NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.3035 8.3144 122.1422 53.9498 33.4759 175.0686 2 E 3.9794 8.5685 123.3342 53.9767 30.2951 175.8539 3 T 4.2040 8.7286 118.3700 61.2985 72.1357 174.9778 4 A 3.9988 8.5413 123.6411 55.2803 18.4302 180.0137 5 A 4.1329 8.0130 118.6065 55.3718 18.4993 179.5591 6 A 4.0121 8.0650 119.3593 55.0848 18.3502 179.7497 7 K 4.0043 8.4854 118.5849 59.6096 32.3013 178.7506 8 F 4.0602 8.4288 120.8995 61.3869 39.4515 176.8976 9 E 4.0332 8.4193 118.2051 59.4861 29.0606 179.3899 10 R 3.9001 8.0215 117.7247 59.5159 30.2660 178.1922 11 Q 4.0449 7.9855 116.4591 57.8871 29.1131 176.1589 12 H 4.6598 7.8484 113.3810 53.5680 31.6703 172.8008 13 M 4.8105 7.9033 118.4296 53.6539 33.7795 176.3458 14 D 4.7690 9.0196 122.9413 52.9614 41.4831 175.7022 15 S 4.3710 8.4977 117.9716 60.4034 63.6977 176.0629 16 S 4.2741 7.8138 115.2455 60.5502 62.7447 174.5603 17 T 4.6119 7.7420 110.8759 60.3398 70.8504 174.9808 18 S 4.2843 8.4925 118.9430 60.1172 62.8686 173.5500 19 A 4.2924 7.2021 118.6676 50.8101 21.7125 174.4769 20 A 3.2005 8.3898 123.5735 53.2604 18.1878 178.3082 21 S 4.1560 8.2317 121.8776 61.8303 62.7515 171.9219 22 S 4.6974 7.5277 114.4451 56.6878 65.7843 176.8399 23 S 4.2492 8.8111 113.7014 63.5854 62.8650 175.7625 24 N 4.6237 8.1302 116.4997 53.2387 38.1881 179.9358 25 Y 4.1476 7.9106 118.0766 62.2603 38.6044 177.7848 26 C 4.1582 8.4478 116.8774 59.9795 38.5768 175.7679 27 N 4.4030 8.2349 117.5984 56.4698 38.1630 177.1038 28 Q 3.9247 7.8524 120.4089 59.5478 29.2304 178.1152 29 M 3.7968 7.6933 121.3279 57.8543 31.8004 178.7267 30 M 4.0537 8.0631 119.2136 57.9502 32.0147 178.7658 31 K 3.9386 7.6038 119.0750 59.6629 32.2261 179.2296 32 S 4.1955 8.1318 114.4247 60.9599 62.6479 175.4384 33 R 4.3494 7.6692 119.4997 55.3110 29.9696 175.8354 34 N 4.2659 7.8823 114.8512 54.7023 36.3618 174.8903 35 L 4.5110 8.0508 116.6580 55.0828 42.2131 177.8956 36 T 5.6046 7.5596 106.6861 60.2953 69.4963 174.8544 37 K 4.1633 8.4470 124.4121 59.7222 32.2562 177.3154 38 D 4.7562 7.8025 114.9493 53.6124 42.1433 175.8191 39 R 3.5721 7.0668 115.2581 55.7221 30.8110 173.9801 40 C 4.6955 8.7013 116.3044 55.7737 39.8002 173.9601 41 K 4.1019 8.3523 127.7705 56.0335 32.3493 175.0031 42 P 4.5934 0.0000 0.0000 65.4628 32.5277 176.4098 43 V 5.0970 7.5958 117.5948 61.3221 34.9456 173.9766 44 N 4.7987 9.0271 123.6175 52.7304 42.4869 172.9159 45 T 4.8241 7.9435 120.9286 61.6548 71.7589 172.8491 46 F 4.8816 8.8847 124.5905 55.6634 42.0761 174.6555 47 V 4.5325 8.7881 123.0833 61.1827 33.4274 175.5603 48 H 5.7272 8.6568 128.3325 53.6889 26.2573 173.4810 49 E 4.7904 7.7142 118.2141 53.3473 34.6291 176.3644 50 S 4.4016 8.3630 115.0521 58.1078 65.1620 174.8896 51 L 4.0072 8.5433 124.1409 58.4630 41.8376 179.1477 52 A 4.0791 8.0016 120.1422 55.3672 18.1373 179.2224 53 D 4.3567 7.8206 116.0567 57.3369 41.1681 178.8754 54 V 3.8188 7.8049 118.4296 66.0402 31.6621 178.0916 55 Q 3.9315 8.6892 117.9559 58.9038 28.5336 178.7436 56 A 4.0746 8.1120 121.4920 54.6610 18.3354 179.6788 57 V 3.5849 7.6340 116.9215 65.8601 31.3293 176.9808 58 C 3.8442 7.8528 115.0627 58.0579 39.8878 174.1494 59 S 4.6791 7.6336 114.2407 57.9403 63.6944 174.9095 60 Q 4.5855 7.5221 121.9880 56.1138 27.9954 176.3600 61 K 4.2122 7.7486 127.3369 56.8551 33.1017 176.2299 62 N 4.5966 8.8089 127.4053 53.6378 39.4053 174.3605 63 V 4.5882 8.1965 118.4446 59.0539 36.0579 175.3897 64 A 4.0274 8.4158 125.4102 52.3543 19.0806 178.5717 65 C 4.6896 8.7103 119.6558 56.0428 41.2000 175.2235 66 K 3.6851 8.9413 122.4155 59.5177 31.6791 177.9216 67 N 4.5565 8.0983 113.2890 52.7166 37.6097 