NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4108 8.3044 120.3244 54.6075 33.4218 174.6802 2 K 3.9186 8.3781 122.7347 56.0538 32.8226 175.6121 3 K 4.0854 9.4071 126.9157 58.4328 33.4288 175.9196 4 H 4.9033 7.9071 113.0770 54.3165 32.1418 173.3553 5 G 3.9761 8.5790 107.5636 45.1876 0.0000 172.8609 6 I 3.7941 7.8770 118.2340 60.8207 38.4426 175.9154 7 L 4.0507 8.4712 128.8012 57.7490 42.4903 177.5523 8 N 4.4412 8.0681 118.0253 53.2471 39.7814 175.4375 9 S 4.0923 8.6302 123.5181 61.8823 62.7816 176.2716 10 H 4.2407 8.0018 119.2804 58.6873 28.4965 177.6740 11 L 4.0380 8.6258 120.8193 57.5741 41.3480 179.3065 12 A 4.0021 8.2301 120.9250 55.2535 18.0892 179.8459 13 K 3.9363 7.6355 115.8932 59.5652 32.2445 179.4714 14 I 3.9030 7.4588 119.6059 64.4222 37.1017 178.4715 15 L 3.9979 8.2994 119.9415 57.6987 41.1737 179.3146 16 A 4.0488 8.0514 120.1103 54.9726 18.3949 178.4987 17 D 4.6330 7.5930 114.3703 53.5283 41.6271 177.0176 18 L 4.2162 7.4049 121.2980 54.7169 42.2842 176.5531 19 G 4.1933 9.3140 111.5262 43.0047 0.0000 171.5579 20 H 4.2739 8.5698 118.9523 58.0766 29.8023 175.3223 21 T 3.4792 8.8298 116.7610 61.3275 68.5686 171.9023 22 D 4.5977 7.8608 122.5360 54.6224 42.2611 175.4429 23 K 5.2872 8.5685 119.7232 54.6300 36.1509 175.1329 24 I 5.0030 8.4856 115.7517 59.1515 41.4773 174.0934 25 V 4.8971 8.7476 123.3486 61.3019 34.5134 174.1170 26 I 5.0802 8.7471 127.7009 59.7029 39.4357 174.6055 27 A 5.2392 9.3450 128.1792 50.0026 23.3349 175.1258 28 D 5.0700 8.1686 119.3834 52.3680 41.2111 177.1896 29 A 4.2175 8.7638 121.2361 53.9536 18.2356 178.3987 30 G 3.8328 8.1213 103.4829 44.8215 0.0000 174.0339 31 L 4.0179 7.4019 121.8004 54.3433 42.5075 174.8589 32 P 4.4468 0.0000 0.0000 62.4069 32.2725 175.4799 33 V 4.2402 8.0005 120.1667 60.3392 33.0773 173.9519 34 P 4.3784 0.0000 0.0000 62.4240 31.8890 175.5212 35 D 4.5457 8.4042 121.6523 55.9980 41.1536 177.1683 36 G 3.9286 9.0466 112.0268 45.0091 0.0000 173.1621 37 V 4.1452 7.0924 119.4049 60.7938 32.8323 175.1615 38 L 4.1277 8.4089 129.2536 55.1410 43.2835 175.0944 39 K 4.9746 8.6431 126.8159 54.6956 34.5383 174.8693 40 I 4.3304 8.7900 128.8242 59.6964 39.5391 174.3389 41 D 4.9783 8.7175 128.1863 53.1427 41.3324 175.8285 42 L 4.6641 8.7470 126.4169 54.7101 42.5771 177.8083 43 S 4.4156 8.1945 114.4133 58.5861 63.5082 173.4176 44 L 4.5262 8.7994 123.7682 56.1824 43.8696 176.2263 45 K 4.3696 7.5359 114.5738 54.8630 34.8853 172.4915 46 P 3.9367 0.0000 0.0000 64.4436 31.1427 177.2576 47 G 3.8843 9.5910 112.0040 45.0200 0.0000 172.6917 48 L 4.7426 8.2259 122.3806 52.5729 44.9021 173.9751 49 P 4.9285 0.0000 0.0000 62.0430 33.5935 175.4369 50 A 4.6435 8.3683 122.2355 51.4479 19.8179 178.4073 51 F 4.1327 9.5749 121.7896 61.6518 39.4213 177.7970 52 Q 3.1067 7.9038 116.9580 58.7676 28.5211 178.4121 53 D 4.3320 7.8444 119.2586 57.6341 40.9181 178.8836 54 T 3.8235 7.8041 115.8606 66.6472 68.5078 176.6603 55 A 3.9872 8.0429 122.7182 54.9677 18.1907 179.5843 56 A 3.9075 8.1328 119.3380 55.3111 18.2858 180.0188 57 V 3.5427 7.6986 116.5815 66.1874 31.5745 178.2717 58 L 4.0220 8.0261 118.5395 57.7403 41.2380 179.2463 59 A 4.1360 7.9845 119.8337 55.2597 18.3358 178.9926 60 E 4.0523 7.9633 116.4843 58.2463 29.9392 177.6426 61 E 4.5356 7.8784 116.6919 55.3412 30.7555 174.9686 62 M 4.6565 7.7772 118.0906 53.2494 35.2467 174.5009 63 A 4.3975 8.4861 127.0296 51.3372 19.8695 176.0504 64 V 4.6739 8.4310 122.7257 62.0691 32.5582 175.2939 65 E 4.5192 9.0395 125.6664 57.1581 31.6410 175.5880 66 K 4.8159 7.6140 120.0669 55.1046 35.9831 174.3241 67 V 4.6779 8.8544 125.8059 61.0293 34.7809 174.1666 68 I 5.0418 8.6783 127.4501 59.6321 40.5256 174.4331 69 A 4.9376 8.8707 126.4510 50.3970 23.5039 174.8504 70 A 4.7153 8.0808 121.6531 51.1840 19.9876 178.6175 71 A 3.9635 9.3649 125.8218 55.5660 18.3216 179.9333 