NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5556 8.3049 120.7143 53.7620 33.8071 174.3515 2 P 4.3119 0.0000 0.0000 64.6030 32.2393 172.3630 3 E 4.7919 9.9522 124.7271 53.8749 33.6131 175.4228 4 R 4.2140 8.6544 122.8697 58.4784 30.4089 176.4130 5 L 4.0935 8.9807 124.1470 54.6755 41.1742 175.0636 6 Q 4.2352 7.9988 118.0725 55.8318 30.1938 175.2692 7 V 4.8069 8.2961 122.2162 61.4603 33.9996 173.7541 8 Y 5.1912 9.0240 125.2516 56.0763 41.2460 174.6333 9 K 5.0465 9.2844 123.7336 54.7990 36.3874 174.4596 10 C 4.7422 9.0290 127.6652 58.1659 32.1389 174.0901 11 E 4.2122 9.0535 126.1483 58.1375 29.5069 178.3515 12 V 3.9245 7.7922 118.6833 64.9424 32.0220 176.3808 13 C 4.3732 8.0731 111.6894 58.0971 30.5038 174.4501 14 G 4.0341 8.2214 108.5721 44.7007 0.0000 173.3862 15 N 4.5666 8.0337 117.5648 53.6418 39.8106 174.0336 16 I 5.1325 8.2354 122.3464 59.8647 40.9512 174.9170 17 V 4.5796 9.0255 119.1283 59.4704 36.2444 173.9165 18 E 5.0832 8.5145 122.1759 54.3636 32.4143 175.3004 19 V 3.8708 8.7539 126.9155 62.8127 32.1066 176.4729 20 L 4.3756 8.6796 127.3355 55.8123 42.8819 176.3688 21 N 4.8645 7.8219 116.3742 51.6970 41.4848 174.7450 22 G 3.8833 8.9580 113.6856 46.4663 0.0000 171.5428 23 G 4.2528 7.8846 106.6906 45.9894 0.0000 173.6798 24 I 4.1450 8.6148 112.2917 61.8065 38.3336 176.5846 25 G 3.7627 7.7127 110.2446 44.9641 0.0000 172.5241 26 E 4.2266 8.4074 123.6458 55.1697 30.8318 175.9186 27 L 4.1656 8.2339 126.9602 54.6438 42.7997 176.0210 28 V 4.9081 8.1441 122.8784 61.5233 34.8659 174.2222 29 C 4.5657 9.1555 124.2306 59.8121 35.0574 173.6024 30 C 4.3400 9.3935 123.1226 61.6095 25.1898 172.5454 31 N 4.2840 8.2286 108.5072 53.5543 36.4472 174.5158 32 Q 4.6190 7.6330 112.6569 54.7974 31.6609 173.2411 33 D 4.8656 8.5510 119.4649 54.9111 41.3814 176.5529 34 M 4.4400 8.4956 123.8271 55.1903 33.0648 175.9299 35 K 4.3038 9.4906 124.9210 55.7306 33.8371 175.5076 36 L 3.5694 8.4440 129.9688 55.0931 42.5141 177.0674 37 M 4.3928 8.6818 128.5699 53.9386 30.3449 176.1392 38 S 4.2019 7.9280 117.6371 57.9361 64.1118 174.2854 39 E 3.8462 8.3809 123.3128 57.3875 30.3798 176.7393 40 N 3.1400 7.7200 119.5856 54.6887 36.1843 174.4679 41 T 4.2672 6.5543 105.4255 61.6727 71.5121 175.4108 42 V 3.6503 7.0207 121.7645 62.3658 32.0088 175.9467 43 D 4.6187 8.5052 126.9332 53.6176 39.2430 174.3844 44 A 4.6362 8.0814 125.7073 49.1440 22.9697 175.6453 45 A 3.9219 8.4547 121.4799 53.0047 18.7350 179.0560 46 K 3.8211 8.6744 123.1832 59.1498 32.7454 178.8313 47 E 4.1540 8.0773 114.8584 57.4897 29.5968 177.6829 48 K 4.6279 7.6036 117.1120 56.4714 34.2431 176.0336 49 H 4.2504 6.9046 113.1087 56.2045 31.0166 175.4046 50 V 3.7791 7.3555 118.6853 62.3121 31.6308 174.6504 51 P 4.5459 0.0000 0.0000 62.8109 32.3933 175.7175 52 V 4.3149 8.9218 123.8589 61.3889 33.4549 174.2733 53 I 4.8596 8.3947 128.8531 59.8334 38.8994 174.7517 54 E 4.6525 9.3012 127.7094 53.9763 32.2863 175.0189 55 K 4.1391 8.9003 126.9630 56.9777 33.2219 176.2595 56 I 4.3294 8.0632 115.6861 59.4411 40.7211 173.1680 57 D 4.4513 8.4914 120.3239 55.1872 40.8760 175.6137 58 G 3.8289 8.5660 116.9477 44.6690 0.0000 173.1512 59 G 4.0891 6.1160 106.8585 45.6276 0.0000 171.4419 60 Y 5.2722 8.4197 117.3645 56.2409 43.1026 174.3148 61 K 5.0286 9.3461 123.3090 54.7187 35.0990 174.8042 62 V 5.1128 9.0247 127.7312 60.9671 34.2609 174.3338 63 K 5.1202 8.9206 126.2551 55.0319 36.5433 175.3920 64 V 4.5925 9.2012 121.7522 60.2453 33.7311 174.4269 65 G 4.1848 8.8413 120.0356 45.0270 0.0000 173.4246 66 A 4.1239 8.9645 125.2798 53.8336 18.8091 177.3756 67 V 4.3712 8.1649 115.4678 60.5027 34.1879 175.3407 68 A 4.3568 8.5972 129.3948 52.6110 18.6209 176.7034 69 H 4.2072 9.1868 123.7905 55.1802 30.7210 173.5507 70 P 4.3799 0.0000 0.0000 