NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.4629 8.2649 122.4603 52.1562 20.2826 176.8343 2 F 4.5154 9.6404 119.1205 56.0696 38.7498 173.5092 3 T 4.7659 8.5790 118.3220 62.8242 73.6301 173.6140 4 G 3.6255 8.7700 110.0823 44.2578 0.0000 172.8534 5 K 4.5340 7.5817 117.7824 56.1826 33.6811 176.5376 6 F 5.0288 9.3417 119.2150 56.4404 44.0478 173.4522 7 E 4.9632 9.3136 122.6540 53.8385 29.8128 173.6393 8 M 4.4440 8.9454 124.8452 55.4163 33.2351 174.4961 9 E 4.6769 8.9678 123.3728 57.1590 37.4300 175.2028 10 S 4.8756 8.0917 115.7184 56.0521 64.8156 172.4384 11 E 5.4545 8.6706 124.5356 55.1189 33.9860 174.1557 12 K 4.6988 8.6568 118.6278 54.8694 36.6223 175.9116 13 N 4.2182 8.9047 116.0957 54.2173 36.6977 176.7299 14 Y 3.3494 8.1363 118.8210 60.6701 39.0676 176.1682 15 D 4.4116 8.1843 119.6292 56.4569 39.4826 177.8354 16 E 3.8312 7.7875 119.5504 58.7746 29.6297 178.3388 17 F 3.8173 8.0252 120.5576 61.7051 39.2856 177.0615 18 M 3.8649 8.0168 118.3466 58.0371 31.7035 178.5749 19 K 3.7953 8.2576 120.2201 59.5084 32.1029 178.8589 20 L 3.8984 7.7245 118.3793 57.6072 41.5876 178.6215 21 L 3.6249 7.2616 119.6693 56.6799 43.1441 177.4870 22 G 4.2390 7.9736 107.4655 47.0519 0.0000 172.4991 23 I 4.6712 7.0161 120.4849 58.9974 41.9418 176.2240 24 S 4.4077 8.3663 119.0169 58.0090 64.7407 175.4832 25 S 4.1310 8.7110 120.1908 61.5782 62.1206 176.1311 26 D 4.4013 8.1744 121.2275 56.9963 38.8815 179.0562 27 V 3.7861 7.7923 113.1068 63.3745 31.7038 178.4492 28 I 3.8618 7.8245 119.9380 64.5214 36.9630 178.2130 29 E 3.9980 8.5526 119.4775 59.5850 29.3074 179.7381 30 K 4.0271 8.3455 118.3098 59.1831 31.8185 179.3181 31 A 4.1673 8.2398 120.9068 55.2656 18.4371 179.5531 32 R 3.6503 7.7771 115.1772 59.4007 30.2173 178.5124 33 N 4.5831 8.0432 114.9157 55.2040 38.6750 175.3488 34 F 4.2576 8.1430 123.4539 57.1540 39.3943 174.9808 35 K 4.0067 8.0097 128.3791 56.7771 32.2817 177.1403 36 I 4.5511 8.1761 125.7959 61.2678 38.6119 175.1967 37 V 4.7508 8.8519 124.3340 61.8015 35.0384 174.4079 38 T 5.1107 9.0281 120.5122 62.4838 73.4963 172.4437 39 E 5.2000 8.7689 123.2818 55.1089 33.8262 174.0525 40 V 4.5082 8.6851 124.0115 61.4052 35.6186 174.0903 41 Q 4.8466 8.3717 122.6221 53.3539 29.2732 174.0416 42 Q 3.3471 8.3554 122.6829 55.7870 30.1624 176.3493 43 D 4.4413 8.1040 123.1133 53.8163 42.4915 175.2250 44 G 4.0780 8.6650 111.2962 46.5045 0.0000 169.9969 45 Q 4.5438 7.9306 118.8708 55.9532 27.8312 174.2551 46 D 5.1401 7.5326 115.9161 54.1639 42.6071 175.3648 47 F 4.8071 8.6420 120.1710 56.2720 43.5489 173.9347 48 T 4.8579 8.2811 116.4855 61.4709 69.6808 172.6649 49 W 4.5863 9.0291 135.0000 57.0681 32.5338 174.7467 50 S 5.3882 9.0778 120.4742 57.2426 67.4934 172.7511 51 Q 5.0438 9.0115 119.1840 55.1121 34.0079 174.5489 52 H 5.1681 9.1541 118.0311 55.5547 32.8317 172.4675 53 Y 4.8193 8.4485 120.9632 55.9859 41.6600 174.0263 54 S 3.4295 9.6302 113.7663 59.5592 59.8106 172.5411 55 G 3.3205 7.0407 104.5952 45.5541 0.0000 171.6077 56 G 3.6797 5.5772 104.3125 45.9782 0.0000 173.8842 57 H 4.1290 7.3773 117.6959 55.8088 29.2934 175.5305 58 T 4.4467 8.4673 120.6079 63.9601 69.4251 173.7434 59 M 4.9630 8.8896 123.0460 54.5086 36.2720 173.6905 60 T 5.1478 8.5914 120.0803 62.1983 71.4877 173.2629 61 N 5.3738 9.2885 121.1614 52.1221 43.6539 173.2990 62 K 4.8150 8.1894 117.3592 56.6625 35.2129 173.9262 63 F 4.7464 7.2248 114.9167 57.0451 41.9427 172.3896 64 T 5.2989 7.9908 115.1028 61.6902 71.2068 174.8427 65 V 4.0746 8.5480 119.6960 62.6550 32.2275 176.0147 66 G 4.0936 9.1309 112.3601 44.9626 0.0000 173.8681 67 K 4.5856 7.2498 116.9743 54.1431 34.2958 175.8376 68 E 4.1961 8.4031 121.6784 56.5815 30.5237 176.0683 69 S 4.8260 8.7564 119.1859 56.8738 68.0312 172.5902 70 N 4.9086 8.7943 121.1197 53.4166 40.0744 174.3593 