NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2925 8.3144 122.1418 54.2980 33.5515 174.3942 2 E 4.5193 8.4120 124.2762 51.8030 31.5435 173.7867 3 T 4.2505 8.6399 118.5220 61.2029 72.2681 174.9539 4 A 3.9922 8.6328 123.8759 55.4460 18.4768 180.0860 5 A 4.1317 7.9962 118.5734 55.3939 18.4830 179.5953 6 A 4.0597 7.8405 119.2851 54.9918 18.4210 179.8084 7 K 4.2478 8.3851 119.9272 58.9292 32.1436 178.9046 8 F 4.0945 8.4510 121.1894 61.3813 39.0927 177.0565 9 E 3.9704 8.3569 117.9842 59.2281 28.9950 179.3498 10 R 3.8872 8.0743 118.3773 59.4663 30.2698 178.1427 11 Q 4.0584 7.9144 116.3994 57.6156 29.1879 176.1738 12 H 4.7260 7.8278 114.2343 54.4125 31.0530 173.5418 13 M 4.8082 7.6176 118.5958 53.7190 34.1585 176.4645 14 D 4.7422 8.9567 122.7999 53.6523 42.4353 175.5399 15 S 4.4269 8.5623 118.3284 59.5499 63.7143 175.7009 16 S 4.2084 8.2126 115.2286 61.2014 62.4955 174.7772 17 T 4.4901 7.5218 110.2737 59.3723 70.2549 174.7394 18 S 4.4196 8.3185 115.4999 59.0237 63.8866 173.3459 19 A 4.2580 7.1203 121.7421 50.5684 21.6852 175.4366 20 A 3.0145 8.1685 122.6322 52.3195 18.5122 177.6671 21 S 4.2338 8.2524 120.2865 61.2336 63.3405 174.7474 22 S 4.5720 7.4732 111.2331 57.5539 65.1860 174.3855 23 S 4.3349 8.6086 115.0511 60.5499 62.8020 174.5820 24 N 4.6838 7.7327 118.0421 53.9444 39.5611 175.7535 25 Y 3.9914 8.1384 119.1470 61.8427 38.6761 177.2102 26 C 4.2101 8.3866 117.0438 60.3445 35.9802 175.8649 27 N 4.3352 8.2986 117.2548 56.4846 38.1568 177.0068 28 Q 3.8885 7.9601 120.6130 59.5940 29.3602 178.2027 29 M 3.7830 8.0236 121.2081 57.9880 31.9705 178.8016 30 M 4.1077 8.7323 119.8497 57.7261 32.0968 178.8041 31 K 4.0815 7.9943 121.8961 58.7256 32.6280 179.0851 32 S 4.1666 8.1233 113.4617 60.6377 63.2129 175.4337 33 R 4.3581 7.6883 118.3532 55.7289 30.1372 176.0946 34 N 4.3365 8.0745 114.1297 54.4483 36.6173 175.4672 35 L 4.4451 7.8196 116.7167 55.5806 41.8049 177.9721 36 T 5.0052 7.5702 107.2812 60.0888 69.1217 175.4531 37 K 4.0571 7.3978 122.5205 59.5647 32.5059 177.4543 38 D 4.4817 7.8106 119.1611 55.1214 40.4452 176.1197 39 R 3.5707 7.0549 113.7465 55.0180 31.6155 174.1051 40 C 4.6810 8.6014 116.7042 56.0616 40.5268 173.7985 41 K 4.2668 8.5026 126.9822 55.5967 32.6243 174.5302 42 P 4.7013 0.0000 0.0000 65.3780 31.8944 176.1578 43 V 5.0370 7.5177 116.6171 61.3827 34.9321 173.7782 44 N 4.6231 9.0058 122.7930 52.8810 42.5714 173.0031 45 T 4.7409 7.8836 121.8901 61.6718 71.4999 172.9982 46 F 4.9195 8.8227 124.3147 55.6256 42.2340 174.5535 47 V 4.5831 9.2082 123.0920 60.8355 33.7104 175.8758 48 H 5.9658 8.3173 127.0166 55.1464 27.2463 173.7818 49 E 4.8270 7.8746 116.3597 53.7299 33.7052 177.2360 50 S 4.3716 8.2811 115.1780 58.1513 65.0869 174.8913 51 L 4.0013 8.6130 124.8193 58.5688 41.9103 179.3275 52 A 4.0011 7.9848 120.1150 55.2407 18.1338 179.2106 53 D 4.3415 7.6708 116.7249 57.2601 41.0647 178.9818 54 V 3.7459 7.7411 118.3280 66.3010 31.6830 178.0925 55 Q 3.8676 8.4132 117.8225 58.9562 28.6087 178.8938 56 A 4.0154 7.8957 121.0528 54.8453 18.2323 179.7100 57 V 3.6513 7.9467 117.1992 65.8651 31.3272 176.8241 58 C 3.8269 7.7623 114.2293 57.9234 39.9402 174.0140 59 S 4.5226 7.3646 115.1435 58.1681 64.2642 174.9365 60 Q 3.9671 7.5228 122.6866 55.1882 27.7812 176.5016 61 K 4.2627 7.9916 128.0885 57.5104 33.1714 175.7985 62 N 4.6358 8.8286 127.1007 53.1353 39.8496 174.2296 63 V 4.5971 8.2083 117.8651 59.3181 36.7867 174.7967 64 A 4.4331 8.4194 124.1544 52.2135 19.2385 177.8998 65 C 4.7152 9.0801 118.5567 55.1765 42.0679 175.5905 66 K 3.8730 8.3809 119.5688 59.7780 31.4975 178.5179 67 N 4.4661 7.9866 112.9043 53.5442 37.3943 175.6116 68 G 3.9726 7.9160 108.2179 45.5285 