NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2137 8.3144 121.7900 55.6165 33.1154 175.1822 2 E 3.7813 8.6512 126.4337 54.9342 30.0898 175.0901 3 T 4.1229 8.7736 118.5232 61.3710 72.0287 174.8389 4 A 3.9985 8.5609 123.7358 55.3922 18.5354 180.0132 5 A 4.1574 8.0175 118.6116 55.2895 18.4624 179.6038 6 A 4.0245 8.0343 119.4271 54.9817 18.4224 179.6763 7 K 4.0683 8.3836 119.9155 59.0376 32.1701 178.6371 8 F 4.1121 8.4532 120.8543 61.4968 39.3167 176.9796 9 E 3.9884 8.3512 117.9414 59.3626 29.0375 179.3459 10 R 3.8665 7.9935 117.8217 59.5193 30.2877 178.1565 11 Q 4.0693 8.1516 116.4350 57.5744 29.2423 176.1142 12 H 4.6863 8.0489 114.2508 53.8601 31.5038 173.0623 13 M 4.7252 7.8877 118.6473 53.8328 33.7373 176.2986 14 D 4.7154 9.2313 123.1696 52.7192 41.8397 175.4893 15 S 4.5751 8.4632 114.8081 58.5807 63.5987 175.7203 16 S 4.2674 8.2629 116.3988 61.0261 62.9890 174.7030 17 T 4.7108 7.4754 115.8559 60.7097 71.1825 174.5233 18 S 4.1669 8.5915 118.0816 61.0372 63.4462 173.7474 19 A 4.0578 7.0056 120.4668 51.1636 21.2825 175.7128 20 A 3.3122 8.0564 122.0986 54.7259 18.7854 180.8219 21 S 3.7792 7.4677 108.0494 58.7200 61.1786 172.2635 22 S 4.5375 7.7445 116.9889 56.1246 64.7240 174.5526 23 S 4.2148 8.8446 123.0154 60.9364 63.0991 174.7471 24 N 4.5183 8.1444 118.6772 55.0521 39.4734 175.5710 25 Y 4.0273 8.3945 119.7466 61.7085 38.6129 177.5751 26 C 4.2047 8.5313 116.7896 60.0885 38.6456 175.5597 27 N 4.3920 8.3794 117.6243 56.6668 38.1454 176.9799 28 Q 3.9026 7.9616 120.2831 59.5646 29.3643 178.1223 29 M 3.7400 7.7944 121.3687 57.9310 31.7202 178.6529 30 M 4.0337 8.0681 119.1241 58.0642 31.9884 178.8189 31 K 4.0156 7.8155 120.3842 59.0875 32.0390 179.1029 32 S 4.2759 8.1259 113.7590 60.2845 62.7309 175.3039 33 R 4.4714 7.4421 119.9366 55.2044 30.1773 175.5856 34 N 4.2859 7.8969 114.7752 54.7584 36.4257 174.8179 35 L 4.5910 8.2515 116.4458 54.9166 42.2929 177.6835 36 T 5.0493 7.5103 107.5326 60.2687 69.4350 175.9248 37 K 4.1057 8.4419 123.4214 59.9865 32.4831 177.3199 38 D 4.6398 8.0196 116.3829 55.1486 42.3363 176.2481 39 R 3.8503 7.1400 113.1691 54.2802 32.6259 174.2196 40 C 4.8580 8.6026 115.8808 55.7751 40.3518 173.8646 41 K 4.1714 8.6317 127.5186 55.9121 32.3045 174.7447 42 P 4.7597 0.0000 0.0000 64.6208 32.4335 176.6847 43 V 4.9453 7.5472 117.1237 61.2167 34.6271 174.3491 44 N 4.6486 9.2341 124.6679 52.8847 42.8007 172.8462 45 T 4.7626 7.9503 122.1726 61.7743 71.2237 173.1713 46 F 4.8675 8.8796 124.5806 55.6398 42.1970 174.5548 47 V 4.4952 8.9500 123.1547 61.0515 33.1532 176.0005 48 H 5.5231 8.6738 128.7897 54.3473 26.3584 173.5680 49 E 4.8249 7.6981 117.0528 53.2580 34.4738 176.9212 50 S 4.3130 8.4230 115.0589 58.5614 64.7780 175.0915 51 L 3.9939 8.5536 124.5361 58.3619 41.9186 179.0516 52 A 4.0155 8.0841 120.1923 55.5452 18.0580 179.2351 53 D 4.3408 7.9371 116.1454 57.3971 41.1637 178.9305 54 V 3.7915 7.8185 118.5446 66.0993 31.6076 178.1397 55 Q 3.9288 8.5598 118.0223 58.8298 28.4725 178.5708 56 A 4.0688 8.1145 121.3052 54.3558 18.3200 179.5773 57 V 3.4168 7.6339 117.1521 65.9820 31.2852 176.8409 58 C 3.7452 7.7813 114.6322 57.7906 39.8737 174.0935 59 S 4.7165 7.5336 114.7519 57.9864 63.8370 174.4080 60 Q 4.0764 7.2327 120.4636 56.3696 30.5572 178.4755 61 K 4.3489 8.4727 134.6393 56.3773 32.7143 174.6427 62 N 4.3835 8.7481 127.4600 53.6673 39.1819 174.3653 63 V 4.5829 8.3905 118.1560 59.2519 36.7064 174.8435 64 A 4.1179 8.4126 125.1039 52.3757 19.1393 178.4948 65 C 4.7388 8.9755 118.8692 55.8961 41.3157 175.2468 66 K 3.7395 8.9900 121.8452 59.7504 