NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5515 8.3049 120.2779 55.3451 33.3649 174.5940 2 I 4.2527 8.7055 125.5521 58.3401 38.9079 173.4036 3 Q 4.8557 9.5881 121.6246 55.0054 32.1050 174.0257 4 P 3.6915 0.0000 0.0000 65.2100 32.2098 176.6018 5 Q 4.2803 7.7823 120.0772 57.0010 29.7798 176.4116 6 T 4.1407 8.4177 115.9161 64.8700 69.4259 173.0338 7 Y 4.7416 8.8350 124.2949 57.5715 39.1723 174.8418 8 L 5.0119 8.9648 123.4929 52.7823 45.3881 175.6226 9 E 4.4014 9.3099 123.5915 55.9713 31.2710 175.3491 10 V 4.5487 7.7623 125.4845 61.7540 31.9188 175.7760 11 A 3.9582 8.7269 130.4284 53.4394 19.7289 176.6801 12 D 4.7403 7.5212 114.4345 51.8820 41.8419 175.7694 13 N 4.9891 7.9219 115.5581 53.3526 37.3281 177.0995 14 T 3.7876 8.0300 118.5687 65.7307 68.8478 175.4879 15 G 3.9703 7.9441 109.2615 45.6445 0.0000 174.1380 16 A 4.4738 7.6720 121.2308 52.1780 19.2610 176.7339 17 R 4.5985 8.9815 118.7283 57.0444 33.5059 176.6350 18 K 4.9260 7.8034 117.4502 54.7044 36.8736 175.3837 19 I 4.6460 8.2975 118.0517 59.0317 40.6487 174.2857 20 M 4.3092 7.8785 126.0200 54.7155 33.2031 175.2162 21 C 4.3657 9.2561 127.5793 60.3595 32.0196 173.0424 22 I 4.4818 8.4467 121.8647 62.4755 40.0784 176.3896 23 R 4.5293 7.4911 118.8837 55.1089 33.4757 174.1653 24 V 4.0858 8.4741 126.7825 61.2384 32.3909 175.3059 25 L 4.2524 8.2412 128.7341 54.1206 41.9421 175.1645 26 K 4.1386 8.4277 132.0979 56.0760 36.0673 174.1950 27 G 3.9597 8.4489 107.5887 45.1569 0.0000 173.1710 28 S 4.2833 8.5521 112.7838 60.1488 63.1587 174.1209 29 N 4.5010 7.2572 115.2813 51.6011 38.2143 175.0005 30 A 4.1255 8.0178 121.2614 53.2651 19.5503 178.4507 31 K 3.8267 8.5861 122.1542 58.8024 32.5058 176.6545 32 Y 5.2215 7.5165 112.4625 56.1592 42.5648 174.6623 33 A 4.8186 9.1452 121.9088 50.8744 22.3512 175.7082 34 T 4.8036 8.7384 118.3654 59.8497 70.8966 173.3272 35 V 3.7226 8.3761 120.8629 65.0304 31.5749 176.6205 36 G 4.0357 9.0365 115.3460 45.1808 0.0000 172.6351 37 D 4.8952 7.9333 120.3923 53.2485 42.8888 176.0915 38 V 4.8166 8.3800 116.1913 60.5990 33.6039 175.0922 39 I 4.9475 9.1666 118.1009 59.1331 41.3415 174.6653 40 V 4.3802 8.4970 124.1696 63.1825 32.9455 174.6585 41 A 4.8354 8.6517 125.1244 51.1363 23.1470 175.4285 42 S 4.6081 8.3247 116.6173 57.4358 64.3704 173.3194 43 V 4.0190 8.1613 126.7040 62.8590 31.7419 176.3487 44 K 4.4696 8.6852 127.6802 56.8822 33.2770 176.4519 45 E 5.0564 7.8691 115.2452 55.7130 32.1734 174.4090 46 A 5.0462 8.3996 121.9657 50.4463 21.9762 175.8908 47 I 3.8496 9.0293 120.9148 60.2461 39.3778 173.9451 48 P 4.2409 0.0000 0.0000 64.2777 31.7333 176.4486 49 R 3.6265 8.6279 116.5777 56.9467 28.5413 176.6003 50 G 3.8419 7.3461 107.4805 46.1672 0.0000 173.7193 51 A 4.1413 7.9638 121.4348 53.9397 18.5894 178.4660 52 V 4.3700 7.4732 114.1216 61.0462 34.4036 174.9812 53 K 4.5100 8.9543 126.3263 54.3042 34.0673 175.7391 54 E 4.1246 8.3683 119.6125 58.0337 29.6740 178.3763 55 G 3.9154 8.9279 110.4177 45.6115 0.0000 173.4462 56 D 4.4481 7.6173 120.9316 54.1388 41.7080 175.8631 57 V 4.1819 8.3560 124.8618 62.8242 32.2232 175.4314 58 V 4.6330 8.9079 120.3737 59.6736 36.6979 174.2458 59 K 4.9911 8.4697 120.3616 55.2427 34.2576 175.7089 60 A 5.1878 9.4355 125.2033 50.4574 23.8249 175.1301 61 V 4.6828 8.6604 118.4069 59.5025 34.2688 175.5436 62 V 4.0489 8.5153 126.1989 63.4843 32.1559 176.6537 63 V 4.2239 8.7642 119.1086 61.6214 35.0408 175.7468 64 R 4.7686 7.6095 117.6450 54.6220 34.7975 174.3387 65 T 5.0256 8.8247 110.7784 60.1108 72.2078 174.5187 66 K 4.0802 8.5417 122.5563 58.0202 32.6751 177.0003 67 K 4.2911 7.8850 120.4092 54.7330 32.8051 175.7473 