72 E 3.6229 7.9589 116.1290 59.1570 29.2487 179.1693 73 I 3.7008 7.8303 119.1849 63.8549 37.7684 177.9969 74 K 3.9724 7.7723 118.2618 58.6814 31.8107 178.4580 75 A 4.2848 7.6065 119.6798 53.5840 19.4431 178.3959 76 S 4.6712 7.7322 110.1860 58.1643 65.3240 174.3557 77 N 4.9916 8.2272 120.7509 50.9331 39.4812 174.6586 78 Q 4.0008 8.1970 122.8044 59.5700 29.6075 176.8964 79 E 4.0102 8.2792 118.9007 60.0283 29.6219 179.1867 80 N 4.6487 8.2286 114.5582 55.8647 38.6054 177.6047 81 A 4.1698 8.1503 122.7279 55.0746 18.4103 179.8340 82 K 3.9848 8.5387 117.4325 59.5480 32.1617 179.1187 83 F 4.0835 8.2442 120.5600 61.4620 39.2241 176.9982 84 L 4.1667 8.3237 119.6569 58.3592 41.7455 178.7987 85 E 4.1089 8.1098 117.4624 59.3389 29.4247 178.9772 86 N 4.4046 8.1391 115.9326 56.2139 38.8066 176.7866 87 L 3.6276 7.5473 120.5583 57.1133 42.7965 178.5348 88 F 5.4474 8.0783 119.0654 55.8815 38.4760 177.7329 89 S 4.2605 7.9567 114.5580 61.4381 63.3036 175.6345 90 E 4.1358 8.0963 118.8267 58.1076 30.0203 176.5708 91 Q 4.5022 7.7687 118.0602 54.5647 31.3152 174.4822 92 E 4.5280 8.2438 121.6230 55.9440 30.9334 175.1298 93 I 4.8383 8.3809 127.3862 59.5151 39.5742 174.2932 94 E 4.6604 8.9949 128.7801 54.4643 32.1855 173.9282 95 Y 5.1915 8.6435 123.7692 56.4260 40.1154 174.8065 96 L 5.1278 8.9129 123.0929 52.3638 46.6679 176.2390 97 S 4.5663 8.5377 114.1752 58.2710 63.9023 174.7449 98 H 4.1902 9.0466 121.3705 59.6354 29.4567 177.6404 99 E 3.9918 8.2333 119.8579 59.5157 29.4399 178.9932 100 E 3.9823 8.0247 118.6243 59.1925 29.2874 178.8727 101 F 4.0300 8.2826 119.9553 61.5618 39.6049 176.9367 102 K 4.0319 8.3382 117.7911 59.5354 31.8198 179.1764 103 L 3.9537 7.6498 118.5972 57.9640 41.7141 179.7106 104 L 4.0006 7.9480 118.8188 57.5287 41.4367 179.2605 105 T 3.8880 7.3431 109.0323 63.7083 68.3762 176.5199 106 K 4.0487 7.6453 120.7844 58.7971 32.1027 177.7165 107 D 4.6547 7.5511 116.2547 53.1822 41.4062 176.5841 108 A 4.3459 6.8447 122.7729 51.9529 19.0052 178.1974 109 K 4.2870 8.9841 119.9053 58.7807 32.8227 177.0938 110 A 4.5990 7.3669 118.8533 51.2280 22.5930 175.0814 111 V 4.6551 8.5895 119.8809 61.1876 34.5580 174.4666 112 I 4.7228 9.2468 130.1741 59.8739 38.9026 174.6873 113 R 4.7203 9.0325 129.7891 55.7545 31.2489 176.1127 114 T 4.8832 8.8018 117.9642 60.3222 71.6028 174.5658 115 G 4.1157 8.7922 106.7813 46.0968 0.0000 173.2332 116 E 4.3804 8.2383 122.7799 56.1592 30.5898 177.8120 117 F 5.0714 8.8739 128.3716 57.5862 39.8660 175.4702 118 T 4.7026 7.5461 108.6467 58.6748 71.6540 171.8555 119 P 3.9318 0.0000 0.0000 64.5354 31.7248 175.6641 120 Y 3.5127 7.7105 118.4161 59.0503 35.8357 171.6127 121 A 3.9052 7.1717 119.8878 50.5552 16.6181 177.0342 122 N 5.6924 7.3272 117.1865 51.3025 43.6484 174.4961 123 C 5.2060 9.3256 114.8216 57.5178 33.8134 172.5102 124 I 4.9623 9.2295 121.7401 59.7094 39.4887 174.4572 125 L 4.6479 8.7216 127.3254 53.0973 43.8903 175.1075 126 Q 4.8838 8.6276 125.6588 53.9774 30.8779 174.6143 127 A 4.4345 9.1420 129.7812 52.6556 19.5642 177.1310 128 G 4.4362 8.9622 111.0880 44.8489 0.0000 173.2294 129 V 4.4094 7.9037 118.2762 59.8572 34.1473 175.2082 130 L 4.4273 8.2612 120.9011 54.9046 41.8236 176.9803 131 F 4.4484 6.9598 119.7327 57.3440 37.3363 173.8747 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 8.30 4.41 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 2 K 8.38 3.92 0.00 1.78 1.70 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.62 1.52 7.81 3 K 9.41 4.09 0.00 1.52 1.46 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.39 7.81 4 H 7.91 4.90 0.00 3.11 3.16 0.00 5.70 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 G 8.58 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 0.00 0.00 0.00 6 I 7.88 3.79 1.89 0.00 0.00 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 1.31 0.87 0.97 0.00 