NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4219 8.3049 118.1937 54.4522 33.3624 175.4675 2 K 4.2650 7.8762 118.7521 54.1902 33.1510 175.1944 3 T 4.3300 8.0852 118.8281 60.5090 68.8410 171.7881 4 F 5.2016 7.5615 121.2289 54.5995 41.8445 175.9257 5 T 4.6670 8.2395 111.0942 61.0275 69.2208 172.7980 6 A 4.3554 8.4706 124.4318 52.5348 19.1519 176.4153 7 K 4.6887 8.0599 116.2435 54.9931 36.9711 174.0326 8 P 5.0609 0.0000 0.0000 62.5686 30.1088 176.5078 9 E 4.7166 8.6097 114.9344 55.8719 30.3109 176.3512 10 T 3.9601 8.3288 113.1899 64.6439 67.6435 174.9744 11 V 3.9381 7.5518 113.6937 61.4566 32.4948 177.1084 12 K 3.9855 8.6400 118.0118 56.8319 29.9047 176.6742 13 R 4.1067 7.5513 119.4110 55.9246 30.1495 175.2382 14 D 4.5757 8.8727 125.4602 52.2989 40.8647 175.7917 15 W 4.9743 8.4121 125.0609 56.7674 29.7455 174.2557 16 Y 4.5779 8.7420 123.9638 55.3947 40.6739 175.4529 17 V 4.2758 7.7890 111.8859 62.5641 37.9473 170.1514 18 V 4.3810 7.4043 120.2204 61.7827 35.1524 177.7026 19 D 4.6860 8.5070 121.3033 52.1751 38.8616 175.3587 20 A 3.8658 8.0449 126.4979 55.7308 18.9003 178.3257 21 T 3.8975 6.7195 109.1561 62.1452 65.5013 168.6013 22 G 3.8295 8.3929 123.9127 44.5638 0.0000 171.1520 23 K 4.6803 8.3207 125.8909 55.6344 33.2529 174.5931 24 T 3.9401 7.9372 117.3835 63.8299 68.7287 174.9322 25 L 4.1563 8.5837 125.7388 57.7491 41.5086 179.4554 26 G 3.4941 8.1263 109.1247 49.0559 0.0000 175.6263 27 R 4.0397 7.8983 115.6449 56.1388 29.6928 177.0297 28 L 4.2696 7.3642 121.6302 56.4184 43.0085 177.8000 29 A 4.0685 7.9488 121.1959 55.4563 18.3160 178.1216 30 T 3.9509 7.5655 109.8863 63.9690 69.3144 173.4400 31 E 3.6281 8.9826 124.9230 56.4123 28.8475 176.4207 32 L 3.0926 8.1928 120.3881 55.3893 40.8179 175.6968 33 A 4.4317 8.5573 120.3146 52.2952 20.5367 177.3834 34 R 4.3462 7.5935 110.5994 56.1149 30.0221 178.1512 35 R 3.9778 7.4125 118.2819 58.5073 32.1248 178.2626 36 L 4.2704 7.8461 116.8881 54.4017 40.3364 180.3071 37 R 3.6659 9.3827 121.0534 58.8155 30.2181 177.4230 38 G 2.9419 6.7173 111.5071 45.2910 0.0000 172.5749 39 K 4.1786 7.0192 116.6041 58.1892 32.9286 177.0810 40 H 4.9977 8.0815 113.1243 54.3430 31.6505 171.7255 41 K 4.5280 7.5938 119.1021 56.3684 35.6214 176.1093 42 A 4.8487 8.3976 119.8080 52.5436 19.3074 176.8054 43 E 4.7273 8.3185 115.9017 57.5648 30.9287 175.3741 44 Y 4.7145 7.9551 120.0981 56.6738 39.1617 174.7708 45 T 3.7915 7.3935 124.3177 64.3010 69.0690 175.0228 46 P 3.7246 0.0000 0.0000 61.1276 34.0361 173.7798 47 H 4.3602 8.6974 119.5478 57.0700 26.9324 175.7645 48 V 3.7368 7.2601 116.9501 62.0105 31.9955 174.7576 49 D 4.6827 8.2728 124.4498 55.0751 41.0449 175.0026 50 T 4.3916 8.1405 110.7576 59.1278 74.8453 174.8852 51 G 3.6437 8.0446 114.2772 46.0986 0.0000 171.6870 52 D 4.4901 8.0213 126.9279 51.5602 42.9642 175.7703 53 Y 4.6271 7.7374 124.0455 56.8300 38.6441 174.7800 54 I 5.8164 7.6229 119.3285 60.2188 41.3574 173.3490 55 I 4.9474 7.4331 120.1781 61.8159 40.8125 173.8908 56 V 3.9322 7.0979 123.5541 60.7077 33.3700 174.6370 57 L 4.1265 8.9100 131.0956 57.6229 41.9309 175.9176 58 N 4.9572 7.8551 114.7642 51.6032 39.6850 174.3294 59 A 4.6874 8.6993 125.2746 51.7512 19.6076 176.7139 60 D 4.5440 7.9777 118.1669 56.0521 40.2231 177.8748 61 K 3.9722 7.8860 118.9787 57.6474 32.5145 175.8946 62 V 3.5320 7.7461 117.1160 63.4361 30.5633 174.6809 63 A 4.5303 8.1760 129.4255 51.0740 20.3382 177.5737 64 V 4.3746 7.7564 113.8916 59.9924 34.1702 176.1566 65 T 4.0476 8.3605 110.4694 62.7182 69.1727 173.8588 66 G 4.1120 8.3337 111.2641 45.6389 