0.0000 174.2781 69 Q 4.2286 8.6831 119.5257 56.1583 29.3044 176.4203 70 T 4.5852 8.2780 108.3130 61.6315 69.3100 173.7972 71 N 4.9435 7.8021 119.0154 54.1530 38.3380 174.9727 72 C 5.4300 7.4200 115.4694 56.6782 43.9874 173.1097 73 Y 5.1784 8.8442 118.3096 56.3162 42.2825 173.8977 74 Q 5.1180 9.1708 124.2408 53.9358 31.6933 174.9715 75 S 4.3878 8.7300 121.7856 58.8123 63.2047 174.2877 76 Y 4.5207 8.8954 121.3379 61.0822 37.8886 176.6223 77 S 4.9011 7.9091 113.9829 57.3608 64.8912 174.1217 78 T 4.2796 8.2034 111.3660 61.6242 70.0601 173.9892 79 M 4.9258 9.3224 122.9150 53.3869 36.8522 174.5872 80 S 4.9039 8.8855 117.1974 58.3262 63.6195 173.0614 81 I 5.1147 9.2038 120.3212 59.5284 41.6100 174.0931 82 T 4.9563 8.7917 120.3977 61.9147 71.3447 172.5820 83 D 4.8517 9.6739 128.4690 53.4689 42.8184 174.1887 84 C 5.7391 9.0201 123.6658 54.4545 44.3110 173.0132 85 R 5.2530 8.5830 123.0121 54.2515 33.3934 173.6115 86 E 4.2380 9.3283 128.6096 56.2292 30.1763 176.8193 87 T 4.1889 8.2680 117.4370 61.0075 69.6753 174.8961 88 G 3.6980 8.4782 110.4647 47.7779 0.0000 174.9219 89 S 4.3438 7.8954 113.4199 59.6391 64.0384 174.8018 90 S 3.9227 7.5851 114.6371 58.5927 62.5024 173.4570 91 K 4.5635 8.4547 127.3062 54.3791 35.0187 174.8833 92 Y 4.4289 8.6626 127.3008 57.3282 39.2513 173.7008 93 P 3.6478 0.0000 0.0000 62.9906 31.7804 176.8833 94 N 4.7227 7.8558 119.5338 52.1736 37.1889 172.8603 95 C 4.4167 8.0139 117.4262 56.4642 42.6131 173.1758 96 A 5.1491 8.4082 124.7491 50.5130 22.0304 174.5957 97 Y 5.2969 9.0933 117.6606 56.3683 42.5284 174.8505 98 K 4.5934 9.0069 121.1600 55.6257 34.4057 175.7487 99 T 4.8109 8.5476 120.9533 62.4252 70.1456 174.0729 100 T 4.5466 9.0520 124.2132 61.6947 71.2529 173.1329 101 Q 4.8362 8.7243 128.0795 55.4768 30.3211 174.4608 102 A 4.6721 9.1783 126.5140 51.0282 23.5971 174.8730 103 N 5.4096 8.7260 116.4859 51.7749 40.4815 174.0342 104 K 4.7466 8.8492 122.6108 54.9499 37.6499 175.4846 105 H 5.1222 9.4022 118.6003 55.6222 30.2352 175.0220 106 I 5.0683 8.3756 113.3563 59.2305 41.2973 174.2502 107 I 4.9795 8.1270 123.4294 59.8522 40.4809 175.1120 108 V 4.7477 8.7403 118.8607 59.5453 36.4807 174.1643 109 A 4.9135 8.9985 124.7729 51.2021 20.3498 175.8165 110 C 5.0966 8.5063 119.7953 55.3834 38.4917 173.0545 111 E 4.6723 8.5590 120.6556 56.5863 33.5593 175.7442 112 G 3.9277 9.3049 111.5721 44.9126 0.0000 171.6447 113 N 4.9065 8.1752 116.1521 50.4700 39.9514 171.9943 114 P 4.2992 0.0000 0.0000 62.7987 31.8721 176.2882 115 Y 4.9206 8.3269 122.1740 57.1956 38.3295 174.3204 116 V 4.4407 7.9650 119.2646 58.0856 36.7575 173.1064 117 P 4.5090 0.0000 0.0000 62.9247 31.0747 177.1676 118 V 4.4352 8.8707 115.7126 61.1217 33.9668 175.3212 119 H 4.9731 7.7000 120.5221 54.8464 33.4236 171.6760 120 F 4.4352 8.9359 128.6559 57.9061 39.3533 174.2351 121 D 4.5427 8.3678 126.8909 55.4426 41.7539 176.0683 122 A 4.6572 6.6455 117.6111 51.6147 22.1525 174.7556 123 S 5.1538 8.9836 113.8115 56.6660 65.9392 174.3966 124 V 4.1107 9.0132 121.1630 63.2374 31.7879 175.0504 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 K 8.31 4.29 0.00 1.79 1.68 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.01 7.81 2 E 8.41 4.52 0.00 2.06 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 3 T 8.64 4.25 4.26 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 1.22 0.00 0.00 4 A 8.63 3.99 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 5 A 8.00 4.13 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 6 A 7.84 4.06 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 7 K 8.39 4.25 0.00 1.86 2.03 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.30 7.81 8 F 8.45 4.09 0.00 3.33 