NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8758 8.3549 109.7335 44.8745 0.0000 171.6237 2 S 3.8922 8.2574 119.9280 57.1889 63.3330 172.3953 3 S 4.6392 8.4610 120.7523 57.3560 65.5763 172.4269 4 G 4.2058 9.0544 116.3305 46.1981 0.0000 173.9835 5 S 4.4494 7.7158 113.7590 56.7751 63.3069 172.7905 6 S 4.7360 8.4685 120.6444 56.2443 65.3092 173.3592 7 G 4.1219 8.5303 111.1714 42.6404 0.0000 172.8290 8 S 4.2464 8.8920 120.7643 60.2514 63.6652 174.7640 9 R 4.5037 7.6131 119.9609 53.9610 32.5700 173.5902 10 E 4.6232 8.4964 124.3695 54.4082 31.3707 175.5903 11 I 3.6472 8.0915 123.1267 61.5662 37.7102 175.7118 12 D 4.3300 8.3319 124.5398 53.1586 40.0306 176.2941 13 Y 4.6746 7.7664 125.8721 60.7564 38.3173 177.6271 14 T 2.4800 7.6722 107.4621 61.2263 68.8097 174.8171 15 A 4.1355 7.0520 125.2785 53.2182 19.9498 177.7092 16 Y 4.1025 6.8063 113.5293 56.2938 38.6147 175.0742 17 P 4.3021 0.0000 0.0000 65.3750 32.0669 177.2262 18 W 4.6582 7.4136 114.5753 56.4254 28.1227 174.7541 19 F 4.9578 7.7918 121.7757 57.6204 39.7607 174.5880 20 A 3.5934 7.9280 129.9520 52.3121 21.4577 177.0586 21 G 3.6867 6.9824 103.3402 45.5466 0.0000 174.8795 22 N 4.8323 8.2886 115.7910 52.0670 36.8421 174.0809 23 M 4.2553 7.3348 115.6186 55.5996 33.1221 175.8261 24 E 4.3449 8.2654 118.3392 55.5389 30.5966 176.6773 25 R 3.7526 8.6713 124.3029 60.0386 30.2268 177.4174 26 Q 3.9333 8.1514 118.1674 59.6940 28.9035 178.8419 27 Q 4.0222 8.1543 120.0926 59.2981 28.9940 178.4955 28 T 3.8789 8.1578 117.2646 66.7301 68.7677 175.9994 29 D 4.6109 8.1068 118.1803 56.1912 41.1178 177.2531 30 N 4.5463 7.7297 115.8493 55.7358 39.0743 176.6525 31 L 4.2384 8.2553 121.3624 58.2162 41.0046 179.1811 32 L 3.9679 8.4877 120.4574 57.4889 41.4718 179.1621 33 K 3.8627 7.3629 116.6363 60.6333 32.2422 178.3852 34 S 4.2179 7.4149 112.9893 61.0196 62.6293 174.3401 35 H 4.3633 7.9045 117.1083 55.3667 30.4850 173.9827 36 A 4.4706 8.2340 124.6351 51.9402 19.6032 176.7534 37 S 4.7556 7.8940 112.1736 58.4220 63.1655 176.2738 38 G 4.3750 8.0703 102.7554 47.5323 0.0000 172.9374 39 T 5.2139 8.3090 118.9179 62.7584 69.3853 173.5121 40 Y 5.4566 9.2011 125.2628 55.4525 41.6404 174.4363 41 L 4.6702 8.6275 118.3826 55.1150 44.6070 173.7364 42 I 5.0815 8.5516 120.9705 59.6898 40.0183 175.1136 43 R 4.9635 8.8046 123.3261 54.3571 32.7802 174.2932 44 E 5.0233 8.6746 120.4243 54.6177 32.1223 175.1260 45 R 4.7243 8.1267 121.9542 53.5422 34.2321 173.9974 46 P 4.7042 0.0000 0.0000 62.1182 29.2347 174.8477 47 A 4.5155 7.4434 126.2985 51.7068 22.1252 176.4277 48 E 3.9445 8.8426 122.5492 59.4443 29.8459 178.2988 49 A 3.9673 7.8642 121.2574 54.7122 18.7665 177.3322 50 E 4.9494 7.8109 122.0830 54.6518 28.7646 176.2828 51 R 4.7204 7.9313 126.0937 54.1256 30.9903 175.0909 52 F 5.2988 7.8433 111.4447 56.5291 43.6580 173.0376 53 A 5.1760 9.5613 122.5197 51.1735 23.5864 175.2326 54 I 5.0079 8.7640 119.1041 59.7490 41.5696 174.5954 55 S 5.6470 9.2373 121.9298 55.6044 64.7735 172.6677 56 I 5.1565 8.1231 126.7204 59.3086 41.0878 174.4713 57 K 4.5253 9.3131 128.9341 55.9407 32.7414 175.5772 58 F 4.7378 8.4655 129.2537 57.8001 42.8126 173.3398 59 N 3.6792 7.8772 124.5045 56.3781 36.3718 173.4373 60 D 4.2926 8.1469 109.9770 54.4353 39.0204 174.1309 61 E 4.5026 7.6724 115.8806 54.9574 33.5707 174.7229 62 V 4.1030 8.4529 124.5821 62.5380 32.0759 175.1652 63 K 4.5154 8.4316 127.9831 55.5130 34.1477 175.7128 64 H 4.9961 8.6892 120.6203 54.2880 31.1178 173.2632 65 I 