0.0000 173.9566 67 N 4.9733 7.9976 115.4386 54.2832 44.8704 175.6738 68 K 4.4068 7.5691 116.2361 55.7302 34.0657 175.0422 69 R 4.6530 8.9368 120.5412 57.3678 30.9140 176.9569 70 T 4.7085 9.0257 116.5924 64.7738 69.3774 175.7914 71 D 4.4970 8.3175 123.3255 55.1033 40.2009 176.5452 72 K 4.4304 7.9014 120.3678 54.2715 33.3087 175.3611 73 V 4.2802 8.2186 125.2221 60.9243 34.4005 173.7708 74 Y 4.7857 7.4195 123.5599 55.3798 39.5918 174.8430 75 Y 4.5976 8.6558 123.5623 56.4824 38.8829 173.9895 76 H 4.6784 8.5418 122.8673 55.1331 29.7496 173.9757 77 H 4.5396 7.5743 121.8165 55.9204 29.4779 173.4796 78 T 4.6395 8.2522 113.5615 61.0664 70.9780 172.3739 79 G 4.0350 8.7073 108.4970 44.1681 0.0000 173.0796 80 H 4.3351 8.9793 118.2094 55.5026 29.6087 175.4040 81 I 4.2401 8.2410 117.2280 59.9550 39.8931 176.1647 82 G 3.9572 9.0198 107.6688 45.8207 0.0000 173.3962 83 G 3.9240 6.8776 104.3943 44.8930 0.0000 172.7476 84 I 4.2460 7.3455 112.9323 58.6819 39.6475 175.6772 85 K 4.3635 8.7482 123.0321 56.8201 33.6206 176.2567 86 Q 3.2769 7.9824 116.6635 56.8787 26.4291 173.0817 87 A 4.6050 7.7050 119.9825 50.1875 19.5695 176.1371 88 T 4.4856 7.8803 111.0998 60.3796 71.5201 175.5063 89 F 4.6082 8.3105 123.0492 57.8437 41.7188 174.7816 90 E 3.9988 7.7073 123.1728 59.5993 29.2017 178.3641 91 E 4.0347 5.9000 116.1926 57.5926 29.8638 177.9849 92 M 4.3358 7.4347 119.9164 58.0968 32.8943 177.2051 93 I 4.1379 7.6694 115.9750 61.7792 38.0513 176.6941 94 A 4.1704 7.7674 120.0222 54.4966 18.2878 178.6085 95 R 3.9649 7.4028 115.7564 57.5971 30.3641 177.8834 96 R 5.2480 7.9865 116.8057 55.1110 29.1493 178.0538 97 P 4.5936 0.0000 0.0000 62.9884 31.9116 174.5956 98 E 4.5982 8.7987 119.8783 57.4641 34.9108 176.0261 99 R 5.0664 7.8091 114.6460 55.0805 29.6634 174.3134 100 V 4.1753 6.5740 117.2693 62.9083 34.3282 177.3368 101 I 3.9482 7.7028 115.5136 61.1005 37.8597 176.1461 102 E 4.5109 7.7333 120.6955 56.7559 31.0981 176.7121 103 I 3.7358 7.7888 119.1496 64.2726 37.2973 176.2797 104 A 4.2911 7.7557 121.6241 52.4362 20.0205 176.6098 105 V 3.4450 8.2817 113.9730 62.5481 30.3957 174.5282 106 K 4.4432 7.8959 119.9194 58.7319 35.2697 177.9894 107 G 3.6009 8.1852 105.9580 47.6478 0.0000 173.4581 108 M 4.3696 7.0806 120.5015 54.0068 31.2508 175.5844 109 L 4.2518 8.1461 124.0103 56.5175 42.7158 177.9474 110 P 4.2355 0.0000 0.0000 65.6296 31.8735 177.7257 111 K 4.3178 7.9502 116.8014 54.9166 33.1315 176.0450 112 G 3.5945 8.0623 109.1563 45.9517 0.0000 171.8742 113 P 3.7842 0.0000 0.0000 62.4927 29.3691 177.9018 114 L 4.5520 8.3286 129.6607 55.4606 40.2010 179.2849 115 G 4.1617 9.3735 109.2341 47.4774 0.0000 175.3689 116 R 4.0610 7.9035 120.8996 59.2687 30.5101 177.8318 117 A 4.1812 7.6357 119.6443 54.2762 18.5703 177.2027 118 M 4.5865 7.4534 117.1469 55.8527 32.2363 176.4877 119 F 4.8213 8.0240 118.9335 59.7039 42.5027 175.6257 120 R 3.9705 7.8297 117.4555 58.8398 29.6691 177.4908 121 K 3.7225 7.7383 116.0485 60.5238 32.4801 178.0360 122 L 4.9976 7.4121 120.2171 55.9040 42.1929 174.8642 123 K 4.5762 8.6469 118.9429 55.3615 36.3057 175.0175 124 V 4.5582 7.6587 115.7351 59.9898 35.5615 174.0985 125 Y 4.7348 7.5018 119.6623 56.3825 41.4632 172.6017 126 A 4.9362 9.0235 123.1672 49.7420 20.9139 176.1276 127 G 4.8980 8.2017 113.5964 45.7761 0.0000 174.5682 128 N 4.3720 7.7747 128.6405 53.0369 40.9577 176.4112 129 E 3.9331 8.4483 116.2197 59.3971 29.6063 178.1848 130 H 4.3728 8.1848 114.7569 57.8919 29.1321 176.3754 131 N 4.1229 7.5706 118.6606 56.4189 38.9851 175.1740 132 H 5.3340 8.1384 117.9572 