31.6355 178.0871 67 N 4.5154 8.0389 112.9658 53.0294 37.5651 175.8313 68 G 3.9408 8.0787 108.4015 45.5826 0.0000 174.1935 69 Q 4.2513 8.4217 119.2964 56.3192 29.2097 176.2799 70 T 4.7056 8.2377 107.9918 61.6399 69.2281 173.6618 71 N 5.0199 8.0362 117.6262 54.1472 38.5852 174.7435 72 C 5.3212 7.5580 115.6203 56.8411 44.6785 172.7001 73 Y 5.0584 8.7483 118.1476 56.5507 42.3233 173.9106 74 Q 4.9866 9.1354 126.1625 54.3286 31.0133 174.9158 75 S 4.5116 8.8805 122.3365 58.7318 63.0511 174.3122 76 Y 4.5222 9.2118 122.1272 60.7260 37.9334 176.8251 77 S 4.8375 7.8378 114.0421 56.8255 64.8406 173.8620 78 T 4.0914 8.0631 112.6028 62.2059 69.5652 173.4263 79 M 5.0400 9.0132 122.0756 53.2830 36.8101 174.7863 80 S 4.8060 9.5249 117.7180 58.5310 63.5494 173.1360 81 I 5.1540 9.0700 120.1679 59.5143 41.8121 174.1617 82 T 4.9388 8.8211 118.9294 61.9413 71.9528 172.9152 83 D 4.8928 9.3049 127.5711 53.6092 42.6251 174.7732 84 C 5.4569 9.1422 121.9337 55.2824 43.7093 172.9412 85 R 5.2162 8.7797 123.8841 54.0806 32.8456 174.1014 86 E 4.1420 9.6509 128.1457 56.4085 30.8772 176.6824 87 T 4.1670 8.7118 116.5661 61.0230 69.6832 175.9159 88 G 3.6413 8.5496 111.2634 47.9174 0.0000 174.6123 89 S 4.4879 7.3268 111.3751 58.2048 63.8391 174.6524 90 S 4.1030 7.3052 116.5370 58.4737 62.8364 173.5482 91 K 4.3149 8.3192 125.8735 55.3168 34.8000 174.3849 92 Y 4.3347 8.8005 128.0247 57.8009 38.9689 174.1135 93 P 3.3131 0.0000 0.0000 62.9626 31.9254 176.7189 94 N 4.6254 7.7841 119.8534 52.1572 36.9589 173.1416 95 C 4.5071 7.8862 116.7326 56.6575 40.6505 173.3857 96 A 5.0198 8.6788 125.5306 50.4152 22.0796 174.4189 97 Y 5.0864 9.4976 119.5888 56.0076 41.9447 175.4266 98 K 4.4392 9.0219 122.9513 56.1864 33.8289 175.8917 99 T 4.9758 8.5623 121.5082 62.7311 70.1687 174.3953 100 T 4.5389 8.7966 122.4935 61.5853 71.9555 173.1941 101 Q 4.6398 8.7802 128.1876 56.1580 29.9803 174.7954 102 A 4.7166 9.0360 125.9825 50.8713 23.5430 174.9205 103 N 5.3791 8.7264 116.5125 51.7242 40.6649 174.2260 104 K 4.7670 8.7984 122.4774 54.7304 37.5123 175.8273 105 H 4.9232 9.0997 119.6570 55.9833 29.9697 174.7972 106 I 4.8338 8.6504 115.4596 59.3761 40.7182 174.3913 107 I 4.9565 8.2500 124.2358 59.7105 40.1809 175.0761 108 V 4.7798 8.6352 119.2656 59.3339 36.1818 174.4538 109 A 4.9355 8.7319 125.2835 51.2682 20.4329 175.6737 110 C 5.1017 8.7443 119.5374 55.2069 40.6672 173.1726 111 E 4.7044 8.7546 121.6893 56.4821 33.5742 175.5776 112 G 3.8454 9.4767 111.3848 44.7062 0.0000 171.4464 113 N 5.0039 8.1943 116.1699 50.6591 40.5238 172.3603 114 P 4.3322 0.0000 0.0000 62.8542 32.0079 175.8110 115 Y 5.2073 8.2454 121.5152 56.5194 38.7217 174.5252 116 V 4.4468 7.9170 118.9513 58.3631 36.8022 173.4364 117 P 4.4892 0.0000 0.0000 62.9861 31.1751 176.9341 118 V 4.4489 8.5447 115.4937 61.1794 33.7165 175.2439 119 H 4.9151 7.7151 119.6468 55.0904 33.3913 171.7690 120 F 4.6179 8.8760 128.5219 57.5098 39.3904 174.3967 121 D 4.5702 8.4034 127.0492 56.0569 41.9410 176.0154 122 A 4.5453 6.4455 117.1716 51.4897 22.2655 174.9208 123 S 5.2255 8.9416 113.7046 56.6690 65.8928 174.6511 124 V 4.1442 8.8194 114.9176 61.6674 32.3540 175.4738 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 4.21 0.00 1.74 1.79 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.45 7.81 2 E 8.65 3.78 0.00 2.13 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 2.41 2.38 0.00 3 T 8.77 4.12 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 8.56 4.00 1.37 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 5 A 8.02 4.16 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 