NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -3 G 3.9471 8.3544 109.7365 45.4351 0.0000 173.2506 -2 S 4.2535 9.2481 112.9305 58.2424 64.4943 171.7328 -1 S 4.4804 8.8484 114.1264 58.4936 64.3841 173.4051 0 R 4.5648 7.6862 117.5886 54.5178 32.2478 174.9115 1 M 4.6706 8.1216 117.4028 53.3804 34.5177 176.0515 2 S 4.1398 8.8212 119.7957 59.8421 63.6341 173.7261 3 T 4.2754 8.4557 119.9702 65.1999 70.0608 174.7524 4 S 4.1113 7.9808 119.0752 58.8976 62.2029 174.4489 5 S 4.0288 8.4490 121.8743 60.2295 63.0076 172.4885 6 L 3.7276 7.7619 126.8915 54.3328 42.3816 172.3196 7 R 4.4614 8.0355 118.5268 56.0353 33.3044 176.0008 8 R 4.6612 7.8224 115.9800 54.8496 33.3236 174.4038 9 Q 4.6617 8.2713 119.1373 54.3526 32.0748 175.5029 10 M 4.5221 8.0535 120.7860 54.9371 34.0595 176.0331 11 K 4.3998 8.3798 123.9242 57.2538 33.2306 173.6229 12 N 5.2382 8.2524 119.8725 51.7269 40.1533 173.6516 13 I 3.8058 8.1576 118.6942 61.4758 37.6632 176.0510 14 V 3.7927 8.3942 125.1850 62.5571 31.4713 176.3840 15 H 4.3947 8.8008 123.5225 57.5761 28.7009 175.6317 16 N 4.6415 7.0193 119.1025 51.1204 37.1066 171.1170 17 Y 4.2850 8.2347 116.3755 58.4399 38.6934 177.5516 18 S 4.6983 8.3139 120.7622 56.9920 62.7108 173.1275 19 E 4.6097 7.7989 116.0624 55.6292 30.8770 178.8104 20 A 4.0305 8.2077 123.0771 55.9188 18.0169 179.9427 21 E 3.8210 8.2876 115.6918 60.0959 29.1833 179.5543 22 I 3.7680 7.4251 118.9266 63.7839 37.2569 178.0299 23 K 3.7940 8.0379 120.4942 59.4203 32.1055 178.5316 24 V 3.4807 7.7663 117.8992 66.5308 29.8699 177.3126 25 R 3.7720 7.5645 116.9035 59.8038 29.6870 177.8171 26 E 3.9023 8.1627 118.5268 58.4867 29.6994 178.1930 27 A 4.2244 7.7293 120.0419 54.4536 18.9508 178.3156 28 T 4.5503 7.2764 106.4098 60.0470 69.3961 174.7521 29 S 4.6854 6.5157 112.6521 58.9178 65.3026 176.3722 30 N 4.8611 8.4537 129.6700 52.7391 39.2099 175.7809 31 D 4.4520 8.3122 117.1765 56.9410 41.3791 177.4848 32 P 4.6252 0.0000 0.0000 62.2908 32.6556 173.4100 33 W 4.5589 9.8259 118.7293 56.0440 31.8256 174.1536 34 G 3.9668 9.2197 105.8049 44.2615 0.0000 171.0555 35 P 4.4140 0.0000 0.0000 63.1290 32.2645 176.2424 36 S 4.6188 8.3508 113.1212 57.1002 61.6353 172.4217 37 S 4.4802 7.0986 116.2297 58.6241 65.2817 175.5852 38 S 4.6074 7.1404 111.0663 55.2185 64.0940 175.2397 39 L 3.8798 7.7807 127.0748 58.2923 42.3661 177.3658 40 M 3.6122 7.7435 117.4836 58.7493 31.9813 177.9790 41 S 5.0134 7.3573 113.7115 60.7674 62.5319 176.1766 42 E 3.9439 8.0682 121.4617 59.5979 29.1069 179.0791 43 I 3.7422 7.8032 117.5902 64.3615 37.3748 178.0183 44 A 4.2149 8.0637 121.0130 55.4014 18.2122 179.1426 45 D 4.7713 8.1239 114.8585 57.3790 41.4364 178.1548 46 L 4.3842 7.9472 119.3277 57.5898 41.5982 178.7989 47 T 4.0871 7.8027 109.0701 65.2200 68.4604 174.6837 48 Y 4.4837 7.9040 117.2289 60.0328 38.4046 177.5101 49 N 4.7580 7.9257 115.8060 53.3681 38.8287 173.5562 50 V 4.3262 8.4083 112.0799 63.7325 33.5672 177.9134 51 V 3.8953 7.4063 118.7776 64.0494 31.3655 177.3532 52 A 3.9840 7.9140 119.4314 55.3979 18.6173 179.0277 53 F 4.2507 8.4259 118.3682 62.0019 39.3710 177.4036 54 S 3.5761 8.0046 114.3815 61.4688 62.0875 176.5305 55 E 4.0861 7.9406 120.1940 59.1460 29.3060 178.1411 56 I 3.9605 7.7567 121.1693 63.5880 37.2564 177.6376 57 M 3.6685 7.9999 118.8500 58.9005 31.8863 178.8895 58 S 4.3462 7.7724 114.7595 62.2493 62.9509 176.6953 59 M 4.1038 7.8707 120.2412 58.4446 31.4782 179.0459 60 I 3.6392 7.2905 119.4090 63.7351 37.3001 178.0793 61 W 4.6698 7.9175 120.1076 59.5993 28.8950 178.6329 62 K 4.0408 8.0189 118.3874 59.6932 31.1433 179.5327 63 R 4.2556 7.8333 117.5570 58.3391 29.7263 178.7493 64 L 4.2814 7.5622 118.5954 55.9833 42.1598 176.6335 65 N 4.7559 