62.5689 32.7190 175.7429 71 M 5.1356 7.9978 118.6204 54.0725 32.7216 174.6110 72 E 4.7594 8.5022 120.5810 54.6920 31.8701 177.8971 73 E 3.8095 8.7470 120.0632 59.0816 29.5277 178.5553 74 K 4.7647 7.7862 114.7546 55.9258 33.3196 176.4349 75 H 5.6076 8.5385 118.4003 56.5676 31.5165 171.5914 76 Y 5.5403 7.8981 122.5894 54.5520 42.5003 173.8682 77 I 4.0489 8.2254 120.2129 60.2842 37.2176 176.4897 78 Q 4.3391 8.7491 128.5327 58.5779 29.8823 176.3129 79 W 5.2679 7.1776 113.2838 55.8673 31.3071 173.4599 80 I 5.1854 8.8592 121.0981 59.6312 40.6477 174.3150 81 E 5.1668 9.9406 127.0431 54.2736 33.4496 173.8411 82 L 4.7721 8.6934 128.1511 53.1314 44.5741 174.6790 83 L 5.0201 8.9975 127.2398 53.0380 44.1765 175.8379 84 A 4.4605 8.6362 125.3912 50.7572 22.3821 175.4948 85 D 4.6344 8.8033 123.8892 56.5154 39.5122 174.5817 86 D 4.9093 8.7127 123.8075 55.2321 41.4280 175.8281 87 K 4.6624 8.0576 118.5491 55.1384 34.2119 175.6370 88 C 4.8160 8.4096 121.8402 58.5724 32.9943 171.1843 89 Y 4.8430 8.9772 123.0277 56.6558 39.4206 174.5547 90 T 5.0515 8.6426 120.5431 61.6489 71.7634 173.1708 91 Q 4.5929 9.2113 127.4710 54.3517 31.3572 174.3085 92 F 5.1714 8.9556 125.6346 57.1485 40.2571 175.0442 93 L 5.2465 8.9630 122.0109 53.1523 45.3045 175.4814 94 K 4.7352 8.9599 117.6852 54.0454 36.2398 174.6040 95 P 4.3622 0.0000 0.0000 64.2619 31.6659 176.0269 96 G 4.0395 8.7514 110.0444 45.7731 0.0000 174.1791 97 Q 4.2733 7.4037 116.9657 54.7390 29.6885 175.2380 98 A 4.2770 8.2032 122.5844 51.2085 19.9201 177.1964 99 P 4.6788 0.0000 0.0000 61.4160 29.4842 174.1436 100 E 5.2054 7.4682 116.3582 56.8019 33.0154 175.7297 101 A 4.5551 9.1486 120.7312 50.7606 23.0818 175.2199 102 V 4.5655 7.9296 119.8083 61.0970 33.7897 175.0197 103 F 4.9094 9.4689 126.2216 55.7575 41.9498 174.6507 104 L 4.9880 8.8767 125.0285 53.6288 41.3835 176.0113 105 I 4.6868 8.3609 125.5255 60.2263 42.2248 174.2410 106 E 4.6710 8.3531 121.8483 54.6433 30.5116 176.2049 107 A 4.3391 8.0725 123.0403 51.0599 21.6277 175.8585 108 A 4.4705 8.9998 126.8446 52.6720 19.2739 178.1136 109 K 4.6122 7.7278 117.0766 52.9052 34.1254 180.6299 110 V 4.6550 8.9874 118.2229 58.5071 36.1707 175.0637 111 V 4.7055 8.6193 122.8527 61.0248 34.4194 173.9904 112 A 5.2145 9.4096 130.3097 50.2746 21.6176 175.4783 113 R 5.2584 9.2789 119.9801 54.5367 34.6238 174.4937 114 A 5.1613 9.1693 122.1384 50.6568 23.4972 174.4922 115 Y 4.7108 8.0111 120.2515 55.7610 41.9554 173.7301 116 C 4.6236 8.2531 128.2198 57.6148 32.9155 174.2902 117 N 4.4886 8.4709 123.7499 55.4459 37.2338 176.8115 118 I 3.8978 7.6535 117.8148 63.3011 38.1999 176.1100 119 H 4.6751 8.0733 113.5143 55.3077 29.2923 177.1022 120 G 3.4496 7.4857 108.5414 44.9621 0.0000 171.4731 121 H 5.3555 8.3021 118.9449 55.2709 31.5618 175.6833 122 W 5.6059 9.1825 124.1333 55.2041 33.7924 173.9988 123 K 5.2804 9.2048 119.7947 56.3927 35.4663 174.7626 124 A 4.8895 9.3053 121.8766 51.0415 23.0333 174.9991 125 E 5.0395 8.4314 116.2607 54.6872 32.9745 175.0988 126 N 4.5131 8.3376 117.8106 53.1986 37.6648 174.8762 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 4.56 0.00 1.82 1.95 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.15 0.00 2 P 0.00 4.31 0.00 2.08 1.94 0.00 3.69 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.90 0.00 3 E 9.95 4.79 0.00 1.90 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 2.23 2.43 0.00 4 R 8.65 4.21 0.00 1.77 1.87 0.00 3.26 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.83 0.00 5 L 8.98 4.09 0.00 1.80 1.99 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 6 Q 8.00 4.24 0.00 2.34 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.77 0.00 0.00 0.00 0.00 0.00 2.39 2.52 0.00 7 V 8.30 4.81 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 