54.7002 28.8145 175.0007 133 A 4.0814 7.6057 123.7809 54.6020 19.3521 178.1358 134 A 4.0982 7.7709 117.4610 52.3062 19.1440 176.9834 135 Q 3.5121 8.3765 121.0474 55.9047 27.8143 173.6022 136 Q 4.6671 7.7775 110.9879 55.2541 30.5913 174.4041 137 P 4.3850 0.0000 0.0000 63.9540 30.2232 178.5941 138 Q 4.6506 7.8109 131.6906 55.1591 31.1267 173.8891 139 V 5.1553 8.0061 116.0726 61.9125 34.3589 175.4997 140 L 4.7306 8.9477 124.9516 53.8515 45.5823 173.9611 141 D 4.7894 8.3807 119.7718 52.4114 44.1340 175.5011 142 I 3.9483 8.1903 124.0014 61.1699 37.9991 175.1969 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 4.42 0.00 2.15 2.28 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.58 0.00 2 K 7.88 4.26 0.00 1.84 1.85 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.43 1.51 7.81 3 T 8.09 4.33 4.20 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 1.23 0.00 0.00 4 F 7.56 5.20 0.00 3.06 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 5 T 8.24 4.67 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 1.28 0.00 0.00 6 A 8.47 4.36 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 7 K 8.06 4.69 0.00 1.70 1.65 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.31 1.27 7.81 8 P 0.00 5.06 0.00 2.18 1.49 0.00 3.71 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 9 E 8.61 4.72 0.00 1.91 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 2.18 2.28 0.00 10 T 8.33 3.96 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 11 V 7.55 3.94 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 0.76 0.00 0.00 0.95 0.00 0.00 12 K 8.64 3.99 0.00 1.93 1.98 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.40 7.81 13 R 7.55 4.11 0.00 1.93 1.95 0.00 3.30 0.00 0.00 2.80 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.86 0.00 14 D 8.87 4.58 0.00 2.89 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 15 W 8.41 4.97 0.00 3.69 3.37 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 16 Y 8.74 4.58 0.00 3.40 2.74 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 17 V 7.79 4.28 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 0.62 0.00 0.00 0.76 0.00 0.00 18 V 7.40 4.38 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 0.70 0.00 0.00 0.89 0.00 0.00 19 D 8.51 4.69 0.00 2.74 2.71 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 20 A 8.04 3.87 1.27 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 0.00 0.00 0.00 21 T 6.72 3.90 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 1.24 0.00 0.00 22 G 8.39 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 0.00 0.00 0.00 23 K 8.32 4.68 0.00 1.98 1.91 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.89 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.16 1.11 7.81 24 T 7.94 3.94 4.23 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 1.25 0.00 0.00 25 L 8.58 4.16 0.00 1.77 1.91 0.92 0.44 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 26 G 8.13 3.49 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 0.00 0.00 0.00 27 R 7.90 4.04 0.00 1.80 1.95 0.00 3.35 0.00 0.00 3.14 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.55 0.00 28 L 7.36 4.27 0.00 1.52 1.83 0.88 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 29 A 7.95 4.07 1.32 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 0.00 0.00 0.00 30 T 7.57 3.95 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 1.17 0.00 0.00 31 E 8.98 3.63 0.00 2.17 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 2.26 2.32 0.00 32 L 8.19 3.09 0.00 1.70 1.71 0.91 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.56 4.43 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 34 R 7.59 4.35 0.00 1.85 2.05 0.00 2.88 0.00 0.00 3.47 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.47 0.00 35 R 7.41 3.98 0.00 1.29 0.90 0.00 2.90 0.00 0.00 2.