7.8136 117.6115 52.2081 39.3007 173.8923 66 D 4.4278 7.9047 117.1267 54.5139 41.4212 174.1978 67 H 4.7172 8.3409 116.3961 55.1431 30.7070 175.3777 68 G 4.1105 8.1434 108.5576 44.8739 0.0000 173.6826 69 K 4.6011 7.8343 116.5323 57.1666 36.8170 175.5499 70 N 4.8091 7.8233 115.8333 50.2160 39.2028 174.4396 71 W 4.6840 8.1685 117.0782 57.2365 28.8259 177.6524 72 R 3.0908 6.5785 120.0133 60.1754 29.1087 177.7848 73 H 4.2702 7.8575 113.8066 58.7461 28.9809 177.5668 74 V 4.0158 8.0437 121.4435 65.6861 31.5832 177.0859 75 Y 4.4904 8.6600 118.7774 61.1582 38.1985 178.2524 76 K 3.8586 8.2707 119.7222 59.3662 32.2468 178.5648 77 A 3.9714 8.1564 121.1178 55.0665 18.2588 179.4749 78 M 4.0427 7.8947 117.3560 58.6045 32.0093 179.0415 79 T 3.8568 7.5911 115.7320 66.3189 68.7800 176.3722 80 L 3.9981 7.5745 121.8171 57.9526 41.7654 178.4904 81 M 3.9573 7.9451 118.2117 57.8834 31.8791 177.5852 82 E 4.0440 8.0090 118.8443 58.6722 30.2413 177.5184 83 Y 4.0196 8.1021 119.7264 60.6282 38.9051 177.7779 84 L 4.1502 8.0657 119.7842 57.8775 41.5517 179.4438 85 I 3.7167 7.3315 118.2082 64.0823 37.0286 176.7559 86 K 4.0431 7.5974 118.3199 58.0030 32.1210 177.2736 87 T 3.9168 7.5922 120.7655 64.6389 67.9006 175.6814 88 G 4.1213 7.1572 108.0073 45.9824 0.0000 173.7668 89 S 4.0133 6.6684 111.0230 55.9943 64.8024 177.6251 90 E 3.8073 7.7295 120.5763 58.0709 29.2997 179.1089 91 R 3.8859 7.4078 116.1282 58.5692 29.3076 178.7040 92 V 3.9900 6.9960 118.7545 65.8632 31.4700 178.1514 93 S 4.2606 7.9099 114.6539 61.2992 62.9385 176.3326 94 Q 4.0218 7.8032 120.5153 59.0356 28.4585 178.6308 95 Q 4.0881 8.2367 120.3276 59.2325 28.8748 177.7200 96 C 4.3324 7.6575 118.3683 62.4945 31.6686 175.2616 97 K 4.0508 7.7690 119.8373 59.2709 31.8753 178.2920 98 E 4.1633 7.9219 117.3979 57.4655 29.9473 176.4079 99 N 4.7656 7.9197 118.5213 52.5678 39.7924 175.9126 100 M 4.0152 7.6544 118.1280 58.5092 32.2741 176.3087 101 Y 4.3477 6.8127 116.1738 60.6586 37.7763 178.1192 102 A 3.9806 7.5840 121.4046 55.0948 18.3957 179.6206 103 V 3.9461 7.8364 116.1227 65.8600 31.8139 177.8188 104 Q 3.9999 8.3183 117.7206 58.2975 28.5577 177.7133 105 T 4.7629 7.9397 115.3815 64.0739 67.2317 175.8729 106 L 4.4403 7.6329 120.8465 57.7492 41.6261 178.6620 107 K 4.0315 7.9002 118.6613 59.2485 32.2613 177.4442 108 D 4.9158 7.7319 118.0904 53.3994 40.5660 175.4433 109 F 5.1453 8.0814 122.3114 57.5173 38.3599 172.4485 110 Q 4.2548 7.9152 120.7070 53.7003 30.8288 174.9997 111 Y 4.6168 7.9192 122.2287 56.4431 41.6731 174.2901 112 V 4.4875 8.0539 126.3406 62.8060 32.1369 175.0502 113 D 4.6462 8.8273 120.0366 52.9826 40.3608 174.0870 114 R 4.0205 8.6542 115.4088 59.4320 28.8965 176.5365 115 D 4.4957 7.7915 119.1003 53.0815 42.5260 173.5551 116 G 3.9406 8.1618 121.2378 44.5964 0.0000 170.2262 117 K 4.6024 8.4845 121.1466 54.5955 34.7054 176.3625 118 D 4.5622 8.3725 122.2090 53.3076 39.4229 175.3476 119 Q 4.5362 8.2440 118.6186 55.3193 29.2383 176.5480 120 G 3.1431 7.5731 105.7442 45.9278 0.0000 176.6430 121 V 3.6268 7.2507 121.8134 64.0057 31.8276 176.6642 122 N 3.9952 7.6258 117.1122 56.0628 38.1975 177.3599 123 V 3.8959 6.6178 119.5606 64.3718 31.7213 178.0682 124 R 3.8335 7.5309 119.3541 59.6035 29.9581 178.4911 125 E 4.0154 8.0426 117.4762 58.8747 29.5840 178.9754 126 K 3.9755 7.8272 119.6353 59.5675 32.2038 178.4473 127 A 4.0852 8.2019 120.8702 55.3108 18.1152 179.4573 128 K 3.8979 7.6947 116.9735 59.5201 32.4900 178.5991 129 Q 4.0775 8.1297 119.8712 59.2031 28.9716 177.6094 130 L 3.9351 7.7467 120.9220 58.6187 41.7529 179.2077 131 V 3.6754 7.5006 116.5918 65.3829 31.7256 177.7408 132 A 4.1235 7.9893 120.7875 55.0703 18.0861 179.4241 133 L 3.8939 7.7900 115.3841 