175.8953 68 G 3.9226 8.1603 108.3640 45.5882 0.0000 174.1399 69 Q 4.2364 8.3907 119.3131 56.2027 29.3205 176.3527 70 T 4.6848 8.3069 107.6759 61.6664 69.0614 174.1655 71 N 5.0474 7.8652 118.5215 53.7053 38.5051 174.6708 72 C 5.3427 7.7826 115.6547 56.6383 44.8679 172.5930 73 Y 5.0485 8.6555 118.2674 56.4249 42.4393 173.7950 74 Q 5.0818 8.9799 125.4185 54.0046 31.3854 174.9114 75 S 4.5062 8.5748 121.6922 58.7164 63.2242 174.3031 76 Y 4.3399 8.8600 121.0443 60.8711 37.9900 176.5821 77 S 4.9446 7.8881 114.0998 57.2720 64.6257 174.6422 78 T 4.2053 8.3180 112.0095 62.1831 69.7143 173.4913 79 M 5.0529 8.9933 121.9283 53.4231 36.8889 174.6652 80 S 4.9192 9.4049 117.6193 58.2497 63.5073 173.0733 81 I 5.1096 9.0326 120.4551 59.4307 41.6080 174.2802 82 T 5.0071 8.9207 119.7927 62.0037 71.6810 172.8563 83 D 5.0269 9.1024 127.2539 53.6815 42.8371 174.7955 84 C 5.6120 9.5904 123.4432 55.8901 41.9155 173.8283 85 R 5.3519 8.8186 123.0918 54.6920 33.1902 171.2193 86 E 4.0793 9.0986 126.0428 55.7269 30.3626 176.8788 87 T 4.2794 8.1326 117.5813 60.6472 70.7172 175.0417 88 G 3.6839 8.6824 109.8605 48.7696 0.0000 175.5461 89 S 4.1007 7.9774 113.4256 60.0919 62.9985 174.2527 90 S 4.1227 7.7902 118.5268 58.8864 62.3232 173.6521 91 K 4.7014 8.5837 128.7425 52.4622 34.7888 171.6232 92 Y 4.4356 8.7979 125.9647 56.6647 39.0888 173.8822 93 P 3.4977 0.0000 0.0000 62.6800 32.1408 176.8103 94 N 4.6554 8.1004 120.1373 52.3397 36.9620 173.1663 95 C 4.6440 8.1264 116.2558 55.9558 42.9070 173.3038 96 A 5.1195 7.9180 124.2988 50.4244 22.2613 174.3339 97 Y 5.1629 9.5899 120.6829 56.7604 42.3799 175.9103 98 K 4.4821 9.2530 126.9521 54.9635 33.6351 174.9351 99 T 5.0404 8.5613 121.1828 61.7475 70.0866 174.1207 100 T 4.6728 8.9696 125.9034 62.3866 71.5933 173.8885 101 Q 4.9964 8.7276 126.1992 54.6296 29.8815 171.6646 102 A 4.7010 8.9761 123.4197 50.2980 23.6865 174.9258 103 N 5.3540 8.7190 116.0745 51.7359 40.7129 174.2692 104 K 4.7557 8.8818 122.4387 54.6964 37.5504 175.6206 105 H 4.8337 9.3098 119.4639 55.7935 30.0068 175.0241 106 I 4.7556 8.5388 115.3827 59.3486 40.8761 174.4287 107 I 4.8972 8.0933 123.6988 59.7023 40.3211 175.0864 108 V 4.7361 8.6044 119.5768 59.3182 35.6351 174.4754 109 A 5.0615 8.7494 124.9493 51.0417 20.7349 175.7237 110 C 5.1687 8.7633 118.5894 55.4065 39.8643 173.3211 111 E 4.7489 8.5516 119.1703 56.2245 33.9497 174.6090 112 G 4.0000 9.4392 107.3648 44.8377 0.0000 172.1914 113 N 4.9869 8.2467 116.1810 50.6188 40.3705 172.1043 114 P 4.3877 0.0000 0.0000 62.6523 32.1473 175.5073 115 Y 4.8255 8.2741 121.2102 56.6700 38.9860 174.7278 116 V 4.4668 8.1552 119.4936 58.5283 36.6652 173.4800 117 P 4.4504 0.0000 0.0000 62.9273 31.0731 176.7865 118 V 4.4683 8.4680 115.8690 61.3452 34.0373 175.3070 119 H 5.0886 7.8822 119.5905 54.7801 33.5177 171.5865 120 F 4.7190 8.7699 127.6151 57.2716 39.6536 174.4180 121 D 4.5643 8.3794 126.8398 56.1764 41.9385 175.7997 122 A 4.6189 6.5529 117.1497 51.3721 22.4863 174.8673 123 S 5.1265 8.7518 113.0082 56.7764 66.4081 174.6388 124 V 4.1463 8.8030 114.5705 61.7851 32.6960 175.1963 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 4.30 0.00 1.79 1.67 0.00 1.78 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 8.57 3.98 0.00 2.01 1.90 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 2.31 2.38 0.00 3 T 8.73 4.20 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 1.23 0.00 0.00 4 A 8.54 4.00 1.36 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 0.00 0.00 0.00 5 A 8.01 4.13 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 6 A 8.06 4.01 1.36 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 