68 E 4.2510 8.6592 124.9608 56.7000 30.3588 176.2587 69 V 4.1953 8.6027 123.4369 61.6343 33.3070 174.8788 70 K 4.4661 8.6200 127.4649 56.2006 33.0328 176.5211 71 R 4.5388 9.2067 124.0787 54.0763 31.8243 175.9816 72 P 4.2464 0.0000 0.0000 65.7986 31.5098 177.1776 73 D 4.6042 8.0400 114.9381 53.4051 39.1095 177.1734 74 G 4.0185 8.1146 110.5078 46.1529 0.0000 174.4480 75 S 4.4398 8.0000 114.0507 58.5946 63.7794 172.5084 76 A 5.1276 8.1088 123.3096 50.9448 22.6603 175.0666 77 I 4.3188 8.1090 117.1191 60.1060 41.8584 173.4252 78 R 4.5999 7.9903 127.8216 55.0591 33.2395 174.1252 79 F 4.9315 8.2881 124.3839 56.3880 41.2012 174.9578 80 D 4.7160 8.9846 117.7102 55.9892 41.4483 176.2080 81 D 4.8303 7.6844 116.1947 51.9744 42.8696 174.5964 82 N 5.0228 8.7835 117.1571 52.6071 39.9511 174.1860 83 A 5.3363 8.5121 124.7419 50.4235 23.3385 174.0542 84 A 4.7542 8.7271 119.1436 51.2167 23.4578 175.5150 85 V 4.5787 8.1227 118.9819 60.9288 34.6646 175.0648 86 I 4.5274 8.2097 128.5531 61.2090 38.2965 175.0001 87 I 5.1278 8.5758 119.1235 59.0844 41.1291 174.2154 88 N 4.7702 9.1460 121.2183 52.2512 39.8897 175.5704 89 N 4.4227 8.5129 118.3198 55.9035 38.6907 176.3142 90 Q 4.0633 7.9745 117.4061 56.5019 29.1413 175.7380 91 L 3.9139 8.5205 116.0718 56.5354 39.6749 173.8359 92 E 4.8076 7.8442 116.8801 53.2769 32.3271 173.8725 93 P 5.0331 0.0000 0.0000 62.5290 31.4874 176.6273 94 R 3.9300 8.8512 122.7555 58.3982 30.1976 176.9077 95 G 4.1316 7.7455 105.7028 44.4061 0.0000 173.7124 96 T 4.5476 7.9460 110.4110 63.1963 69.8606 177.2143 97 R 3.7348 7.4931 122.5247 52.8777 30.2199 175.3234 98 V 4.4448 8.3889 128.0646 59.9385 32.3396 175.6911 99 F 4.6170 7.9926 121.2209 56.3535 39.2979 176.1428 100 G 3.9532 8.7589 108.0948 45.0918 0.0000 171.5760 101 P 5.1288 0.0000 0.0000 62.6331 32.2250 175.1260 102 V 4.4913 8.0049 111.2758 60.5321 36.2383 173.7820 103 A 4.8802 8.1276 122.4284 50.7159 19.9403 179.2401 104 R 3.9880 8.7218 118.0857 58.8964 30.3058 179.2520 105 E 3.9993 8.3060 118.3555 59.3121 29.5455 178.9570 106 L 4.3433 7.8494 119.0813 57.3285 41.6581 179.5974 107 R 3.9518 8.1976 119.4037 59.4521 29.9636 177.8409 108 E 4.2957 7.5982 113.0942 57.3324 29.4026 177.9414 109 K 4.4577 8.1301 117.8088 55.7356 33.5935 176.8338 110 G 3.8373 7.8663 106.8537 45.5093 0.0000 173.7089 111 F 5.0442 7.7927 117.1601 57.1980 39.6884 178.2475 112 M 4.1523 8.1278 120.8525 58.0250 30.8241 176.8649 113 K 3.8801 8.2098 120.7648 59.7344 32.2786 178.5480 114 I 3.7713 7.9128 119.7632 64.5536 36.9289 178.9290 115 V 3.9524 7.8060 111.5257 63.9163 31.3956 178.5237 116 S 4.2764 7.9303 113.7372 61.6664 63.1489 176.4299 117 L 4.1047 7.5572 121.6055 55.7193 41.7292 177.8791 118 A 4.3320 7.9856 122.5017 51.5211 19.0089 175.6470 119 P 4.2518 0.0000 0.0000 65.3866 31.9984 176.5663 120 E 4.3515 7.9203 126.5526 53.8449 30.6346 173.8054 121 V 4.4545 8.1888 127.7789 61.6234 30.4523 175.3280 122 L 4.3331 8.4684 127.3821 54.6570 42.1226 175.8135 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 4.55 0.00 1.78 2.01 0.00 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 2 I 8.71 4.25 2.09 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 1.37 0.57 0.94 0.00 0.00 3 Q 9.59 4.86 0.00 2.19 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.41 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 4 P 0.00 3.69 0.00 2.09 1.98 0.00 3.63 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.10 0.00 5 Q 7.78 4.28 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.91 0.00 0.00 0.00 0.00 0.00 2.38 2.53 0.00 6 T 8.42 4.14 4.39 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 1.27 