0.00 7 L 8.47 4.05 0.00 1.63 1.68 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 8 N 8.07 4.44 0.00 2.81 2.70 0.00 0.00 6.97 7.63 0.00 0.00 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 S 8.63 4.09 0.00 4.03 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 10 H 8.00 4.24 0.00 3.36 3.38 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 11 L 8.63 4.04 0.00 1.83 1.74 0.95 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 12 A 8.23 4.00 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 13 K 7.64 3.94 0.00 1.87 1.91 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.71 7.81 14 I 7.46 3.90 2.02 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 1.75 1.11 0.92 0.00 0.00 15 L 8.30 4.00 0.00 1.82 1.74 0.94 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 16 A 8.05 4.05 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 17 D 7.59 4.63 0.00 2.62 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 18 L 7.40 4.22 0.00 1.76 1.62 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 19 G 9.31 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 0.00 0.00 0.00 20 H 8.57 4.27 0.00 3.00 3.20 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 21 T 8.83 3.48 4.15 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 0.92 0.00 0.00 22 D 7.86 4.60 0.00 2.72 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 23 K 8.57 5.29 0.00 1.60 1.59 0.00 1.54 0.00 0.00 1.78 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.51 7.81 24 I 8.49 5.00 1.88 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.83 0.91 0.00 0.00 25 V 8.75 4.90 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 1.13 0.00 0.00 0.86 0.00 0.00 26 I 8.75 5.08 2.10 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 1.22 0.56 0.99 0.00 0.00 27 A 9.35 5.24 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 28 D 8.17 5.07 0.00 2.82 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 29 A 8.76 4.22 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 30 G 8.12 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 0.00 0.00 0.00 31 L 7.40 4.02 0.00 1.68 1.63 1.15 1.11 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 32 P 0.00 4.45 0.00 2.22 2.03 0.00 3.83 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 33 V 8.00 4.24 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 0.84 0.00 0.00 0.94 0.00 0.00 34 P 0.00 4.38 0.00 2.19 1.94 0.00 3.64 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.09 0.00 35 D 8.40 4.55 0.00 2.66 2.60 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 0.00 0.00 0.00 0.00 36 G 9.05 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 37 V 7.09 4.15 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 0.76 0.00 0.00 0.96 0.00 0.00 38 L 8.41 4.13 0.00 1.81 1.68 0.91 0.50 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 39 K 8.64 4.97 0.00 1.77 1.65 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.44 7.81 40 I 8.79 4.33 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.69 0.94 0.00 0.00 41 D 8.72 4.98 0.00 2.69 2.60 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 0.00 0.00 0.00 0.00 42 L 8.75 4.66 0.00 1.60 1.72 0.95 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 43 S 8.19 4.42 0.00 4.06 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 44 L 8.80 4.53 0.00 1.52 1.75 0.93 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 45 K 7.54 4.37 0.00 1.84 1.81 0.00 1.53 0.00 0.00 1.78 0.00 0.00 2.89 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.34 1.36 7.81 46 P 0.00 3.94 0.00 1.61 0.75 0.00 3.49 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.20 0.00 47 G 9.59 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 48 L 8.23 4.74 0.00 1.63 1.48 0.91 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.93 0.00 2.17 2.16 0.00 3.78 