58.1205 41.9857 179.5826 134 L 4.3436 7.3337 117.0022 56.6601 42.2880 178.3349 135 R 4.5319 7.4684 116.7960 55.5861 32.4078 174.3321 136 D 4.4727 8.5821 121.6869 56.3165 41.8188 175.9818 137 E 4.7956 7.8978 117.1069 54.1692 32.4984 174.2496 138 D 5.0280 8.3818 122.4744 52.7966 44.4561 177.1563 139 R 4.1167 8.3525 122.7634 55.4046 28.6204 173.5243 140 L 3.3795 7.8236 121.2911 54.6531 41.9339 174.5095 141 R 4.1886 8.2980 127.8826 58.2108 31.7043 174.7811 142 E 4.9704 7.9208 107.0842 56.1715 31.0322 175.6977 143 E 4.5931 7.9694 120.3345 54.0631 32.1591 175.3142 144 R 4.0914 8.5699 125.0262 56.6487 30.1829 175.7341 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 -3 G 8.35 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 -2 S 9.25 4.25 0.00 3.86 3.80 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 -1 S 8.85 4.48 0.00 3.85 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 0 R 7.69 4.56 0.00 1.82 1.84 0.00 3.36 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 1 M 8.12 4.67 0.00 1.94 1.94 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 2 S 8.82 4.14 0.00 3.85 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 3 T 8.46 4.28 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 1.21 0.00 0.00 4 S 7.98 4.11 0.00 3.86 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 5 S 8.45 4.03 0.00 3.85 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 6 L 7.76 3.73 0.00 1.75 1.65 0.92 0.84 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 7 R 8.04 4.46 0.00 1.80 1.72 0.00 3.20 0.00 0.00 3.28 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 8 R 7.82 4.66 0.00 1.84 1.83 0.00 2.99 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.59 0.00 9 Q 8.27 4.66 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.98 0.00 0.00 0.00 0.00 0.00 2.24 2.40 0.00 10 M 8.05 4.52 0.00 2.05 2.00 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 2.60 2.50 0.00 11 K 8.38 4.40 0.00 1.75 1.72 0.00 1.69 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.43 7.81 12 N 8.25 5.24 0.00 2.81 2.83 0.00 0.00 5.94 7.86 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 13 I 8.16 3.81 1.93 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 1.33 0.86 1.04 0.00 0.00 14 V 8.39 3.79 2.12 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 1.10 0.00 0.00 0.93 0.00 0.00 15 H 8.80 4.39 0.00 3.31 3.45 0.00 5.56 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 N 7.02 4.64 0.00 2.61 2.76 0.00 0.00 7.17 7.47 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 17 Y 8.23 4.29 0.00 2.91 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 18 S 8.31 4.70 0.00 3.99 3.72 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 19 E 7.80 4.61 0.00 2.05 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 2.15 2.14 0.00 20 A 8.21 4.03 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.29 3.82 0.00 2.17 2.25 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 2.36 2.42 0.00 22 I 7.43 3.77 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 1.38 0.79 0.88 0.00 0.00 23 K 8.04 3.79 0.00 1.83 1.76 0.00 1.50 0.00 0.00 1.53 0.00 0.00 3.10 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.51 7.81 24 V 7.77 3.48 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 1.02 0.00 0.00 0.92 0.00 0.00 25 R 7.56 3.77 0.00 2.04 1.96 0.00 3.12 0.00 0.00 3.05 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 26 E 8.16 3.90 0.00 2.16 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 2.28 2.32 0.00 27 A 7.73 4.22 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 28 T 7.28 4.55 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 1.24 0.00 0.00 29 S 6.52 4.69 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 