4.5224 8.9516 125.2673 59.6165 39.5039 174.9801 66 K 4.9645 8.6103 123.8046 55.3577 34.7842 175.4198 67 V 4.4802 8.7554 122.8089 61.2852 34.1942 174.2813 68 V 4.4705 9.0281 127.6995 61.0840 33.8321 173.7343 69 E 5.4864 8.4659 128.0507 53.7924 30.7581 174.8532 70 K 4.5787 8.1039 127.0455 55.6552 35.6311 175.2054 71 D 4.2555 9.2433 120.9539 55.6531 38.2644 173.4718 72 N 3.9413 8.0070 110.3638 53.8647 36.3335 174.2243 73 W 5.5106 7.7373 116.2320 55.0199 32.7431 174.4356 74 I 5.2716 8.3313 119.4442 60.1508 40.4169 174.6322 75 H 4.9831 8.8228 121.5635 54.9308 32.6387 172.1221 76 I 4.7605 8.1129 110.9220 60.0848 40.6435 175.3228 77 T 3.1675 9.3705 117.2978 63.0415 66.1911 171.4235 78 E 3.6802 8.1090 115.0893 56.8732 27.9353 174.6402 79 A 4.4513 7.6642 121.1043 52.7662 21.1816 177.8573 80 K 3.9669 7.3392 114.7687 55.1509 34.9697 174.9809 81 K 4.1064 7.8402 125.7067 56.2445 33.4859 176.2044 82 F 4.9429 8.1963 117.2314 55.7158 43.0869 175.2512 83 D 4.4720 8.7412 124.2646 57.8913 41.2920 176.9357 84 S 4.7045 7.8733 112.2279 56.3310 67.6858 176.6025 85 L 3.6335 8.1229 123.8057 58.5637 41.2676 178.2414 86 L 3.7657 7.9821 119.3726 58.4661 41.7881 178.5799 87 E 3.7184 8.0852 117.3953 59.4349 29.3303 178.7922 88 L 2.4400 7.3217 120.0183 57.7600 41.8997 179.3931 89 V 3.3162 7.3858 117.8492 66.0421 31.3066 177.9447 90 E 4.4261 7.6547 118.2038 58.5990 29.4511 178.7660 91 Y 3.7026 7.5237 119.8773 60.8918 38.4460 177.5608 92 Y 5.0428 7.1097 118.7290 60.2987 38.0412 177.8380 93 Q 3.7174 8.1433 119.6275 58.3286 28.4511 178.3975 94 C 4.4539 7.2561 114.5567 59.9260 30.9477 173.8829 95 H 4.7334 7.4683 117.3295 53.5747 29.5837 174.7429 96 S 4.4860 8.5776 118.8610 58.9296 62.7374 173.5391 97 L 4.2552 8.3783 124.1471 54.5859 41.3886 179.2346 98 K 4.7306 7.6896 119.9743 59.5075 32.7746 178.0488 99 E 4.1054 8.5051 118.4446 59.2994 29.5457 178.5342 100 S 3.9054 7.9478 111.0234 60.0679 63.6139 173.9529 101 F 4.6951 8.1935 121.7818 54.5644 40.3632 175.2194 102 K 3.9212 8.9683 125.1057 60.0984 32.1791 178.4491 103 Q 4.0427 8.2927 117.2283 57.7712 28.9667 176.6512 104 L 4.1855 8.1749 120.9953 53.5197 43.5536 175.1455 105 D 4.5603 7.0621 125.9288 52.7267 42.7090 173.7988 106 T 4.4258 7.3640 118.4690 61.3486 71.1583 171.2614 107 T 4.8132 8.0953 113.5328 59.3538 71.6333 172.6479 108 L 3.2592 8.2261 125.6262 54.7073 40.2283 176.6157 109 K 3.9205 7.8298 123.1109 56.0697 33.3887 176.2552 110 Y 4.9569 8.3414 116.5745 55.4553 40.7626 174.8014 111 P 4.3165 0.0000 0.0000 61.6295 32.6188 174.6359 112 Y 4.4233 8.4046 116.5683 56.2340 39.7479 175.0490 113 S 3.9908 8.6995 113.8950 61.1737 62.5657 175.8535 114 G 3.4182 5.3800 104.4349 44.6318 0.0000 171.8101 115 P 4.3565 0.0000 0.0000 62.4961 29.8484 175.7017 116 S 4.4138 8.2872 120.0559 57.5567 62.5515 173.7654 117 S 4.6087 8.2408 122.3097 57.2933 64.3066 174.9962 118 G 3.9856 9.0036 113.0210 45.8944 0.0000 173.5162 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 G 8.35 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 2 S 8.26 3.89 0.00 3.89 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 3 S 8.46 4.64 0.00 3.95 3.84 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 4 G 9.05 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 0.00 0.00 0.00 0.00 5 S 7.72 4.45 0.00 3.76 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 6 S 8.47 4.74 0.00 3.81 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 7 G 8.53 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 