0.00 0.00 0.00 7 K 8.49 4.00 0.00 1.94 2.05 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.46 7.81 8 F 8.43 4.06 0.00 3.29 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 9 E 8.42 4.03 0.00 2.28 2.05 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 2.52 2.71 0.00 10 R 8.02 3.90 0.00 1.80 2.10 0.00 3.37 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 1.67 0.00 11 Q 7.99 4.04 0.00 1.70 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.48 0.00 0.00 0.00 0.00 0.00 2.25 2.45 0.00 12 H 7.85 4.66 0.00 1.91 2.57 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 7.90 4.81 0.00 1.98 2.16 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.67 0.00 14 D 9.02 4.77 0.00 2.73 2.59 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 15 S 8.50 4.37 0.00 3.93 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 16 S 7.81 4.27 0.00 4.06 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 17 T 7.74 4.61 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 1.23 0.00 0.00 18 S 8.49 4.28 0.00 3.65 3.81 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 0.00 0.00 0.00 19 A 7.20 4.29 1.11 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 0.00 0.00 20 A 8.39 3.20 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.23 4.16 0.00 3.64 3.81 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 0.00 0.00 0.00 22 S 7.53 4.70 0.00 3.60 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 23 S 8.81 4.25 0.00 4.00 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 24 N 8.13 4.62 0.00 2.67 2.85 0.00 0.00 6.52 7.57 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 25 Y 7.91 4.15 0.00 3.12 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 26 C 8.45 4.16 0.00 3.16 3.12 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 27 N 8.23 4.40 0.00 2.91 2.93 0.00 0.00 6.76 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 28 Q 7.85 3.92 0.00 2.03 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.26 2.46 0.00 29 M 7.69 3.80 0.00 0.87 1.18 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.56 0.00 30 M 8.06 4.05 0.00 1.73 1.90 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 2.41 0.00 31 K 7.60 3.94 0.00 2.05 1.91 0.00 1.62 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.44 7.81 32 S 8.13 4.20 0.00 4.02 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 7.67 4.35 0.00 1.93 2.13 0.00 3.60 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.91 0.00 34 N 7.88 4.27 0.00 2.88 2.94 0.00 0.00 6.84 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 35 L 8.05 4.51 0.00 1.81 1.63 0.82 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.56 5.60 4.41 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 1.42 0.00 0.00 37 K 8.45 4.16 0.00 1.78 1.92 0.00 1.77 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.48 1.50 7.81 38 D 7.80 4.76 0.00 2.67 2.63 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 39 R 7.07 3.57 0.00 1.77 1.78 0.00 2.89 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 1.38 1.42 0.00 40 C 8.70 4.70 0.00 3.10 3.14 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 41 K 8.35 4.10 0.00 1.77 1.78 0.00 1.76 0.00 0.00 1.66 0.00 0.00 3.25 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.61 1.40 7.81 42 P 0.00 4.59 0.00 2.19 2.32 0.00 3.74 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 2.10 1.98 0.00 43 V 7.60 5.10 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 0.84 0.00 0.00 0.97 0.00 0.00 44 N 9.03 4.80 0.00 2.64 2.25 0.00 0.00 6.95 6.84 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 45 T 7.94 4.82 