30 N 8.45 4.86 0.00 2.56 2.57 0.00 0.00 7.08 8.33 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 31 D 8.31 4.45 0.00 2.63 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 32 P 0.00 4.63 0.00 2.22 2.14 0.00 3.57 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 33 W 9.83 4.56 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 34 G 9.22 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 35 P 0.00 4.41 0.00 2.19 2.09 0.00 3.73 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 36 S 8.35 4.62 0.00 3.79 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 37 S 7.10 4.48 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 38 S 7.14 4.61 0.00 3.82 3.71 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 39 L 7.78 3.88 0.00 1.70 1.53 0.86 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 40 M 7.74 3.61 0.00 0.68 1.57 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 2.26 1.81 0.00 41 S 7.36 5.01 0.00 4.06 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 42 E 8.07 3.94 0.00 2.26 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 2.33 2.47 0.00 43 I 7.80 3.74 1.99 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.42 0.92 0.00 0.00 44 A 8.06 4.21 1.72 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 0.00 0.00 45 D 8.12 4.77 0.00 2.78 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 46 L 7.95 4.38 0.00 2.01 1.79 1.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 47 T 7.80 4.09 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 1.37 0.00 0.00 48 Y 7.90 4.48 0.00 3.23 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 49 N 7.93 4.76 0.00 2.94 2.87 0.00 0.00 7.11 7.11 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 50 V 8.41 4.33 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 0.89 0.00 0.00 0.98 0.00 0.00 51 V 7.41 3.90 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 0.99 0.00 0.00 0.98 0.00 0.00 52 A 7.91 3.98 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 53 F 8.43 4.25 0.00 3.22 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 54 S 8.00 3.58 0.00 4.03 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 55 E 7.94 4.09 0.00 2.12 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 2.39 2.42 0.00 56 I 7.76 3.96 2.07 0.00 0.00 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 1.53 0.92 0.89 0.00 0.00 57 M 8.00 3.67 0.00 2.07 1.86 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.73 0.00 58 S 7.77 4.35 0.00 3.92 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 59 M 7.87 4.10 0.00 2.02 2.28 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.55 0.00 60 I 7.29 3.64 1.63 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.29 0.07 0.00 0.00 61 W 7.92 4.67 0.00 3.56 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 62 K 8.02 4.04 0.00 1.92 1.87 0.00 1.87 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.54 7.81 63 R 7.83 4.26 0.00 1.75 1.98 0.00 3.20 0.00 0.00 3.13 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.77 0.00 64 L 7.56 4.28 0.00 1.91 1.93 0.80 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 65 N 7.81 4.76 0.00 2.69 2.74 0.00 0.00 7.10 8.20 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 66 D 7.90 4.43 0.00 2.71 2.68 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 67 H 8.34 4.72 0.00 3.18 3.19 0.00 5.76 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 68 G 8.14 4.11 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 0.00 69 K 7.83 4.60 0.00 1.60 1.76 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.09 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.31 1.51 7.81 70 N 7.82 4.81 0.00 2.72 2.42 0.00 0.00 6.58 