9552 116.2316 66.2207 31.4221 177.8390 15 C 3.9742 7.9277 115.6261 62.8325 28.0222 175.4854 16 E 4.0250 8.7214 119.4232 56.7072 29.3000 177.0200 17 I 3.0323 6.9911 121.8453 59.3420 37.8935 174.1722 18 P 4.0609 0.0000 0.0000 62.8061 31.8989 174.6828 19 Y 4.0296 8.3277 121.4239 58.6040 39.2636 177.2777 20 G 3.8472 8.7159 115.1959 45.3530 0.0000 172.9100 21 K 4.9149 7.5986 118.0511 54.8050 35.2209 175.2856 22 V 4.6877 9.3755 114.7270 60.0522 36.7573 174.1989 23 S 4.8677 9.8337 116.2685 57.1706 66.7324 171.9374 24 T 4.7198 8.1522 115.5928 60.7661 69.0725 174.1953 25 Y 4.1620 8.8094 126.3040 61.6568 38.0179 179.3773 26 G 3.9655 8.4777 105.3796 48.4607 0.0000 175.0211 27 E 4.0649 8.1841 120.2972 59.1664 29.3725 179.4810 28 I 3.7203 7.9604 119.7276 64.3164 37.2154 177.5897 29 A 4.1243 8.0765 121.1705 55.9074 18.0651 179.3983 30 R 3.8874 8.2930 114.8742 59.9321 30.1446 178.2427 31 Y 4.1998 8.6377 118.9749 61.0104 38.8289 178.2050 32 V 4.1012 7.9523 110.1572 61.1376 31.8251 176.7493 33 G 3.9952 8.5216 107.5795 45.6142 0.0000 174.5502 34 M 4.8146 8.0322 118.0321 52.9888 31.8253 175.0489 35 P 4.3995 0.0000 0.0000 65.0422 32.1830 178.0007 36 S 4.7207 8.2765 109.7955 58.3846 63.7379 173.3286 37 Y 4.1810 8.6742 119.6455 58.3845 38.3173 178.1513 38 A 4.1296 8.2661 124.2828 55.5443 19.1612 179.8275 39 R 3.9792 8.1888 114.8733 59.3452 30.3313 178.6409 40 Q 4.2040 7.9072 114.4276 57.8078 29.4765 177.7968 41 V 3.7011 8.7019 119.4937 66.0361 31.2332 178.2021 42 G 3.6864 8.2118 105.3449 48.1160 0.0000 175.8803 43 Q 4.0671 8.1074 120.7284 58.3001 28.5824 178.3387 44 A 3.6681 8.4081 121.5509 55.2977 18.2651 179.5182 45 M 4.2802 7.6503 116.1748 58.4898 32.4566 178.1876 46 K 4.0269 8.2603 120.1607 59.9528 32.2611 177.9085 47 H 4.8595 8.6275 114.7012 55.4841 29.9609 175.4319 48 L 4.5341 7.1292 119.9020 53.2612 43.6436 176.7935 49 H 4.5210 8.1795 117.5063 55.5159 29.1766 175.4850 50 P 4.7013 0.0000 0.0000 62.9678 30.5904 177.3729 51 E 4.3355 8.4241 120.5889 57.6155 30.5566 177.1873 52 T 3.7238 7.8672 111.9072 63.0336 67.4576 173.0780 53 H 4.5409 8.5626 122.8849 56.6290 28.7119 175.0213 54 V 4.1515 9.7225 120.5707 60.7616 32.7482 175.5007 55 P 4.3540 0.0000 0.0000 61.2833 30.3768 177.7854 56 W 4.5025 7.9588 117.4289 60.6760 28.2169 177.6182 57 H 4.1843 6.4393 112.5047 57.1837 27.9077 175.8513 58 R 4.0445 7.9424 119.7214 56.1204 29.9801 175.1565 59 V 4.6343 7.2513 119.1762 61.1845 32.9769 174.7950 60 I 4.7396 8.4152 121.2938 59.3087 41.6511 173.7711 61 N 5.6896 8.7344 119.1535 52.1995 38.9250 176.4393 62 S 4.8910 8.7995 112.9266 59.3444 63.4420 174.7049 63 R 4.2679 8.0463 119.6431 56.2641 30.1259 176.7964 64 G 3.9070 9.2946 107.9203 46.1094 0.0000 173.4256 65 T 5.0753 8.0618 111.4130 59.6723 72.1611 172.3944 66 I 4.8659 7.6854 120.9410 59.9503 39.4725 176.1945 67 S 4.5711 8.7812 122.0822 57.9740 63.5191 174.9925 68 K 3.9690 8.9467 122.4759 57.5029 32.0781 177.5764 69 R 3.8020 8.4177 116.9581 57.9833 30.0357 177.2589 70 D 3.9466 9.5343 113.7029 52.5463 42.9622 179.9779 71 I 3.2178 8.0655 121.2622 62.0252 32.8756 173.2122 72 S 3.7288 8.2565 121.8124 56.8273 63.8231 172.7058 73 A 4.0460 8.9302 122.7600 54.9854 18.8845 182.4244 74 G 3.6771 7.6942 104.6807 48.0492 0.0000 177.2426 75 E 3.9877 8.0464 118.2516 57.3943 29.7325 178.2605 76 Q 4.2401 8.7583 122.4749 59.8977 28.6790 178.3318 77 R 3.9427 8.7374 119.9945 59.6905 29.9772 178.0352 78 Q 4.0071 8.2351 118.5173 59.2898 29.0853 178.1080 79 K 3.7594 7.7752 119.5496 59.5387 31.9870 178.1727 80 D 4.3579 8.1666 117.3452 56.0336 40.9137 178.0160 81 R 4.3369 7.0460 118.6869 58.3677 30.8925 178.6593 82 L 3.8014 7.7872 118.6150 57.5625 41.4441 179.4007 83 E 4.2236 8.1738 120.0720 58.4041 29.1475 178.3664 84 E 4.2520 7.9245 116.6630 57.2490 29.8202 176.9011 85 E 4.8674 7.3776 119.4725 55.3724 30.1551 176.8919 86 G 4.1360 8.2273 