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 50 A 8.37 4.64 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 51 F 9.57 4.13 0.00 3.09 3.05 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 52 Q 7.90 3.11 0.00 1.75 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.68 0.00 0.00 0.00 0.00 0.00 1.16 2.05 0.00 53 D 7.84 4.33 0.00 2.87 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 54 T 7.80 3.82 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 1.22 0.00 0.00 55 A 8.04 3.99 1.22 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 56 A 8.13 3.91 1.51 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 0.00 0.00 57 V 7.70 3.54 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 1.04 0.00 0.00 0.96 0.00 0.00 58 L 8.03 4.02 0.00 2.00 1.78 0.95 0.84 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 59 A 7.98 4.14 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 60 E 7.96 4.05 0.00 1.90 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 0.00 2.32 2.39 0.00 61 E 7.88 4.54 0.00 2.00 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 2.42 2.44 0.00 62 M 7.78 4.66 0.00 2.08 1.91 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 2.51 2.47 0.00 63 A 8.49 4.40 1.26 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 0.00 0.00 64 V 8.43 4.67 2.20 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 0.72 0.00 0.00 1.00 0.00 0.00 65 E 9.04 4.52 0.00 2.08 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 2.38 2.21 0.00 66 K 7.61 4.82 0.00 1.76 1.56 0.00 1.61 0.00 0.00 1.69 0.00 0.00 2.72 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.51 7.81 67 V 8.85 4.68 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 0.78 0.00 0.00 -0.02 0.00 0.00 68 I 8.68 5.04 1.90 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 1.11 0.44 1.05 0.00 0.00 69 A 8.87 4.94 1.07 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 0.00 0.00 70 A 8.08 4.72 1.15 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 71 A 9.36 3.96 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 72 E 7.96 3.62 0.00 1.16 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 1.71 2.04 0.00 73 I 7.83 3.70 1.95 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 1.54 1.40 1.08 0.00 0.00 74 K 7.77 3.97 0.00 1.74 1.71 0.00 1.27 0.00 0.00 1.38 0.00 0.00 2.35 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.21 1.03 7.81 75 A 7.61 4.28 1.18 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 76 S 7.73 4.67 0.00 3.96 3.95 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 0.00 0.00 0.00 0.00 77 N 8.23 4.99 0.00 2.83 2.64 0.00 0.00 6.72 6.57 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 78 Q 8.20 4.00 0.00 2.20 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.62 0.00 0.00 0.00 0.00 0.00 2.44 2.55 0.00 79 E 8.28 4.01 0.00 2.05 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 2.43 2.39 0.00 80 N 8.23 4.65 0.00 2.88 2.95 0.00 0.00 7.02 7.83 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 81 A 8.15 4.17 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.54 3.98 0.00 2.05 1.94 0.00 1.74 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.70 7.81 83 F 8.24 4.08 0.00 3.27 3.41 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 84 L 8.32 4.17 0.00 2.40 1.99 1.38 1.27 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 85 E 8.11 4.11 0.00 2.22 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 0.00 2.65 2.62 0.00 86 N 8.14 4.40 0.00 2.65 2.74 0.00 0.00 6.98 8.58 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 87 L 7.55 3.63 0.00 0.59 1.08 0.49 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 88 F 8.08 5.45 0.00 3.17 3.01 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 89 S 7.96 4.26 0.00 3.97 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 90 E 8.10 4.14 0.00 2.01 