7.49 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 71 W 8.17 4.68 0.00 3.80 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 72 R 6.58 3.09 0.00 1.38 1.74 0.00 2.66 0.00 0.00 2.87 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.00 0.00 73 H 7.86 4.27 0.00 3.28 3.34 0.00 5.76 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 74 V 8.04 4.02 2.69 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 1.62 0.00 0.00 1.27 0.00 0.00 75 Y 8.66 4.49 0.00 3.75 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 0.00 76 K 8.27 3.86 0.00 2.13 1.79 0.00 1.54 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.48 1.58 7.81 77 A 8.16 3.97 1.38 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 0.00 0.00 0.00 0.00 0.00 0.00 78 M 7.89 4.04 0.00 2.10 2.17 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.63 0.00 79 T 7.59 3.86 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 1.12 0.00 0.00 80 L 7.57 4.00 0.00 1.66 1.53 0.83 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 81 M 7.95 3.96 0.00 2.00 1.79 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.41 0.00 82 E 8.01 4.04 0.00 2.07 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 0.00 2.30 2.30 0.00 83 Y 8.10 4.02 0.00 3.16 2.93 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 84 L 8.07 4.15 0.00 1.84 1.75 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 85 I 7.33 3.72 2.07 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 1.65 0.56 0.90 0.00 0.00 86 K 7.60 4.04 0.00 1.79 1.46 0.00 1.62 0.00 0.00 1.57 0.00 0.00 2.82 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.35 7.81 87 T 7.59 3.92 3.94 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 0.00 0.00 0.00 0.71 0.00 0.00 88 G 7.16 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 89 S 6.67 4.01 0.00 3.09 3.20 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 0.00 90 E 7.73 3.81 0.00 1.92 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 2.32 2.26 0.00 91 R 7.41 3.89 0.00 1.31 1.76 0.00 2.55 0.00 0.00 2.81 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.50 0.00 92 V 7.00 3.99 2.23 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 1.10 0.00 0.00 0.96 0.00 0.00 93 S 7.91 4.26 0.00 3.87 3.87 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 94 Q 7.80 4.02 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.80 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 95 Q 8.24 4.09 0.00 2.52 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.86 0.00 0.00 0.00 0.00 0.00 2.75 2.61 0.00 96 C 7.66 4.33 0.00 3.27 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 97 K 7.77 4.05 0.00 1.79 1.80 0.00 1.84 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.46 7.81 98 E 7.92 4.16 0.00 2.14 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 0.00 2.45 2.48 0.00 99 N 7.92 4.77 0.00 2.56 2.12 0.00 0.00 5.95 6.55 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 0.00 100 M 7.65 4.02 0.00 1.60 1.85 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 2.57 2.52 0.00 101 Y 6.81 4.35 0.00 3.03 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 0.00 102 A 7.58 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 V 7.84 3.95 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 1.24 0.00 0.00 1.37 0.00 0.00 104 Q 8.32 4.00 0.00 2.28 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.60 0.00 0.00 0.00 0.00 0.00 2.39 2.63 0.00 105 T 7.94 4.76 4.54 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 0.00 0.00 0.00 1.31 0.00 0.00 106 L 7.63 4.44 0.00 1.89 1.88 1.10 1.02 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 0.00 107 K 7.90 4.03 0.00 1.84 2.00 0.00 1.80 0.00 0.00 1.79 0.00 0.00 3.12 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.50 7.81 108 D 7.73 4.92 0.00 3.05 2.94 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 0.00 0.00 0.00 0.00 109 F 8.08 5.15 0.00 3.14 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 0.00 110 Q 7.92 4.25 0.00 2.