3.30 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 9 E 8.36 3.97 0.00 2.30 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 2.50 2.67 0.00 10 R 8.07 3.89 0.00 1.79 2.05 0.00 3.45 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 1.62 1.66 0.00 11 Q 7.91 4.06 0.00 1.63 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.47 0.00 0.00 0.00 0.00 0.00 2.23 2.38 0.00 12 H 7.83 4.73 0.00 2.09 2.82 0.00 5.59 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 13 M 7.62 4.81 0.00 1.92 2.12 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 2.69 2.61 0.00 14 D 8.96 4.74 0.00 2.68 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 15 S 8.56 4.43 0.00 3.93 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 16 S 8.21 4.21 0.00 3.97 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 17 T 7.52 4.49 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 1.24 0.00 0.00 18 S 8.32 4.42 0.00 3.98 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 19 A 7.12 4.26 1.13 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 0.00 0.00 20 A 8.17 3.01 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 21 S 8.25 4.23 0.00 4.12 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 22 S 7.47 4.57 0.00 3.97 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 23 S 8.61 4.33 0.00 3.91 3.99 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 0.00 0.00 0.00 24 N 7.73 4.68 0.00 2.88 2.81 0.00 0.00 6.67 7.44 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 25 Y 8.14 3.99 0.00 3.24 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 26 C 8.39 4.21 0.00 3.17 3.11 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 27 N 8.30 4.34 0.00 2.90 2.95 0.00 0.00 6.68 7.39 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 28 Q 7.96 3.89 0.00 2.04 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.80 0.00 0.00 0.00 0.00 0.00 2.04 2.24 0.00 29 M 8.02 3.78 0.00 0.92 1.48 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.24 0.00 30 M 8.73 4.11 0.00 1.65 1.81 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 2.48 0.00 31 K 7.99 4.08 0.00 1.85 1.89 0.00 1.67 0.00 0.00 1.77 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.32 7.81 32 S 8.12 4.17 0.00 3.98 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 33 R 7.69 4.36 0.00 1.91 2.12 0.00 3.55 0.00 0.00 3.18 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.94 0.00 34 N 8.07 4.34 0.00 2.96 2.94 0.00 0.00 7.01 6.10 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 35 L 7.82 4.45 0.00 1.87 1.66 0.84 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.57 5.01 4.43 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 1.41 0.00 0.00 37 K 7.40 4.06 0.00 1.99 1.85 0.00 1.87 0.00 0.00 1.79 0.00 0.00 3.00 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.50 1.56 7.81 38 D 7.81 4.48 0.00 2.71 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 39 R 7.05 3.57 0.00 1.77 1.74 0.00 2.86 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.54 0.00 40 C 8.60 4.68 0.00 3.11 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 41 K 8.50 4.27 0.00 1.94 1.76 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.41 7.81 42 P 0.00 4.70 0.00 2.15 2.11 0.00 3.62 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 2.13 2.11 0.00 43 V 7.52 5.04 2.09 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 0.78 0.00 0.00 0.96 0.00 0.00 44 N 9.01 4.62 0.00 2.62 2.24 0.00 0.00 7.11 7.74 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 45 T 7.88 4.74 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 0.89 0.00 0.00 46 F 8.82 4.92 0.00 3.00 2.89 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 