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.62 0.00 36 L 7.85 4.27 0.00 1.56 1.11 0.89 0.86 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 37 R 9.38 3.67 0.00 1.98 2.02 0.00 3.30 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.59 0.00 38 G 6.72 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 0.00 0.00 0.00 39 K 7.02 4.18 0.00 1.76 1.62 0.00 1.39 0.00 0.00 2.30 0.00 0.00 3.09 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.53 7.81 40 H 8.08 5.00 0.00 3.14 3.16 0.00 5.79 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 7.59 4.53 0.00 1.84 1.81 0.00 1.50 0.00 0.00 1.90 0.00 0.00 3.10 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.52 7.81 42 A 8.40 4.85 1.30 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 0.00 0.00 0.00 43 E 8.32 4.73 0.00 2.00 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 2.24 2.24 0.00 44 Y 7.96 4.71 0.00 2.82 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 45 T 7.39 3.79 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 1.12 0.00 0.00 46 P 0.00 3.72 0.00 1.87 1.13 0.00 3.63 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 1.80 1.86 0.00 47 H 8.70 4.36 0.00 3.08 3.55 0.00 5.74 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 7.26 3.74 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 0.76 0.00 0.00 49 D 8.27 4.68 0.00 2.69 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 50 T 8.14 4.39 4.28 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 1.45 0.00 0.00 51 G 8.04 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 52 D 8.02 4.49 0.00 2.57 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 53 Y 7.74 4.63 0.00 3.17 3.34 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 54 I 7.62 5.82 1.88 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 1.17 1.20 0.97 0.00 0.00 55 I 7.43 4.95 1.68 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.80 0.64 0.00 0.00 56 V 7.10 3.93 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 0.88 0.00 0.00 0.81 0.00 0.00 57 L 8.91 4.13 0.00 1.79 1.56 0.98 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 58 N 7.86 4.96 0.00 3.12 3.07 0.00 0.00 5.81 7.46 0.00 0.00 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 A 8.70 4.69 1.25 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 0.00 0.00 0.00 0.00 0.00 60 D 7.98 4.54 0.00 2.80 2.81 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 61 K 7.89 3.97 0.00 1.73 1.87 0.00 1.68 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.48 7.81 62 V 7.75 3.53 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 0.82 0.00 0.00 0.99 0.00 0.00 63 A 8.18 4.53 1.25 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 0.00 0.00 0.00 0.00 0.00 64 V 7.76 4.37 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 0.76 0.00 0.00 0.94 0.00 0.00 65 T 8.36 4.05 4.25 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 0.00 0.00 1.22 0.00 0.00 66 G 8.33 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 67 N 8.00 4.97 0.00 2.68 2.80 0.00 0.00 7.21 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 68 K 7.57 4.41 0.00 1.83 2.21 0.00 1.67 0.00 0.00 1.99 0.00 0.00 2.79 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.57 7.81 69 R 8.94 4.65 0.00 1.85 1.81 0.00 3.16 0.00 0.00 3.18 7.