71 I 4.5229 8.5293 127.0134 59.0937 39.6361 175.1927 72 Q 4.1517 8.6216 125.3076 56.1999 29.6676 176.7598 73 T 4.2949 7.6555 115.3948 62.2167 68.8451 173.0168 74 M 3.5296 7.9985 123.5514 54.2253 31.8232 178.5963 75 G 3.8817 8.6575 109.5762 44.9519 0.0000 174.4169 76 G 4.8714 7.7543 123.5097 46.8183 0.0000 170.6262 77 K 4.6147 6.7499 119.5190 55.2113 34.6465 175.3503 78 T 4.6235 8.1457 115.7066 63.0363 72.4537 172.6833 79 F 5.0034 7.9963 118.3453 56.1633 41.8798 172.8041 80 K 5.1890 8.6117 117.9955 55.3035 34.3514 175.4691 81 A 4.4865 8.6376 122.9237 51.9254 23.6093 175.0030 82 T 4.5960 7.5742 116.1424 61.9114 70.7879 174.4502 83 V 3.9058 8.0312 125.8698 61.6831 33.8191 174.3493 84 Q 4.7773 8.8313 123.9284 54.5666 34.0048 173.7660 85 M 4.7043 8.4516 119.1875 54.3037 34.4140 175.1498 86 E 4.4587 8.6198 128.5520 55.1821 28.4403 178.3871 87 G 3.8812 7.9215 117.2616 46.0814 0.0000 174.9648 88 G 3.8624 8.9620 112.0745 48.1010 0.0000 173.6145 89 K 4.4533 7.5962 116.3057 56.2546 33.8741 176.6004 90 L 4.6367 8.8324 126.8168 53.2946 41.4274 175.8677 91 V 4.1217 8.1748 124.1149 62.6267 33.2318 174.4704 92 V 4.3982 7.6070 121.9407 60.8146 33.6599 172.1984 93 N 4.5393 7.6809 118.2218 51.7606 43.2282 173.5204 94 F 4.7757 8.2950 118.1735 54.9298 43.3641 173.0174 95 P 4.1544 0.0000 0.0000 64.5523 31.3564 176.4242 96 N 4.1956 8.7073 120.8081 53.8792 36.5889 173.3818 97 Y 4.8534 7.3621 113.1355 57.5134 42.2177 171.9423 98 H 4.9268 8.6099 124.0694 55.1868 34.1878 171.3719 99 Q 4.9233 7.6137 122.1935 55.3535 33.1603 172.9170 100 T 4.7096 8.3919 112.0500 60.0371 72.4174 173.0636 101 S 5.1419 8.2265 118.8742 57.2785 66.7561 172.5266 102 E 5.2189 8.9832 120.3006 55.6212 33.4469 173.7607 103 I 4.7739 8.1295 126.0597 59.7908 38.9323 175.4242 104 V 4.3072 8.5613 126.2628 62.1750 34.2183 175.4300 105 G 4.1327 9.5440 114.4326 46.5952 0.0000 172.1622 106 D 4.4201 8.3402 113.5539 54.8850 39.7604 173.0000 107 K 4.8287 8.0210 115.1978 54.3191 37.2489 176.0443 108 L 4.5758 8.8863 125.8929 54.5025 43.1514 175.9574 109 V 5.0440 8.7821 118.8092 59.9540 36.4373 174.3277 110 E 4.8378 8.7704 120.3460 55.2758 34.6954 174.7463 111 V 4.7839 8.5833 120.8607 61.3093 32.1097 174.8288 112 S 4.6561 8.4321 121.4244 58.0784 64.6815 172.8781 113 T 5.3095 8.8159 116.1852 63.2385 73.3964 172.7043 114 I 4.0647 9.1909 123.5763 62.5410 41.7472 176.0823 115 G 4.0191 9.4904 116.5757 46.1650 0.0000 175.2023 116 G 4.2948 8.6100 107.4751 42.9725 0.0000 173.3137 117 V 4.4114 7.9073 116.8676 60.4397 34.7962 174.2227 118 T 4.5810 8.3229 117.3066 62.4717 69.3920 174.0244 119 Y 5.2340 8.4001 118.1527 56.8621 40.5844 173.1106 120 E 4.4362 8.3126 124.1228 56.1604 31.7714 175.6490 121 R 5.0287 8.6886 123.5718 54.4107 34.5453 174.5802 122 V 4.7216 8.3545 119.3810 61.5185 35.4896 174.7024 123 S 5.0273 8.8893 121.7117 57.3616 65.3393 173.6651 124 K 4.4101 8.7701 126.6988 56.5299 33.2267 176.2618 125 R 4.7004 8.2771 122.6262 55.4156 31.9085 174.9739 126 L 4.3571 7.7100 123.1149 55.9181 44.5497 174.6597 127 A 4.0336 8.2078 120.9856 52.7585 19.0281 176.0380 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 A 8.26 4.46 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 2 F 9.64 4.52 0.00 3.45 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 3 T 8.58 4.77 4.28 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 1.20 0.00 0.00 4 G 8.77 3.63 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 K 7.58 4.53 0.00 1.68 1.66 0.00 1.58 0.00 0.00 1.61 0.00 0.00 2.85 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.51 1.32 7.81 6 F 9.34 5.03 0.00 2.86 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 7 E 9.31 4.96 0.00 2.01 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 2.25 2.21 0.00 8 M 8.95 4.44 0.00 2.35 2.07 