47 V 9.21 4.58 2.23 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 1.06 0.00 0.00 1.08 0.00 0.00 48 H 8.32 5.97 0.00 3.09 3.51 0.00 5.61 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 49 E 7.87 4.83 0.00 1.97 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 2.24 2.24 0.00 50 S 8.28 4.37 0.00 4.07 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 51 L 8.61 4.00 0.00 1.82 1.75 1.02 1.23 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 52 A 7.98 4.00 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 53 D 7.67 4.34 0.00 2.80 2.77 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 54 V 7.74 3.75 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 1.28 0.00 0.00 1.09 0.00 0.00 55 Q 8.41 3.87 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.33 2.58 0.00 56 A 7.90 4.02 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 57 V 7.95 3.65 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 1.08 0.00 0.00 1.04 0.00 0.00 58 C 7.76 3.83 0.00 2.92 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 59 S 7.36 4.52 0.00 3.90 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 60 Q 7.52 3.97 0.00 1.76 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.87 0.00 0.00 0.00 0.00 0.00 1.42 2.04 0.00 61 K 7.99 4.26 0.00 2.09 1.88 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.80 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.54 7.81 62 N 8.83 4.64 0.00 2.81 2.69 0.00 0.00 7.00 7.71 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 63 V 8.21 4.60 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 0.68 0.00 0.00 0.86 0.00 0.00 64 A 8.42 4.43 1.19 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 0.00 0.00 65 C 9.08 4.72 0.00 3.08 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 66 K 8.38 3.87 0.00 1.80 1.88 0.00 1.73 0.00 0.00 1.78 0.00 0.00 3.20 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.48 1.53 7.81 67 N 7.99 4.47 0.00 2.78 2.90 0.00 0.00 6.31 7.00 0.00 0.00 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 G 7.92 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 69 Q 8.68 4.23 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.72 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 70 T 8.28 4.59 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 1.17 0.00 0.00 71 N 7.80 4.94 0.00 3.05 3.15 0.00 0.00 6.02 7.68 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 72 C 7.42 5.43 0.00 3.01 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 73 Y 8.84 5.18 0.00 2.84 2.85 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 74 Q 9.17 5.12 0.00 2.02 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.27 2.26 0.00 75 S 8.73 4.39 0.00 3.94 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 76 Y 8.90 4.52 0.00 3.08 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 77 S 7.91 4.90 0.00 3.81 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 78 T 8.20 4.28 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 1.06 0.00 0.00 79 M 9.32 4.93 0.00 1.93 1.99 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 2.53 2.48 0.00 80 S 8.89 4.90 0.00 3.98 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 81 I 9.20 5.11 1.85 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.20 0.97 0.00 0.00 82 T 8.79 4.96 4.37 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 1.21 0.00 0.00 83 D 9.67 4.85 0.00 2.64 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 84 C 9.02 5.74 0.00 2.93 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 R 8.58 5.25 0.00 1.89 1.78 0.00 3.22 0.00 0.00 3.29 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 86 E 9.33 4.24 0.00 2.10 