8 S 8.89 4.25 0.00 4.00 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 9 R 7.61 4.50 0.00 1.72 1.79 0.00 3.37 0.00 0.00 3.19 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.56 0.00 10 E 8.50 4.62 0.00 2.07 1.77 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 2.36 2.40 0.00 11 I 8.09 3.65 1.93 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.53 1.15 0.00 0.00 12 D 8.33 4.33 0.00 2.59 2.39 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 0.00 0.00 0.00 0.00 13 Y 7.77 4.67 0.00 3.34 3.26 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 14 T 7.67 2.48 3.29 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 0.80 0.00 0.00 15 A 7.05 4.14 1.04 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 16 Y 6.81 4.10 0.00 1.43 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 17 P 0.00 4.30 0.00 2.23 2.20 0.00 3.64 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 2.12 2.04 0.00 18 W 7.41 4.66 0.00 3.31 3.04 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 19 F 7.79 4.96 0.00 2.95 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 20 A 7.93 3.59 0.74 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 0.00 0.00 21 G 6.98 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 22 N 8.29 4.83 0.00 2.81 2.89 0.00 0.00 5.92 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 23 M 7.33 4.26 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.50 0.00 24 E 8.27 4.34 0.00 1.92 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 25 R 8.67 3.75 0.00 1.84 1.91 0.00 3.09 0.00 0.00 3.20 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 26 Q 8.15 3.93 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.67 0.00 0.00 0.00 0.00 0.00 2.44 2.68 0.00 27 Q 8.15 4.02 0.00 2.18 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.64 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 28 T 8.16 3.88 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 1.24 0.00 0.00 29 D 8.11 4.61 0.00 2.75 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 30 N 7.73 4.55 0.00 2.93 2.85 0.00 0.00 6.97 7.34 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 31 L 8.26 4.24 0.00 1.91 2.00 1.13 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 32 L 8.49 3.97 0.00 1.84 1.81 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 33 K 7.36 3.86 0.00 2.04 2.24 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.56 1.49 7.81 34 S 7.41 4.22 0.00 3.84 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 35 H 7.90 4.36 0.00 3.46 3.31 0.00 5.70 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 A 8.23 4.47 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 37 S 7.89 4.76 0.00 3.90 3.84 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 38 G 8.07 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 0.00 0.00 0.00 0.00 39 T 8.31 5.21 4.34 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 1.21 0.00 0.00 40 Y 9.20 5.46 0.00 2.93 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 41 L 8.63 4.67 0.00 1.68 1.80 0.79 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 42 I 8.55 5.08 2.27 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.81 1.13 0.00 0.00 43 R 8.80 4.96 0.00 1.94 1.93 0.00 2.73 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 44 E 8.67 5.02 0.00 2.04 1.86 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 2.13 2.09 0.00 45 R 8.13 4.72 0.00 1.72 1.75 0.00 3.37 0.00 0.00 3.40 