1.00 0.00 0.00 1.03 0.00 0.00 8 Y 9.02 5.19 0.00 2.97 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 9 K 9.28 5.05 0.00 1.80 1.66 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.55 7.81 10 C 9.03 4.74 0.00 3.06 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 11 E 9.05 4.21 0.00 2.03 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 2.35 2.33 0.00 12 V 7.79 3.92 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 0.84 0.00 0.00 0.98 0.00 0.00 13 C 8.07 4.37 0.00 3.13 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 14 G 8.22 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 0.00 0.00 0.00 15 N 8.03 4.57 0.00 2.68 2.77 0.00 0.00 6.83 7.22 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 16 I 8.24 5.13 1.90 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 1.38 0.87 0.92 0.00 0.00 17 V 9.03 4.58 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 0.67 0.00 0.00 1.02 0.00 0.00 18 E 8.51 5.08 0.00 1.81 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 2.15 2.26 0.00 19 V 8.75 3.87 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 0.95 0.00 0.00 1.08 0.00 0.00 20 L 8.68 4.38 0.00 1.66 1.69 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 21 N 7.82 4.86 0.00 2.64 2.63 0.00 0.00 6.94 7.98 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 22 G 8.96 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 23 G 7.88 4.25 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 0.00 0.00 0.00 24 I 8.61 4.15 1.86 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 1.33 0.65 0.90 0.00 0.00 25 G 7.71 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 0.00 0.00 0.00 26 E 8.41 4.23 0.00 1.97 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 2.24 2.32 0.00 27 L 8.23 4.17 0.00 1.29 1.40 0.37 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 28 V 8.14 4.91 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 0.78 0.00 0.00 0.98 0.00 0.00 29 C 9.16 4.57 0.00 2.97 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 30 C 9.39 4.34 0.00 3.14 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 31 N 8.23 4.28 0.00 2.84 2.89 0.00 0.00 7.00 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 32 Q 7.63 4.62 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.31 6.98 0.00 0.00 0.00 0.00 0.00 2.55 2.34 0.00 33 D 8.55 4.87 0.00 2.73 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 34 M 8.50 4.44 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.53 0.00 35 K 9.49 4.30 0.00 1.84 1.82 0.00 1.74 0.00 0.00 1.59 0.00 0.00 2.74 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.38 7.81 36 L 8.44 3.57 0.00 1.30 1.41 0.32 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 37 M 8.68 4.39 0.00 2.01 2.10 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.87 0.00 38 S 7.93 4.20 0.00 3.74 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 39 E 8.38 3.85 0.00 1.79 1.71 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 2.09 1.98 0.00 40 N 7.72 3.14 0.00 2.67 2.72 0.00 0.00 6.77 7.91 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 41 T 6.55 4.27 4.10 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 1.11 0.00 0.00 42 V 7.02 3.65 2.18 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 0.86 0.00 0.00 0.87 0.00 0.00 43 D 8.51 4.62 0.00 2.68 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 44 A 8.08 4.64 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 45 A 8.45 3.92 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 46 K 8.67 3.82 0.00 1.82 1.87 0.00 1.74 0.00 0.00 1.94 0.00 0.00 3.15 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.71 1.48 7.81 47 E 8.08 4.15 0.00 2.06 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 2.27 2.22 0.00 48 K 7.60 4.63 0.00 1.49 