0.00 0.00 7 Y 8.84 4.74 0.00 2.73 2.91 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 8 L 8.96 5.01 0.00 1.52 1.47 0.97 0.86 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 9 E 9.31 4.40 0.00 2.03 1.74 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 2.28 2.27 0.00 10 V 7.76 4.55 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 0.74 0.00 0.00 0.86 0.00 0.00 11 A 8.73 3.96 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 12 D 7.52 4.74 0.00 2.71 2.58 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 0.00 0.00 0.00 0.00 13 N 7.92 4.99 0.00 3.24 3.32 0.00 0.00 7.42 7.10 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 14 T 8.03 3.79 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 1.19 0.00 0.00 15 G 7.94 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 0.00 0.00 0.00 0.00 16 A 7.67 4.47 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 17 R 8.98 4.60 0.00 1.82 2.02 0.00 3.30 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.73 0.00 18 K 7.80 4.93 0.00 1.68 1.66 0.00 1.75 0.00 0.00 2.15 0.00 0.00 3.18 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.63 1.48 7.81 19 I 8.30 4.65 1.89 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.15 0.82 0.00 0.00 20 M 7.88 4.31 0.00 1.81 1.31 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.44 0.00 21 C 9.26 4.37 0.00 2.95 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 22 I 8.45 4.48 1.95 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.03 0.90 0.00 0.00 23 R 7.49 4.53 0.00 1.87 1.69 0.00 3.20 0.00 0.00 3.37 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 24 V 8.47 4.09 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 0.71 0.00 0.00 1.00 0.00 0.00 25 L 8.24 4.25 0.00 1.75 1.68 0.93 0.75 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 26 K 8.43 4.14 0.00 1.70 1.41 0.00 1.88 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.23 1.34 7.81 27 G 8.45 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 0.00 0.00 0.00 28 S 8.55 4.28 0.00 3.98 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 0.00 29 N 7.26 4.50 0.00 2.75 2.83 0.00 0.00 6.89 6.93 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 30 A 8.02 4.13 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 31 K 8.59 3.83 0.00 1.53 0.74 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.10 1.28 7.81 32 Y 7.52 5.22 0.00 2.78 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 33 A 9.15 4.82 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 34 T 8.74 4.80 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 1.25 0.00 0.00 35 V 8.38 3.72 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 0.88 0.00 0.00 1.04 0.00 0.00 36 G 9.04 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 37 D 7.93 4.90 0.00 2.78 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 38 V 8.38 4.82 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 1.05 0.00 0.00 0.99 0.00 0.00 39 I 9.17 4.95 1.98 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 1.27 0.90 0.91 0.00 0.00 40 V 8.50 4.38 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 0.96 0.00 0.00 0.92 0.00 0.00 41 A 8.65 4.84 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 42 S 8.32 4.61 0.00 3.88 3.66 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 43 V 8.16 4.02 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 0.95 0.00 0.00 0.94 0.00 0.00 44 K 8.69 4.47 0.00 1.43 1.83 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.09 0.99 7.81 45 E 7.87 5.06 0.00 2.01 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 2.23 2.27 0.00 46 A 8.40 5.05 