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.56 0.00 46 P 0.00 4.70 0.00 2.16 2.08 0.00 3.79 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 47 A 7.44 4.52 1.29 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 48 E 8.84 3.94 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 2.28 2.36 0.00 49 A 7.86 3.97 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 50 E 7.81 4.95 0.00 1.96 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 2.30 2.54 0.00 51 R 7.93 4.72 0.00 1.73 1.56 0.00 2.97 0.00 0.00 2.25 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.40 0.00 52 F 7.84 5.30 0.00 3.04 2.79 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 53 A 9.56 5.18 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 54 I 8.76 5.01 1.89 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.68 0.95 0.00 0.00 55 S 9.24 5.65 0.00 3.69 3.59 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 0.00 0.00 0.00 56 I 8.12 5.16 1.88 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.81 1.09 0.00 0.00 57 K 9.31 4.53 0.00 1.93 1.89 0.00 1.55 0.00 0.00 1.61 0.00 0.00 3.05 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.66 1.51 7.81 58 F 8.47 4.74 0.00 3.00 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 59 N 7.88 3.68 0.00 2.64 2.82 0.00 0.00 7.55 8.48 0.00 0.00 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 D 8.15 4.29 0.00 2.74 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 61 E 7.67 4.50 0.00 2.04 1.81 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 2.23 2.41 0.00 62 V 8.45 4.10 2.39 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 0.72 0.00 0.00 1.02 0.00 0.00 63 K 8.43 4.52 0.00 1.73 1.53 0.00 1.59 0.00 0.00 1.76 0.00 0.00 3.19 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.38 7.81 64 H 8.69 5.00 0.00 2.95 3.20 0.00 5.68 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 65 I 8.95 4.52 1.97 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.74 1.08 0.00 0.00 66 K 8.61 4.96 0.00 1.77 1.83 0.00 1.51 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.55 7.81 67 V 8.76 4.48 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 1.04 0.00 0.00 68 V 9.03 4.47 2.13 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 0.88 0.00 0.00 1.00 0.00 0.00 69 E 8.47 5.49 0.00 2.17 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 2.53 2.36 0.00 70 K 8.10 4.58 0.00 1.80 1.66 0.00 1.95 0.00 0.00 1.87 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.46 7.81 71 D 9.24 4.26 0.00 2.97 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 72 N 8.01 3.94 0.00 1.69 2.11 0.00 0.00 6.78 7.55 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 73 W 7.74 5.51 0.00 3.50 2.98 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 74 I 8.33 5.27 2.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.44 0.94 0.00 0.00 75 H 8.82 4.98 0.00 3.27 3.44 0.00 5.40 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 I 8.11 4.76 2.03 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.86 1.09 0.00 0.00 77 T 9.37 3.17 4.27 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 1.09 0.00 0.00 78 E 8.11 3.68 0.00 2.07 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 2.13 2.24 0.00 79 A 7.66 4.45 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 80 K 7.34 3.97 0.00 1.37 1.02 0.00 0.61 0.00 0.00 0.78 0.00 0.00 2.46 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.87 0.69 7.81 81 K 7.84 4.11 0.00 1.56 1.46 0.00 1.11 0.00 0.00 1.27 0.00 0.00 2.62 