104.3270 46.1496 0.0000 174.8405 87 V 3.6167 7.2180 118.7971 62.3345 32.0581 174.4243 88 E 4.7293 8.5646 126.5635 54.5360 31.1651 175.2703 89 I 4.8334 8.0991 125.2579 59.9296 41.0664 174.2406 90 Y 5.1362 7.7319 124.3032 55.7945 41.3159 173.9854 91 Q 5.2915 9.0862 115.8673 54.0651 33.2684 174.7398 92 T 4.6930 7.9829 117.1798 61.2456 71.0765 174.5544 93 S 3.8712 8.5559 118.1862 59.8192 62.8910 172.2955 94 L 3.2672 8.4795 127.6888 56.0013 36.9116 178.6500 95 G 3.1537 8.3195 106.4245 44.7656 0.0000 172.3014 96 E 3.8430 7.6798 126.4396 52.9492 25.5650 175.9084 97 Y 4.8406 7.7207 120.4985 58.5571 39.4202 175.1331 98 K 4.3138 8.7178 122.2484 55.8694 36.4673 173.6434 99 L 5.0849 8.1525 123.6191 54.5279 44.4490 174.7069 100 N 4.7805 9.0635 117.3651 52.6879 38.9729 175.0487 101 L 4.1009 8.6753 128.1827 57.8088 42.2430 176.5997 102 P 4.0851 0.0000 0.0000 65.5269 31.2707 177.9450 103 E 3.9062 9.7556 118.0047 59.0916 29.8666 177.1766 104 Y 4.4891 7.7789 114.6042 58.4671 38.7738 175.1683 105 M 4.5829 8.6129 121.3734 55.3693 33.1642 175.8263 106 W 4.6203 9.4110 135.0000 57.1511 31.0911 176.0737 107 K 4.1212 8.6289 128.5303 53.8932 32.2155 174.9653 108 P 4.3435 0.0000 0.0000 62.5114 31.5030 176.1826 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 1 M 8.29 4.54 0.00 1.98 2.06 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.57 0.00 2 R 8.92 4.57 0.00 1.97 1.97 0.00 2.82 0.00 0.00 3.13 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 3 M 8.37 4.31 0.00 1.98 2.09 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.49 0.00 4 D 8.02 4.44 0.00 2.93 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 5 E 8.99 3.94 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 2.35 2.46 0.00 6 F 8.41 4.03 0.00 3.13 3.37 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 7 Y 8.85 3.52 0.00 2.94 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 8 T 7.90 3.82 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 1.31 0.00 0.00 9 K 8.34 4.04 0.00 1.53 1.80 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.61 1.52 7.81 10 V 7.28 3.65 1.60 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 0.84 0.00 0.00 0.00 0.00 0.00 11 Y 7.43 4.49 0.00 3.23 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 12 D 8.36 4.39 0.00 2.70 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 13 A 8.98 4.34 1.47 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 0.00 0.00 0.00 14 V 7.96 3.35 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 1.11 0.00 0.00 1.01 0.00 0.00 15 C 7.93 3.97 0.00 3.32 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 16 E 8.72 4.02 0.00 1.97 1.59 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 2.33 2.37 0.00 17 I 6.99 3.03 1.63 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 1.18 0.46 0.78 0.00 0.00 18 P 0.00 4.06 0.00 2.13 2.03 0.00 2.83 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.52 0.00 19 Y 8.33 4.03 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 20 G 8.72 3.85 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 0.00 0.00 0.00 21 K 7.60 4.91 0.00 1.82 1.82 0.00 2.05 0.00 0.00 1.92 0.00 0.00 2.81 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.63 7.81 22 V 9.38 4.69 2.07 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 0.62 0.00 0.00 0.96 0.00 0.00 23 S 9.83 4.87 0.00 3.99 3.69 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 24 T 8.15 4.72 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 1.28 0.00 0.00 25 Y 8.81 4.16 0.00 3.25 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 26 G 8.48 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 0.00 0.00 0.00 27 E 8.18 4.06 0.00 2.13 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 2.41 2.32 0.00 28 I 7.96 3.72 2.09 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.94 0.94 0.00 0.00 29 A 8.08 4.12 1.56 