8.03 4.02 1.40 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 0.00 0.00 0.00 7 K 8.38 4.07 0.00 2.02 2.05 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.32 7.81 8 F 8.45 4.11 0.00 3.26 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 8.35 3.99 0.00 2.31 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 0.00 2.51 2.68 0.00 10 R 7.99 3.87 0.00 1.80 2.08 0.00 3.36 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 11 Q 8.15 4.07 0.00 1.56 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.48 0.00 0.00 0.00 0.00 0.00 2.24 2.46 0.00 12 H 8.05 4.69 0.00 1.84 2.57 0.00 5.60 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.89 4.73 0.00 1.97 2.17 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.65 0.00 14 D 9.23 4.72 0.00 2.62 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 15 S 8.46 4.58 0.00 3.93 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 16 S 8.26 4.27 0.00 3.97 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 17 T 7.48 4.71 4.17 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 1.24 0.00 0.00 18 S 8.59 4.17 0.00 3.95 3.98 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 19 A 7.01 4.06 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 20 A 8.06 3.31 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 S 7.47 3.78 0.00 3.87 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 22 S 7.74 4.54 0.00 3.80 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 23 S 8.84 4.21 0.00 4.05 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 24 N 8.14 4.52 0.00 2.85 2.86 0.00 0.00 6.83 7.56 0.00 0.00 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 8.39 4.03 0.00 3.16 2.99 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 26 C 8.53 4.20 0.00 3.18 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 27 N 8.38 4.39 0.00 2.92 2.96 0.00 0.00 6.70 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 7.96 3.90 0.00 2.11 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.27 2.44 0.00 29 M 7.79 3.74 0.00 0.84 1.31 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.46 0.00 30 M 8.07 4.03 0.00 1.71 1.85 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.37 0.00 31 K 7.82 4.02 0.00 2.04 1.96 0.00 1.66 0.00 0.00 1.77 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.30 7.81 32 S 8.13 4.28 0.00 4.02 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 33 R 7.44 4.47 0.00 1.95 2.13 0.00 3.57 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.96 0.00 34 N 7.90 4.29 0.00 2.90 2.95 0.00 0.00 6.82 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 35 L 8.25 4.59 0.00 1.76 1.63 0.78 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.51 5.05 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 8.44 4.11 0.00 1.93 1.91 0.00 1.82 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.46 1.43 7.81 38 D 8.02 4.64 0.00 2.61 2.57 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 0.00 0.00 0.00 0.00 39 R 7.14 3.85 0.00 1.84 1.69 0.00 2.97 0.00 0.00 3.31 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.57 0.00 40 C 8.60 4.86 0.00 3.11 3.16 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 0.00 0.00 0.00 0.00 41 K 8.63 4.17 0.00 1.80 1.81 0.00 1.76 0.00 0.00 1.60 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.42 7.81 42 P 0.00 4.76 0.00 2.15 2.10 0.00 3.90 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.95 0.00 43 V 7.55 4.95 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 0.80 0.00 0.00 0.97 0.00 0.00 44 N 9.23 4.65 0.00 2.62 2.26 0.00 0.00 6.79 