0.00 0.00 2.47 0.00 0.00 0.00 0.00 1.05 1.11 7.81 82 F 8.20 4.94 0.00 3.23 2.75 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 0.00 0.00 0.00 83 D 8.74 4.47 0.00 2.70 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 84 S 7.87 4.70 0.00 3.99 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 85 L 8.12 3.63 0.00 1.02 0.66 0.59 -0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 86 L 7.98 3.77 0.00 2.06 1.79 0.92 1.18 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 87 E 8.09 3.72 0.00 2.19 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 2.40 2.37 0.00 88 L 7.32 2.44 0.00 1.68 1.68 1.10 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 89 V 7.39 3.32 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 0.31 0.00 0.00 0.45 0.00 0.00 90 E 7.65 4.43 0.00 1.88 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 2.35 2.19 0.00 91 Y 7.52 3.70 0.00 2.23 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 0.00 0.00 0.00 92 Y 7.11 5.04 0.00 2.86 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 93 Q 8.14 3.72 0.00 1.91 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.32 0.00 0.00 0.00 0.00 0.00 1.92 2.12 0.00 94 C 7.26 4.45 0.00 2.56 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 95 H 7.47 4.73 0.00 2.99 3.00 0.00 5.66 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 S 8.58 4.49 0.00 3.77 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 97 L 8.38 4.26 0.00 1.52 1.50 0.68 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.69 4.73 0.00 1.88 2.07 0.00 1.63 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.37 7.81 99 E 8.51 4.11 0.00 2.11 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 2.39 2.43 0.00 100 S 7.95 3.91 0.00 3.09 3.78 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 0.00 101 F 8.19 4.70 0.00 2.94 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 K 8.97 3.92 0.00 1.87 1.98 0.00 1.62 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.54 7.81 103 Q 8.29 4.04 0.00 2.13 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.86 0.00 0.00 0.00 0.00 0.00 2.43 2.37 0.00 104 L 8.17 4.19 0.00 1.67 1.53 0.93 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 105 D 7.06 4.56 0.00 2.60 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 0.00 106 T 7.36 4.43 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 0.92 0.00 0.00 107 T 8.10 4.81 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 108 L 8.23 3.26 0.00 0.68 0.13 0.35 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 109 K 7.83 3.92 0.00 1.80 0.74 0.00 1.71 0.00 0.00 1.68 0.00 0.00 3.19 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.07 1.43 7.81 110 Y 8.34 4.96 0.00 3.01 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 0.00 111 P 0.00 4.32 0.00 2.22 2.20 0.00 3.58 0.00 0.00 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 112 Y 8.40 4.42 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 0.00 113 S 8.70 3.99 0.00 3.91 3.89 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 0.00 114 G 5.38 3.42 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 0.00 0.00 0.00 115 P 0.00 4.36 0.00 2.24 2.26 0.00 3.72 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.05 0.00 116 S 8.29 4.41 0.00 3.98 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 0.00 117 S 8.24 4.61 0.00 3.87 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 0.00 118 G 9.00 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 0.00 0.00 0.00