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 2.04 1.61 0.00 87 T 8.27 4.19 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 1.19 0.00 0.00 88 G 8.48 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 0.00 0.00 0.00 89 S 7.90 4.34 0.00 3.96 3.98 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 90 S 7.59 3.92 0.00 3.82 3.86 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 0.00 0.00 0.00 0.00 91 K 8.45 4.56 0.00 1.74 1.56 0.00 1.71 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.37 7.81 92 Y 8.66 4.43 0.00 2.93 2.86 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 0.00 0.00 0.00 0.00 93 P 0.00 3.65 0.00 1.81 1.10 0.00 3.59 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.68 0.00 94 N 7.86 4.72 0.00 2.87 2.75 0.00 0.00 7.01 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 95 C 8.01 4.42 0.00 3.15 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 96 A 8.41 5.15 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 0.00 0.00 0.00 0.00 0.00 97 Y 9.09 5.30 0.00 2.85 2.85 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 98 K 9.01 4.59 0.00 1.78 1.76 0.00 1.83 0.00 0.00 1.68 0.00 0.00 3.07 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.46 7.81 99 T 8.55 4.81 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 1.27 0.00 0.00 100 T 9.05 4.55 4.26 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 1.22 0.00 0.00 101 Q 8.72 4.84 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.76 0.00 0.00 0.00 0.00 0.00 2.26 2.40 0.00 102 A 9.18 4.67 1.21 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 0.00 0.00 103 N 8.73 5.41 0.00 2.58 2.76 0.00 0.00 6.70 7.61 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 0.00 104 K 8.85 4.75 0.00 1.72 1.85 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.44 7.81 105 H 9.40 5.12 0.00 3.16 3.24 0.00 5.55 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.38 5.07 1.87 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 1.29 0.76 1.09 0.00 0.00 107 I 8.13 4.98 1.77 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.66 0.82 0.00 0.00 108 V 8.74 4.75 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 0.66 0.00 0.00 0.81 0.00 0.00 109 A 9.00 4.91 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 0.00 110 C 8.51 5.10 0.00 2.07 1.72 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 0.00 111 E 8.56 4.67 0.00 1.97 1.66 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 2.22 2.30 0.00 112 G 9.30 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 0.00 113 N 8.18 4.91 0.00 2.66 2.73 0.00 0.00 6.91 7.69 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 0.00 114 P 0.00 4.30 0.00 2.23 2.05 0.00 3.83 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 115 Y 8.33 4.92 0.00 2.84 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 0.00 116 V 7.96 4.44 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 0.75 0.00 0.00 0.90 0.00 0.00 117 P 0.00 4.51 0.00 0.49 1.16 0.00 3.35 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.80 0.00 118 V 8.87 4.44 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 0.57 0.00 0.00 0.93 0.00 0.00 119 H 7.70 4.97 0.00 3.26 3.09 0.00 5.85 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 0.00 120 F 8.94 4.44 0.00 2.84 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 0.00 121 D 8.37 4.54 0.00 2.59 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 0.00 122 A 6.65 4.66 1.21 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 0.00 0.00 123 S 8.98 5.15 0.00 4.10 4.13 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 0.00 124 V 9.01 4.11 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 0.92 0.00 0.00 0.93 0.00 0.00