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.56 0.00 9 E 8.97 4.68 0.00 1.91 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 2.35 2.26 0.00 10 S 8.09 4.88 0.00 3.92 3.76 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 11 E 8.67 5.45 0.00 1.95 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 2.59 2.64 0.00 12 K 8.66 4.70 0.00 1.69 1.73 0.00 1.90 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.47 7.81 13 N 8.90 4.22 0.00 3.06 2.89 0.00 0.00 6.62 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 14 Y 8.14 3.35 0.00 2.97 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 15 D 8.18 4.41 0.00 2.95 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 16 E 7.79 3.83 0.00 2.15 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 2.30 2.33 0.00 17 F 8.03 3.82 0.00 2.97 2.56 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 18 M 8.02 3.86 0.00 1.91 1.91 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.83 0.00 19 K 8.26 3.80 0.00 1.85 1.88 0.00 1.47 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.46 7.81 20 L 7.72 3.90 0.00 1.40 1.45 0.82 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 21 L 7.26 3.62 0.00 0.81 1.54 0.40 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 22 G 7.97 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 0.00 0.00 0.00 0.00 23 I 7.02 4.67 1.89 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 1.36 0.88 0.92 0.00 0.00 24 S 8.37 4.41 0.00 3.93 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 25 S 8.71 4.13 0.00 3.89 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 26 D 8.17 4.40 0.00 2.93 2.95 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 27 V 7.79 3.79 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 0.87 0.00 0.00 1.05 0.00 0.00 28 I 7.82 3.86 2.06 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 1.55 1.17 1.08 0.00 0.00 29 E 8.55 4.00 0.00 2.02 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 2.36 2.52 0.00 30 K 8.35 4.03 0.00 1.92 1.91 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.58 7.81 31 A 8.24 4.17 1.62 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 0.00 0.00 32 R 7.78 3.65 0.00 1.85 1.82 0.00 3.06 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 1.59 0.00 33 N 8.04 4.58 0.00 2.89 2.93 0.00 0.00 7.11 7.23 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 34 F 8.14 4.26 0.00 2.98 3.03 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 35 K 8.01 4.01 0.00 1.39 1.78 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.79 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.36 1.34 7.81 36 I 8.18 4.55 2.08 0.00 0.00 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 1.55 1.27 1.24 0.00 0.00 37 V 8.85 4.75 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 1.10 0.00 0.00 1.00 0.00 0.00 38 T 9.03 5.11 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 39 E 8.77 5.20 0.00 2.01 1.79 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 2.21 2.39 0.00 40 V 8.69 4.51 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 1.10 0.00 0.00 -0.74 0.00 0.00 41 Q 8.37 4.85 0.00 2.02 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.71 0.00 0.00 0.00 0.00 0.00 2.25 2.27 0.00 42 Q 8.36 3.35 0.00 2.10 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 7.47 0.00 0.00 0.00 0.00 0.00 2.00 1.16 0.00 43 D 8.10 4.44 0.00 2.58 2.42 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 44 G 8.66 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 45 Q 7.93 4.54 0.00 2.32 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 7.04 0.00 0.00 0.00 0.00 0.00 2.40 2.36 0.00 46 D 7.53 5.14 0.00 2.76 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 47 F 8.64 4.81 0.00 1.51 2.52 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 0.00 48 T 8.28 4.86 