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 70 T 9.03 4.71 4.09 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 1.07 0.00 0.00 71 D 8.32 4.50 0.00 2.81 2.81 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 72 K 7.90 4.43 0.00 1.74 1.79 0.00 1.63 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.52 7.81 73 V 8.22 4.28 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 0.81 0.00 0.00 0.92 0.00 0.00 74 Y 7.42 4.79 0.00 3.23 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 75 Y 8.66 4.60 0.00 2.99 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 76 H 8.54 4.68 0.00 3.26 3.20 0.00 6.03 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 7.57 4.54 0.00 3.15 3.16 0.00 5.69 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.25 4.64 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 1.21 0.00 0.00 79 G 8.71 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 80 H 8.98 4.34 0.00 3.31 3.32 0.00 5.52 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 81 I 8.24 4.24 1.98 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.90 1.11 0.00 0.00 82 G 9.02 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 83 G 6.88 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 84 I 7.35 4.25 1.77 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.78 0.87 0.00 0.00 85 K 8.75 4.36 0.00 1.84 2.16 0.00 1.89 0.00 0.00 2.43 0.00 0.00 3.17 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.61 7.81 86 Q 7.98 3.28 0.00 2.08 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.07 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 87 A 7.70 4.61 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 88 T 7.88 4.49 4.35 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 1.29 0.00 0.00 89 F 8.31 4.61 0.00 3.03 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 90 E 7.71 4.00 0.00 1.90 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 2.27 2.27 0.00 91 E 5.90 4.03 0.00 1.95 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 2.36 2.38 0.00 92 M 7.43 4.34 0.00 2.38 2.36 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.80 0.00 93 I 7.67 4.14 2.01 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.17 0.97 0.00 0.00 94 A 7.77 4.17 1.32 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 0.00 0.00 0.00 95 R 7.40 3.96 0.00 1.89 2.01 0.00 3.28 0.00 0.00 3.24 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 96 R 7.99 5.25 0.00 1.86 1.30 0.00 3.12 0.00 0.00 3.22 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.77 0.00 97 P 0.00 4.59 0.00 2.04 1.98 0.00 3.65 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.09 0.00 98 E 8.80 4.60 0.00 2.01 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 2.31 2.41 0.00 99 R 7.81 5.07 0.00 1.67 1.79 0.00 3.36 0.00 0.00 3.31 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.49 0.00 100 V 6.57 4.18 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 0.76 0.00 0.00 0.93 0.00 0.00 101 I 7.70 3.95 1.82 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 1.24 0.43 0.87 0.00 0.00 102 E 7.73 4.51 0.00 1.89 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 0.00 2.30 2.65 0.00 103 I 7.79 3.74 1.92 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 1.31 0.70 0.91 0.00 0.00 104 A 7.76 4.29 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 0.00 105 V 8.28 3.44 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 0.71 0.00 0.00 0.89 0.00 0.00 106 K 7.90 4.44 0.00 2.05 1.99 0.00 1.48 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.32 1.40 7.81 107 G 8.19 3.60 