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 0.82 0.00 0.00 46 F 8.88 4.88 0.00 2.99 2.88 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 47 V 8.79 4.53 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 1.06 0.00 0.00 1.03 0.00 0.00 48 H 8.66 5.73 0.00 3.10 3.47 0.00 5.63 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.71 4.79 0.00 1.95 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 2.26 2.28 0.00 50 S 8.36 4.40 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 8.54 4.01 0.00 1.83 1.75 1.02 1.11 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 52 A 8.00 4.08 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 53 D 7.82 4.36 0.00 2.86 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 54 V 7.80 3.82 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 1.25 0.00 0.00 1.11 0.00 0.00 55 Q 8.69 3.93 0.00 2.20 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.34 2.54 0.00 56 A 8.11 4.07 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 0.00 0.00 57 V 7.63 3.58 2.15 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 1.01 0.00 0.00 1.02 0.00 0.00 58 C 7.85 3.84 0.00 2.90 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 59 S 7.63 4.68 0.00 3.96 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 60 Q 7.52 4.59 0.00 2.03 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.94 0.00 0.00 0.00 0.00 0.00 2.50 2.44 0.00 61 K 7.75 4.21 0.00 1.54 1.57 0.00 1.70 0.00 0.00 1.52 0.00 0.00 2.75 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.43 7.81 62 N 8.81 4.60 0.00 2.82 2.67 0.00 0.00 7.01 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 8.20 4.59 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 0.68 0.00 0.00 0.78 0.00 0.00 64 A 8.42 4.03 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 8.71 4.69 0.00 3.13 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 66 K 8.94 3.69 0.00 1.87 1.89 0.00 1.82 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.49 7.81 67 N 8.10 4.56 0.00 2.80 2.89 0.00 0.00 6.20 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 8.16 3.92 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 0.00 0.00 0.00 69 Q 8.39 4.24 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.28 0.00 70 T 8.31 4.68 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 1.18 0.00 0.00 71 N 7.87 5.05 0.00 3.09 3.16 0.00 0.00 6.03 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 7.78 5.34 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 73 Y 8.66 5.05 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 74 Q 8.98 5.08 0.00 1.96 1.80 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 2.17 2.21 0.00 75 S 8.57 4.51 0.00 3.94 3.85 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 76 Y 8.86 4.34 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 77 S 7.89 4.94 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 8.32 4.21 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 1.02 0.00 0.00 79 M 8.99 5.05 0.00 1.94 1.99 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.49 0.00 80 S 9.40 4.92 0.00 3.91 3.96 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 0.00 0.00 0.00 81 I 9.03 5.11 1.85 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 1.27 0.57 0.98 0.00 0.00 82 T 8.92 5.01 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 1.30 0.00 0.00 83 D 9.10 5.03 0.00 2.62 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 84 C 9.59 5.61 0.00 2.77 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 8.82 5.35 0.00 1.48 1.73 0.00 3.27 0.00 0.00 3.09 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.41 0.00 86 E 9.10 4.08 0.00 