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 0.00 2.31 2.32 0.00 91 Q 7.77 4.50 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.99 0.00 0.00 0.00 0.00 0.00 2.46 2.44 0.00 92 E 8.24 4.53 0.00 2.17 1.78 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 2.26 2.28 0.00 93 I 8.38 4.84 1.86 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 1.17 0.80 0.55 0.00 0.00 94 E 8.99 4.66 0.00 1.96 1.70 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 2.20 2.27 0.00 95 Y 8.64 5.19 0.00 2.89 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 96 L 8.91 5.13 0.00 1.67 1.60 0.97 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 97 S 8.54 4.57 0.00 4.03 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 98 H 9.05 4.19 0.00 3.52 3.51 0.00 5.79 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 E 8.23 3.99 0.00 2.06 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 2.47 2.39 0.00 100 E 8.02 3.98 0.00 2.15 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 2.36 2.49 0.00 101 F 8.28 4.03 0.00 3.10 3.24 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 0.00 102 K 8.34 4.03 0.00 2.01 1.85 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.54 7.81 103 L 7.65 3.95 0.00 1.92 1.69 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.95 4.00 0.00 1.61 1.52 0.85 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 105 T 7.34 3.89 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 0.89 0.00 0.00 106 K 7.65 4.05 0.00 1.78 1.88 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.51 7.81 107 D 7.55 4.65 0.00 2.62 2.65 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 0.00 108 A 6.84 4.35 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 0.00 109 K 8.98 4.29 0.00 1.60 1.88 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.58 1.53 7.81 110 A 7.37 4.60 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 0.00 111 V 8.59 4.66 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 1.10 0.00 0.00 0.94 0.00 0.00 112 I 9.25 4.72 1.99 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 1.15 0.59 0.95 0.00 0.00 113 R 9.03 4.72 0.00 1.91 1.95 0.00 3.09 0.00 0.00 3.64 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 114 T 8.80 4.88 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 115 G 8.79 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 0.00 0.00 0.00 116 E 8.24 4.38 0.00 2.27 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 0.00 2.30 2.36 0.00 117 F 8.87 5.07 0.00 2.90 3.05 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 0.00 118 T 7.55 4.70 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 1.30 0.00 0.00 119 P 0.00 3.93 0.00 2.18 2.01 0.00 3.82 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 2.04 2.05 0.00 120 Y 7.71 3.51 0.00 2.96 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 0.00 121 A 7.17 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 N 7.33 5.69 0.00 2.24 2.89 0.00 0.00 7.03 7.66 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 0.00 123 C 9.33 5.21 0.00 3.23 3.27 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 0.00 124 I 9.23 4.96 1.85 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.43 0.83 0.00 0.00 125 L 8.72 4.65 0.00 1.56 1.50 1.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 126 Q 8.63 4.88 0.00 2.06 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.99 0.00 0.00 0.00 0.00 0.00 2.22 2.41 0.00 127 A 9.14 4.43 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 0.00 128 G 8.96 4.44 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 V 7.90 4.41 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 0.43 0.00 0.00 0.06 0.00 0.00 130 L 8.26 4.43 0.00 1.84 1.83 0.98 0.79 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 0.00 131 F 6.96 4.45 0.00 3.12 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