6.98 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 45 T 7.95 4.76 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 0.92 0.00 0.00 46 F 8.88 4.87 0.00 2.96 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 47 V 8.95 4.50 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 1.12 0.00 0.00 1.04 0.00 0.00 48 H 8.67 5.52 0.00 3.11 3.43 0.00 5.61 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.70 4.82 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 2.25 2.25 0.00 50 S 8.42 4.31 0.00 4.07 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 51 L 8.55 3.99 0.00 1.83 1.74 1.02 1.27 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 52 A 8.08 4.02 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 7.94 4.34 0.00 2.84 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 54 V 7.82 3.79 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 1.06 0.00 0.00 55 Q 8.56 3.93 0.00 2.26 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.34 2.55 0.00 56 A 8.11 4.07 1.39 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 0.00 0.00 57 V 7.63 3.42 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 0.99 0.00 0.00 0.96 0.00 0.00 58 C 7.78 3.75 0.00 2.85 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 59 S 7.53 4.72 0.00 3.91 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 60 Q 7.23 4.08 0.00 1.64 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.96 0.00 0.00 0.00 0.00 0.00 1.77 2.14 0.00 61 K 8.47 4.35 0.00 2.06 1.83 0.00 1.75 0.00 0.00 1.61 0.00 0.00 2.81 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.51 7.81 62 N 8.75 4.38 0.00 2.74 2.64 0.00 0.00 7.00 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 8.39 4.58 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 0.69 0.00 0.00 0.80 0.00 0.00 64 A 8.41 4.12 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 8.98 4.74 0.00 3.12 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 66 K 8.99 3.74 0.00 1.90 1.90 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.11 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.39 7.81 67 N 8.04 4.52 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 8.08 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 69 Q 8.42 4.25 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 70 T 8.24 4.71 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 1.17 0.00 0.00 71 N 8.04 5.02 0.00 3.08 3.15 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 7.56 5.32 0.00 2.97 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 73 Y 8.75 5.06 0.00 2.81 2.84 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 74 Q 9.14 4.99 0.00 2.04 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.99 0.00 0.00 0.00 0.00 0.00 2.30 2.27 0.00 75 S 8.88 4.51 0.00 3.91 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 76 Y 9.21 4.52 0.00 3.02 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 77 S 7.84 4.84 0.00 3.91 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 78 T 8.06 4.09 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 1.03 0.00 0.00 79 M 9.01 5.04 0.00 1.94 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 2.53 2.48 0.00 80 S 9.52 4.81 0.00 3.89 3.98 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 81 I 9.07 5.15 1.94 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 1.36 0.56 1.04 0.00 0.00 82 T 8.82 4.94 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 1.22 0.00 0.00 83 D 9.30 4.89 0.00 2.59 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 84 C 9.14 5.46 0.00 2.94 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 