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 0.00 0.00 0.00 108 M 7.08 4.37 0.00 2.10 2.02 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.51 0.00 109 L 8.15 4.25 0.00 1.80 1.69 0.99 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 110 P 0.00 4.24 0.00 2.17 2.17 0.00 3.81 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 111 K 7.95 4.32 0.00 1.72 1.77 0.00 1.91 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.36 7.81 112 G 8.06 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 0.00 0.00 0.00 113 P 0.00 3.78 0.00 2.27 2.25 0.00 3.61 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.07 0.00 114 L 8.33 4.55 0.00 1.85 1.92 0.96 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 115 G 9.37 4.16 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 0.00 0.00 0.00 116 R 7.90 4.06 0.00 1.92 1.93 0.00 3.13 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 117 A 7.64 4.18 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 0.00 118 M 7.45 4.59 0.00 2.28 2.07 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.49 0.00 119 F 8.02 4.82 0.00 2.97 3.06 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 0.00 120 R 7.83 3.97 0.00 2.00 2.00 0.00 3.32 0.00 0.00 3.29 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.73 0.00 121 K 7.74 3.72 0.00 1.80 1.79 0.00 1.89 0.00 0.00 1.91 0.00 0.00 3.13 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.84 1.39 7.81 122 L 7.41 5.00 0.00 1.59 1.75 0.97 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 123 K 8.65 4.58 0.00 1.80 1.50 0.00 1.51 0.00 0.00 1.73 0.00 0.00 2.83 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.49 1.40 7.81 124 V 7.66 4.56 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 0.89 0.00 0.00 125 Y 7.50 4.73 0.00 2.95 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 0.00 126 A 9.02 4.94 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 0.00 127 G 8.20 4.90 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 0.00 0.00 0.00 128 N 7.77 4.37 0.00 2.86 2.23 0.00 0.00 5.96 7.66 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 0.00 129 E 8.45 3.93 0.00 2.09 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 2.44 2.28 0.00 130 H 8.18 4.37 0.00 3.26 3.41 0.00 5.53 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 N 7.57 4.12 0.00 3.00 2.64 0.00 0.00 6.47 8.04 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 0.00 132 H 8.14 5.33 0.00 3.27 3.43 0.00 5.61 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 0.00 133 A 7.61 4.08 1.25 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 0.00 0.00 0.00 0.00 0.00 134 A 7.77 4.10 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 0.00 135 Q 8.38 3.51 0.00 2.28 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 7.54 0.00 0.00 0.00 0.00 0.00 2.12 2.24 0.00 136 Q 7.78 4.67 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 7.09 0.00 0.00 0.00 0.00 0.00 2.07 2.20 0.00 137 P 0.00 4.39 0.00 1.26 1.21 0.00 3.33 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.89 0.00 138 Q 7.81 4.65 0.00 1.94 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.54 6.87 0.00 0.00 0.00 0.00 0.00 1.60 1.99 0.00 139 V 8.01 5.16 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 1.00 0.00 0.00 0.98 0.00 0.00 140 L 8.95 4.73 0.00 1.91 1.59 1.01 1.30 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 0.00 141 D 8.38 4.79 0.00 2.56 2.48 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 0.00 0.00 0.00 0.00 142 I 8.19 3.95 1.79 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.84 0.86 0.00 0.00