2.12 1.80 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 2.07 1.68 0.00 87 T 8.13 4.28 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 1.20 0.00 0.00 88 G 8.68 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 89 S 7.98 4.10 0.00 3.97 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 90 S 7.79 4.12 0.00 3.92 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 8.58 4.70 0.00 1.66 1.60 0.00 1.88 0.00 0.00 1.57 0.00 0.00 2.78 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.26 1.22 7.81 92 Y 8.80 4.44 0.00 2.88 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 93 P 0.00 3.50 0.00 1.79 1.20 0.00 3.66 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.00 94 N 8.10 4.66 0.00 2.89 2.76 0.00 0.00 7.03 7.38 0.00 0.00 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 8.13 4.64 0.00 3.12 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 96 A 7.92 5.12 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 9.59 5.16 0.00 2.89 2.88 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 98 K 9.25 4.48 0.00 1.42 1.68 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.78 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.34 1.29 7.81 99 T 8.56 5.04 4.32 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 1.29 0.00 0.00 100 T 8.97 4.67 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 1.23 0.00 0.00 101 Q 8.73 5.00 0.00 1.83 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.78 0.00 0.00 0.00 0.00 0.00 2.22 1.92 0.00 102 A 8.98 4.70 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 0.00 103 N 8.72 5.35 0.00 2.56 2.75 0.00 0.00 6.68 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 8.88 4.76 0.00 1.70 1.83 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.43 7.81 105 H 9.31 4.83 0.00 3.15 3.20 0.00 5.58 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.54 4.76 1.89 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.82 1.14 0.00 0.00 107 I 8.09 4.90 1.73 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 1.11 0.69 0.76 0.00 0.00 108 V 8.60 4.74 1.93 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 0.71 0.00 0.00 0.82 0.00 0.00 109 A 8.75 5.06 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 8.76 5.17 0.00 1.81 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 0.00 0.00 0.00 111 E 8.55 4.75 0.00 1.84 1.80 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 2.26 2.22 0.00 112 G 9.44 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 0.00 0.00 0.00 113 N 8.25 4.99 0.00 2.64 2.71 0.00 0.00 6.96 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 4.39 0.00 2.21 2.06 0.00 3.56 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 2.08 0.00 115 Y 8.27 4.83 0.00 2.82 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 0.00 116 V 8.16 4.47 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 0.67 0.00 0.00 0.91 0.00 0.00 117 P 0.00 4.45 0.00 0.49 1.10 0.00 3.37 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.79 0.00 118 V 8.47 4.47 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 0.58 0.00 0.00 0.95 0.00 0.00 119 H 7.88 5.09 0.00 3.26 3.11 0.00 5.85 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 0.00 120 F 8.77 4.72 0.00 2.83 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 0.00 121 D 8.38 4.56 0.00 2.56 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 6.55 4.62 1.14 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 0.00 0.00 123 S 8.75 5.13 0.00 3.94 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 0.00 124 V 8.80 4.15 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 0.66 0.00 0.00 0.97 0.00 0.00