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 1.26 0.00 0.00 49 W 9.03 4.59 0.00 3.78 3.09 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 50 S 9.08 5.39 0.00 3.91 3.73 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 51 Q 9.01 5.04 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.91 0.00 0.00 0.00 0.00 0.00 2.54 2.57 0.00 52 H 9.15 5.17 0.00 3.33 3.31 0.00 5.64 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 Y 8.45 4.82 0.00 3.07 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 54 S 9.63 3.43 0.00 3.95 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 55 G 7.04 3.32 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 0.00 56 G 5.58 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 57 H 7.38 4.13 0.00 2.35 2.96 0.00 5.62 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 T 8.47 4.45 4.28 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 1.29 0.00 0.00 59 M 8.89 4.96 0.00 2.34 2.08 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.61 0.00 60 T 8.59 5.15 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 1.28 0.00 0.00 61 N 9.29 5.37 0.00 2.95 2.78 0.00 0.00 6.65 6.47 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 62 K 8.19 4.81 0.00 1.78 1.76 0.00 1.64 0.00 0.00 1.79 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.44 7.81 63 F 7.22 4.75 0.00 3.11 3.18 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 64 T 7.99 5.30 4.33 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 1.30 0.00 0.00 65 V 8.55 4.07 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 0.63 0.00 0.00 1.09 0.00 0.00 66 G 9.13 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 0.00 0.00 0.00 67 K 7.25 4.59 0.00 1.95 1.76 0.00 1.63 0.00 0.00 1.77 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.41 7.81 68 E 8.40 4.20 0.00 1.92 1.85 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 2.32 2.47 0.00 69 S 8.76 4.83 0.00 3.85 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 70 N 8.79 4.91 0.00 2.76 2.74 0.00 0.00 6.82 7.94 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 71 I 8.53 4.52 1.69 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.81 0.00 0.00 72 Q 8.62 4.15 0.00 2.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.18 7.37 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 73 T 7.66 4.29 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 1.23 0.00 0.00 74 M 8.00 3.53 0.00 2.26 2.12 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.51 0.00 75 G 8.66 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 76 G 7.75 4.87 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 0.00 0.00 0.00 77 K 6.75 4.61 0.00 2.00 1.75 0.00 1.68 0.00 0.00 1.63 0.00 0.00 3.09 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.40 7.81 78 T 8.15 4.62 4.22 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 1.15 0.00 0.00 79 F 8.00 5.00 0.00 3.13 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 80 K 8.61 5.19 0.00 1.73 1.89 0.00 1.83 0.00 0.00 1.75 0.00 0.00 2.75 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.41 1.49 7.81 81 A 8.64 4.49 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 82 T 7.57 4.60 4.07 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 1.13 0.00 0.00 83 V 8.03 3.91 1.43 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 -0.13 0.00 0.00 0.16 0.00 0.00 84 Q 8.83 4.78 0.00 1.87 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.41 0.00 0.00 0.00 0.00 0.00 2.15 2.08 0.00 85 M 8.45 4.70 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.74 0.00 86 E 8.62 4.46 0.00 1.95 1.89 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 2.23 2.35 0.00 87 G 7.92 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 88 G 8.96 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 0.00 0.00 