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 47 I 9.03 3.85 2.00 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 1.25 1.21 0.92 0.00 0.00 48 P 0.00 4.24 0.00 2.08 1.99 0.00 3.86 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 49 R 8.63 3.63 0.00 1.99 2.06 0.00 3.04 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 50 G 7.35 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 0.00 0.00 0.00 51 A 7.96 4.14 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 52 V 7.47 4.37 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 0.89 0.00 0.00 0.92 0.00 0.00 53 K 8.95 4.51 0.00 1.99 1.70 0.00 1.61 0.00 0.00 1.64 0.00 0.00 3.01 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.38 1.43 7.81 54 E 8.37 4.12 0.00 1.95 1.88 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 2.31 2.31 0.00 55 G 8.93 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 56 D 7.62 4.45 0.00 2.68 2.61 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 0.00 0.00 0.00 0.00 57 V 8.36 4.18 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 0.75 0.00 0.00 0.91 0.00 0.00 58 V 8.91 4.63 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 0.72 0.00 0.00 0.96 0.00 0.00 59 K 8.47 4.99 0.00 1.70 1.71 0.00 1.64 0.00 0.00 1.83 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.42 7.81 60 A 9.44 5.19 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 61 V 8.66 4.68 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 0.38 0.00 0.00 0.23 0.00 0.00 62 V 8.52 4.05 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 1.06 0.00 0.00 0.97 0.00 0.00 63 V 8.76 4.22 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 0.76 0.00 0.00 0.77 0.00 0.00 64 R 7.61 4.77 0.00 1.37 1.35 0.00 2.44 0.00 0.00 2.46 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.97 0.00 65 T 8.82 5.03 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 1.26 0.00 0.00 66 K 8.54 4.08 0.00 1.99 1.89 0.00 1.86 0.00 0.00 1.84 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.43 7.81 67 K 7.88 4.29 0.00 1.71 1.76 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.32 1.44 7.81 68 E 8.66 4.25 0.00 2.02 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 2.24 2.22 0.00 69 V 8.60 4.20 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 0.96 0.00 0.00 0.97 0.00 0.00 70 K 8.62 4.47 0.00 1.67 1.71 0.00 1.77 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.41 1.45 7.81 71 R 9.21 4.54 0.00 1.90 1.87 0.00 3.30 0.00 0.00 3.19 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.73 0.00 72 P 0.00 4.25 0.00 2.04 2.12 0.00 3.67 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 73 D 8.04 4.60 0.00 2.76 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 74 G 8.11 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 75 S 8.00 4.44 0.00 3.88 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 76 A 8.11 5.13 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 77 I 8.11 4.32 1.76 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 1.47 0.79 0.00 0.00 78 R 7.99 4.60 0.00 1.70 1.59 0.00 3.33 0.00 0.00 3.41 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.72 0.00 79 F 8.29 4.93 0.00 3.18 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 80 D 8.98 4.72 0.00 2.73 2.76 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 81 D 7.68 4.83 0.00 2.64 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 82 N 8.78 5.02 0.00 2.77 2.81 0.00 0.00 6.48 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 83 A 8.51 5.34 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 84 A 8.73 4.75 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 85 V 8.12 4.58 