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 0.00 0.00 30 R 8.29 3.89 0.00 2.09 2.09 0.00 3.20 0.00 0.00 3.13 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 31 Y 8.64 4.20 0.00 3.00 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 32 V 7.95 4.10 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 0.83 0.00 0.00 0.98 0.00 0.00 33 G 8.52 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 34 M 8.03 4.81 0.00 2.05 2.23 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 2.65 2.63 0.00 35 P 0.00 4.40 0.00 2.11 2.19 0.00 3.75 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 36 S 8.28 4.72 0.00 3.94 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 37 Y 8.67 4.18 0.00 3.39 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 38 A 8.27 4.13 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 39 R 8.19 3.98 0.00 1.80 1.95 0.00 3.04 0.00 0.00 3.30 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.56 0.00 40 Q 7.91 4.20 0.00 2.24 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.85 0.00 0.00 0.00 0.00 0.00 2.63 2.34 0.00 41 V 8.70 3.70 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 1.09 0.00 0.00 1.33 0.00 0.00 42 G 8.21 3.69 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 0.00 0.00 0.00 43 Q 8.11 4.07 0.00 2.14 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.49 2.45 0.00 44 A 8.41 3.67 0.88 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 45 M 7.65 4.28 0.00 2.16 2.51 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 3.05 0.00 46 K 8.26 4.03 0.00 1.86 2.09 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.53 7.81 47 H 8.63 4.86 0.00 3.35 3.39 0.00 5.71 0.00 0.00 0.00 0.00 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.13 4.53 0.00 1.48 1.44 0.97 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 49 H 8.18 4.52 0.00 3.15 3.54 0.00 5.64 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 P 0.00 4.70 0.00 2.02 2.01 0.00 3.66 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 2.00 2.05 0.00 51 E 8.42 4.34 0.00 1.86 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 2.26 2.26 0.00 52 T 7.87 3.72 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 1.38 0.00 0.00 53 H 8.56 4.54 0.00 3.21 3.32 0.00 5.74 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 54 V 9.72 4.15 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 0.79 0.00 0.00 0.78 0.00 0.00 55 P 0.00 4.35 0.00 1.92 1.95 0.00 3.72 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.81 0.00 56 W 7.96 4.50 0.00 3.77 3.54 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 57 H 6.44 4.18 0.00 2.81 2.09 0.00 5.52 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 R 7.94 4.04 0.00 1.59 1.89 0.00 3.07 0.00 0.00 2.88 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.11 0.00 59 V 7.25 4.63 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 0.28 0.00 0.00 0.87 0.00 0.00 60 I 8.42 4.74 2.21 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.07 0.83 0.00 0.00 61 N 8.73 5.69 0.00 2.98 3.21 0.00 0.00 7.20 7.64 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 62 S 8.80 4.89 0.00 4.06 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 63 R 8.05 4.27 0.00 1.86 2.03 0.00 3.30 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 64 G 9.29 3.91 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 0.00 0.00 0.00 65 T 8.06 5.08 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 1.32 0.00 0.00 66 I 7.69 4.87 2.02 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 1.28 0.69 1.13 0.00 0.00 67 S 8.78 4.57 0.00 3.91 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 68 K 8.95 3.97 0.00 1.77 1.83 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.75 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.35 7.81 69 R 8.42 3.80 0.00 2.11 2.01 0.00 3.24 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 