0.00 89 K 7.60 4.45 0.00 1.74 1.76 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.78 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.59 1.43 7.81 90 L 8.83 4.64 0.00 0.87 0.90 0.39 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 91 V 8.17 4.12 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 0.63 0.00 0.00 0.89 0.00 0.00 92 V 7.61 4.40 1.55 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 0.39 0.00 0.00 0.03 0.00 0.00 93 N 7.68 4.54 0.00 2.24 2.45 0.00 0.00 6.73 8.03 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 94 F 8.30 4.78 0.00 2.82 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 0.00 0.00 0.00 0.00 95 P 0.00 4.15 0.00 1.99 1.99 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 2.00 2.09 0.00 96 N 8.71 4.20 0.00 2.80 2.85 0.00 0.00 6.89 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 97 Y 7.36 4.85 0.00 2.83 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 98 H 8.61 4.93 0.00 3.20 3.02 0.00 5.85 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 7.61 4.92 0.00 2.20 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.35 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 100 T 8.39 4.71 4.20 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 1.22 0.00 0.00 101 S 8.23 5.14 0.00 3.57 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 0.00 102 E 8.98 5.22 0.00 2.10 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 2.23 2.34 0.00 103 I 8.13 4.77 1.64 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.14 0.64 0.91 0.00 0.00 104 V 8.56 4.31 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 0.94 0.00 0.00 0.95 0.00 0.00 105 G 9.54 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 0.00 0.00 0.00 106 D 8.34 4.42 0.00 2.77 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 0.00 107 K 8.02 4.83 0.00 1.80 1.68 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.58 1.53 7.81 108 L 8.89 4.58 0.00 1.02 1.59 1.20 0.51 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 0.00 109 V 8.78 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 0.73 0.00 0.00 0.98 0.00 0.00 110 E 8.77 4.84 0.00 1.71 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 2.25 0.00 111 V 8.58 4.78 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 0.98 0.00 0.00 0.92 0.00 0.00 112 S 8.43 4.66 0.00 3.34 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 0.00 113 T 8.82 5.31 4.40 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 1.37 0.00 0.00 114 I 9.19 4.06 1.55 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 1.03 0.38 0.00 0.00 115 G 9.49 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 0.00 0.00 0.00 116 G 8.61 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 V 7.91 4.41 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 0.74 0.00 0.00 1.00 0.00 0.00 118 T 8.32 4.58 4.31 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 1.28 0.00 0.00 119 Y 8.40 5.23 0.00 2.84 2.52 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 0.00 120 E 8.31 4.44 0.00 2.11 1.84 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 2.38 2.47 0.00 121 R 8.69 5.03 0.00 1.64 1.70 0.00 3.00 0.00 0.00 2.85 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.96 0.00 122 V 8.35 4.72 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 1.06 0.00 0.00 0.96 0.00 0.00 123 S 8.89 5.03 0.00 4.00 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 0.00 124 K 8.77 4.41 0.00 1.91 1.74 0.00 1.80 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.51 7.81 125 R 8.28 4.70 0.00 1.94 1.86 0.00 3.39 0.00 0.00 3.53 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.90 0.00 126 L 7.71 4.36 0.00 1.58 1.66 0.89 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 127 A 8.21 4.03 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