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 0.97 0.00 0.00 0.77 0.00 0.00 86 I 8.21 4.53 1.83 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 1.23 0.64 0.90 0.00 0.00 87 I 8.58 5.13 1.91 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 1.22 0.76 0.97 0.00 0.00 88 N 9.15 4.77 0.00 2.82 2.80 0.00 0.00 7.65 6.59 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 89 N 8.51 4.42 0.00 2.74 2.88 0.00 0.00 6.88 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 90 Q 7.97 4.06 0.00 1.98 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.57 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 91 L 8.52 3.91 0.00 1.83 1.87 1.10 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 92 E 7.84 4.81 0.00 2.01 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 2.32 2.41 0.00 93 P 0.00 5.03 0.00 2.37 2.07 0.00 3.43 0.00 0.00 5.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 94 R 8.85 3.93 0.00 1.81 2.03 0.00 3.18 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 95 G 7.75 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 96 T 7.95 4.55 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 97 R 7.49 3.73 0.00 2.00 1.93 0.00 3.15 0.00 0.00 3.40 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.77 0.00 98 V 8.39 4.44 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 0.79 0.00 0.00 0.81 0.00 0.00 99 F 7.99 4.62 0.00 3.15 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 0.00 100 G 8.76 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 0.00 0.00 0.00 101 P 0.00 5.13 0.00 1.94 2.15 0.00 3.70 0.00 0.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.03 0.00 102 V 8.00 4.49 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 0.57 0.00 0.00 0.94 0.00 0.00 103 A 8.13 4.88 1.44 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 0.00 104 R 8.72 3.99 0.00 1.90 2.03 0.00 3.16 0.00 0.00 3.36 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.75 0.00 105 E 8.31 4.00 0.00 2.11 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 2.44 2.51 0.00 106 L 7.85 4.34 0.00 1.75 1.86 1.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 107 R 8.20 3.95 0.00 1.95 2.02 0.00 3.12 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 108 E 7.60 4.30 0.00 2.10 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 2.36 2.37 0.00 109 K 8.13 4.46 0.00 2.06 1.80 0.00 1.79 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.61 1.58 7.81 110 G 7.87 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 0.00 0.00 0.00 111 F 7.79 5.04 0.00 3.33 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 0.00 112 M 8.13 4.15 0.00 2.26 2.35 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.61 0.00 113 K 8.21 3.88 0.00 1.87 1.92 0.00 1.76 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.54 1.53 7.81 114 I 7.91 3.77 2.02 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.58 0.85 0.00 0.00 115 V 7.81 3.95 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 0.88 0.00 0.00 1.00 0.00 0.00 116 S 7.93 4.28 0.00 4.05 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 0.00 117 L 7.56 4.10 0.00 1.72 1.79 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 118 A 7.99 4.33 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 0.00 119 P 0.00 4.25 0.00 2.22 2.22 0.00 3.87 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 2.02 2.01 0.00 120 E 7.92 4.35 0.00 2.12 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 2.33 2.38 0.00 121 V 8.19 4.45 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 0.00 122 L 8.47 4.33 0.00 1.87 1.63 0.98 0.94 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