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.39 0.00 0.00 0.00 0.00 0.00 2.29 2.17 0.00 111 Y 7.92 4.62 0.00 3.08 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 V 8.05 4.49 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 0.99 0.00 0.00 0.96 0.00 0.00 113 D 8.83 4.65 0.00 2.92 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 0.00 114 R 8.65 4.02 0.00 1.95 2.15 0.00 3.07 0.00 0.00 3.17 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 115 D 7.79 4.50 0.00 2.60 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 0.00 116 G 8.16 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 K 8.48 4.60 0.00 1.73 1.72 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.44 7.81 118 D 8.37 4.56 0.00 2.59 2.54 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 0.00 0.00 0.00 0.00 119 Q 8.24 4.54 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 7.61 0.00 0.00 0.00 0.00 0.00 2.29 2.45 0.00 120 G 7.57 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 0.00 0.00 0.00 121 V 7.25 3.63 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 0.62 0.00 0.00 0.81 0.00 0.00 122 N 7.63 4.00 0.00 2.21 2.02 0.00 0.00 6.53 7.65 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 0.00 123 V 6.62 3.90 1.75 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 0.40 0.00 0.00 1.26 0.00 0.00 124 R 7.53 3.83 0.00 1.91 1.92 0.00 3.06 0.00 0.00 3.05 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 0.00 125 E 8.04 4.02 0.00 2.05 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 2.37 2.30 0.00 126 K 7.83 3.98 0.00 2.56 2.14 0.00 1.75 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.53 7.81 127 A 8.20 4.09 1.54 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 0.00 0.00 0.00 0.00 0.00 0.00 128 K 7.69 3.90 0.00 1.89 2.00 0.00 1.84 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.62 7.81 129 Q 8.13 4.08 0.00 2.42 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.50 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 130 L 7.75 3.94 0.00 1.82 1.73 0.98 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 131 V 7.50 3.68 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 0.91 0.00 0.00 1.12 0.00 0.00 132 A 7.99 4.12 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 0.00 133 L 7.79 3.89 0.00 1.61 1.74 0.98 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 134 L 7.33 4.34 0.00 1.74 1.76 0.98 0.87 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 0.00 135 R 7.47 4.53 0.00 1.86 1.83 0.00 3.14 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 136 D 8.58 4.47 0.00 2.62 2.68 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 0.00 137 E 7.90 4.80 0.00 1.92 1.76 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 2.17 2.28 0.00 138 D 8.38 5.03 0.00 2.66 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 0.00 139 R 8.35 4.12 0.00 1.79 1.89 0.00 3.52 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 1.58 1.55 0.00 140 L 7.82 3.38 0.00 1.74 1.66 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 141 R 8.30 4.19 0.00 1.83 1.88 0.00 3.37 0.00 0.00 3.18 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 142 E 7.92 4.97 0.00 1.91 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 2.16 0.00 143 E 7.97 4.59 0.00 1.96 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 2.19 2.28 0.00 144 R 8.57 4.09 0.00 1.81 1.78 0.00 3.48 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00