1.54 0.00 1.56 0.00 0.00 1.52 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.19 1.29 7.81 49 H 6.90 4.25 0.00 1.40 1.31 0.00 5.86 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 V 7.36 3.78 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 0.78 0.00 0.00 1.08 0.00 0.00 51 P 0.00 4.55 0.00 2.00 2.01 0.00 3.70 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.14 0.00 52 V 8.92 4.31 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 0.99 0.00 0.00 0.92 0.00 0.00 53 I 8.39 4.86 1.90 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.73 0.96 0.00 0.00 54 E 9.30 4.65 0.00 2.03 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 2.21 2.28 0.00 55 K 8.90 4.14 0.00 1.66 1.61 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.65 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.54 1.43 7.81 56 I 8.06 4.33 1.84 0.00 0.00 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 1.17 0.46 0.94 0.00 0.00 57 D 8.49 4.45 0.00 2.61 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 58 G 8.57 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 59 G 6.12 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 60 Y 8.42 5.27 0.00 2.96 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 61 K 9.35 5.03 0.00 1.82 1.80 0.00 1.58 0.00 0.00 1.81 0.00 0.00 2.81 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.37 7.81 62 V 9.02 5.11 2.35 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 1.10 0.00 0.00 1.11 0.00 0.00 63 K 8.92 5.12 0.00 1.85 1.87 0.00 1.30 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.32 1.50 7.81 64 V 9.20 4.59 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 0.89 0.00 0.00 0.91 0.00 0.00 65 G 8.84 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 0.00 0.00 0.00 0.00 66 A 8.96 4.12 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 67 V 8.16 4.37 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 0.97 0.00 0.00 0.88 0.00 0.00 68 A 8.60 4.36 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 69 H 9.19 4.21 0.00 3.20 3.13 0.00 5.77 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 P 0.00 4.38 0.00 1.90 1.90 0.00 2.76 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.01 0.00 71 M 8.00 5.14 0.00 2.03 1.97 0.00 0.00 0.00 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.67 0.00 72 E 8.50 4.76 0.00 2.08 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 2.30 2.45 0.00 73 E 8.75 3.81 0.00 1.94 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 0.00 2.28 2.27 0.00 74 K 7.79 4.76 0.00 1.76 1.83 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.39 1.42 7.81 75 H 8.54 5.61 0.00 3.18 3.20 0.00 5.61 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 7.90 5.54 0.00 3.04 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 77 I 8.23 4.05 1.83 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.67 0.84 0.00 0.00 78 Q 8.75 4.34 0.00 1.74 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.66 0.00 0.00 0.00 0.00 0.00 1.70 1.83 0.00 79 W 7.18 5.27 0.00 3.16 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 80 I 8.86 5.19 2.10 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.92 1.20 0.00 0.00 81 E 9.94 5.17 0.00 2.17 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 2.15 2.28 0.00 82 L 8.69 4.77 0.00 0.27 0.59 0.57 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 83 L 9.00 5.02 0.00 1.47 1.47 0.89 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 84 A 8.64 4.46 1.01 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 0.00 0.00 85 D 8.80 4.63 0.00 2.79 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 0.00 0.00 0.00 0.00 86 D 8.71 4.91 0.00 2.65 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.06 4.66 0.00 1.70 1.34 0.00 1.43 0.00 0.00 1.26 0.00 