85 R 8.78 5.22 0.00 1.94 1.79 0.00 3.13 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 86 E 9.65 4.14 0.00 2.07 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 2.09 1.83 0.00 87 T 8.71 4.17 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 1.23 0.00 0.00 88 G 8.55 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.33 4.49 0.00 4.03 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 90 S 7.31 4.10 0.00 3.78 3.82 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 91 K 8.32 4.31 0.00 1.82 1.59 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.37 1.39 7.81 92 Y 8.80 4.33 0.00 2.96 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 93 P 0.00 3.31 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 1.75 1.73 0.00 94 N 7.78 4.63 0.00 2.82 2.76 0.00 0.00 6.98 7.16 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 95 C 7.89 4.51 0.00 3.11 3.10 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 0.00 96 A 8.68 5.02 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 97 Y 9.50 5.09 0.00 2.94 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 98 K 9.02 4.44 0.00 1.74 1.78 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.59 7.81 99 T 8.56 4.98 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 1.28 0.00 0.00 100 T 8.80 4.54 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 8.78 4.64 0.00 1.97 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.76 0.00 0.00 0.00 0.00 0.00 2.28 2.40 0.00 102 A 9.04 4.72 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 8.73 5.38 0.00 2.58 2.75 0.00 0.00 6.71 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 8.80 4.77 0.00 1.73 1.83 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.45 7.81 105 H 9.10 4.92 0.00 3.10 3.35 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 8.65 4.83 1.86 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.26 1.14 0.00 0.00 107 I 8.25 4.96 1.75 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 1.15 0.71 0.83 0.00 0.00 108 V 8.64 4.78 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 0.73 0.00 0.00 0.86 0.00 0.00 109 A 8.73 4.94 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 8.74 5.10 0.00 2.08 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 0.00 111 E 8.75 4.70 0.00 1.99 1.69 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 2.25 2.33 0.00 112 G 9.48 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 0.00 0.00 0.00 113 N 8.19 5.00 0.00 2.66 2.71 0.00 0.00 6.90 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 4.33 0.00 2.23 2.05 0.00 3.82 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 115 Y 8.25 5.21 0.00 2.81 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 7.92 4.45 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 0.76 0.00 0.00 0.90 0.00 0.00 117 P 0.00 4.49 0.00 0.49 0.97 0.00 3.36 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 118 V 8.54 4.45 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 0.65 0.00 0.00 0.93 0.00 0.00 119 H 7.72 4.92 0.00 3.21 3.11 0.00 5.66 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.88 4.62 0.00 2.76 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 0.00 121 D 8.40 4.57 0.00 2.58 2.55 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 0.00 0.00 0.00 0.00 122 A 6.45 4.55 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 0.00 123 S 8.94 5.23 0.00 4.07 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 0.00 124 V 8.82 4.14 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 0.74 0.00 0.00 0.93 0.00 0.00