70 D 9.53 3.95 0.00 2.83 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 0.00 0.00 0.00 0.00 71 I 8.07 3.22 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.48 0.90 0.00 0.00 72 S 8.26 3.73 0.00 4.13 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 73 A 8.93 4.05 1.31 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 0.00 0.00 0.00 0.00 0.00 0.00 74 G 7.69 3.68 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 0.00 0.00 0.00 75 E 8.05 3.99 0.00 2.31 2.28 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 2.48 2.55 0.00 76 Q 8.76 4.24 0.00 2.23 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.76 0.00 0.00 0.00 0.00 0.00 2.44 2.76 0.00 77 R 8.74 3.94 0.00 2.13 2.13 0.00 3.41 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.76 0.00 78 Q 8.24 4.01 0.00 2.44 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.68 0.00 0.00 0.00 0.00 0.00 2.45 2.51 0.00 79 K 7.78 3.76 0.00 1.42 1.70 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.75 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.12 1.11 7.81 80 D 8.17 4.36 0.00 2.80 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 81 R 7.05 4.34 0.00 1.71 1.54 0.00 2.87 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.77 0.00 82 L 7.79 3.80 0.00 1.62 1.47 0.82 0.59 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 83 E 8.17 4.22 0.00 1.89 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 0.00 2.19 2.21 0.00 84 E 7.92 4.25 0.00 2.04 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 2.31 2.44 0.00 85 E 7.38 4.87 0.00 1.64 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 0.00 0.00 0.00 1.78 1.98 0.00 86 G 8.23 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 87 V 7.22 3.62 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 0.22 0.00 0.00 0.62 0.00 0.00 88 E 8.56 4.73 0.00 2.05 2.03 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 2.39 2.34 0.00 89 I 8.10 4.83 1.66 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.57 0.60 0.00 0.00 90 Y 7.73 5.14 0.00 3.19 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 91 Q 9.09 5.29 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.77 0.00 0.00 0.00 0.00 0.00 2.47 2.56 0.00 92 T 7.98 4.69 4.58 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 1.25 0.00 0.00 93 S 8.56 3.87 0.00 3.99 3.96 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 94 L 8.48 3.27 0.00 1.91 1.79 0.93 1.02 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 95 G 8.32 3.15 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 0.00 0.00 0.00 0.00 96 E 7.68 3.84 0.00 1.99 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 2.28 2.46 0.00 97 Y 7.72 4.84 0.00 2.90 2.78 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 98 K 8.72 4.31 0.00 1.61 1.11 0.00 1.55 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.38 1.17 7.81 99 L 8.15 5.08 0.00 1.65 1.44 1.06 0.80 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 0.00 100 N 9.06 4.78 0.00 2.93 3.01 0.00 0.00 6.54 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 0.00 101 L 8.68 4.10 0.00 1.87 1.69 0.97 1.03 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 0.00 102 P 0.00 4.09 0.00 2.06 2.11 0.00 3.91 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.17 0.00 103 E 9.76 3.91 0.00 1.99 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 1.60 2.07 0.00 104 Y 7.78 4.49 0.00 3.37 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 0.00 105 M 8.61 4.58 0.00 1.99 2.10 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 2.64 2.51 0.00 106 W 9.41 4.62 0.00 3.25 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 0.00 107 K 8.63 4.12 0.00 1.58 1.62 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.24 1.33 7.81 108 P 0.00 4.34 0.00 2.08 0.91 0.00 3.29 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.72 0.00