0.00 2.88 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.45 1.31 7.81 88 C 8.41 4.82 0.00 2.93 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 89 Y 8.98 4.84 0.00 2.70 3.02 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 90 T 8.64 5.05 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 0.29 0.00 0.00 91 Q 9.21 4.59 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.95 0.00 0.00 0.00 0.00 0.00 2.18 2.40 0.00 92 F 8.96 5.17 0.00 3.10 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 93 L 8.96 5.25 0.00 1.93 1.74 1.05 0.83 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 94 K 8.96 4.74 0.00 1.78 1.59 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.49 7.81 95 P 0.00 4.36 0.00 2.03 1.82 0.00 3.36 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.68 0.00 96 G 8.75 4.04 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 0.00 0.00 0.00 97 Q 7.40 4.27 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 98 A 8.20 4.28 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 99 P 0.00 4.68 0.00 2.38 2.25 0.00 3.75 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.09 0.00 100 E 7.47 5.21 0.00 2.09 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 2.19 2.30 0.00 101 A 9.15 4.56 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 0.00 102 V 7.93 4.57 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 0.84 0.00 0.00 0.88 0.00 0.00 103 F 9.47 4.91 0.00 3.10 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 0.00 104 L 8.88 4.99 0.00 1.66 1.75 0.96 0.96 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 I 8.36 4.69 1.88 0.00 0.00 0.50 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 1.25 1.08 0.00 0.00 106 E 8.35 4.67 0.00 1.99 1.73 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 2.12 1.83 0.00 107 A 8.07 4.34 1.25 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 0.00 0.00 108 A 9.00 4.47 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 0.00 109 K 7.73 4.61 0.00 1.72 1.58 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.24 1.00 7.81 110 V 8.99 4.65 1.65 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 0.37 0.00 0.00 0.04 0.00 0.00 111 V 8.62 4.71 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 0.96 0.00 0.00 0.90 0.00 0.00 112 A 9.41 5.21 1.17 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 0.00 0.00 113 R 9.28 5.26 0.00 1.83 1.93 0.00 3.05 0.00 0.00 3.22 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 114 A 9.17 5.16 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 0.00 115 Y 8.01 4.71 0.00 2.04 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 0.00 0.00 0.00 0.00 116 C 8.25 4.62 0.00 2.85 2.66 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 0.00 0.00 0.00 117 N 8.47 4.49 0.00 2.95 2.81 0.00 0.00 6.56 7.80 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 0.00 118 I 7.65 3.90 1.66 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 1.40 0.75 0.65 0.00 0.00 119 H 8.07 4.68 0.00 3.12 3.35 0.00 5.94 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 0.00 120 G 7.49 3.45 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 0.00 0.00 0.00 0.00 121 H 8.30 5.36 0.00 3.33 3.22 0.00 5.64 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 W 9.18 5.61 0.00 3.27 3.08 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 0.00 123 K 9.20 5.28 0.00 1.80 1.68 0.00 1.57 0.00 0.00 1.84 0.00 0.00 2.69 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.39 7.81 124 A 9.31 4.89 1.23 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 0.00 0.00 0.00 125 E 8.43 5.04 0.00 1.95 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 2.15 2.28 0.00 126 N 8.34 4.51 0.00 2.90 2.83 0.00 0.00 6.78 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