NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.4253 8.2649 122.4715 51.5517 21.0233 175.9658 3 T 4.5407 7.9551 113.7830 61.6134 71.4192 172.0850 4 K 5.2930 8.9554 125.1560 54.8165 37.2956 174.5577 5 A 5.4661 8.9643 123.6538 50.7599 23.4366 175.0100 6 V 4.9646 8.8853 117.4128 61.1308 35.4902 173.3969 7 C 4.8311 9.0528 121.7601 58.3356 35.0270 172.8963 8 V 4.4409 8.4827 126.7538 61.5263 32.2914 174.4688 9 L 4.6077 8.7261 129.7461 54.6279 42.7336 176.7200 10 K 4.8487 9.0734 122.2971 55.7109 37.3678 175.3551 11 G 4.1707 7.9260 107.0722 46.9605 0.0000 172.8547 12 D 4.5898 9.0876 119.1049 56.3664 41.0557 176.6540 13 G 4.4045 7.5861 108.8570 43.6082 0.0000 171.5863 14 P 4.0238 0.0000 0.0000 64.4499 31.9074 176.5951 15 V 4.0931 7.0721 120.6916 63.0936 31.8383 175.1167 16 Q 4.7261 8.4098 124.6794 55.3318 32.5165 173.3396 17 G 4.2032 7.7813 106.7868 46.4758 0.0000 171.7471 18 I 5.0946 7.6785 119.9818 59.3698 40.7845 175.1817 19 I 4.7174 8.7813 127.1862 59.5289 40.5834 174.4476 20 N 4.8396 8.8049 124.9653 51.6001 40.9954 174.0266 21 F 5.4108 8.8404 119.4338 55.9843 43.5288 174.3578 22 E 5.0004 9.4204 123.4340 55.6258 33.1123 173.6207 23 Q 4.8072 8.9437 130.2183 54.3703 30.1751 176.3714 24 K 4.1774 8.9124 127.3692 58.7853 32.6702 177.7892 25 E 4.7569 7.8345 117.1258 54.0288 33.2271 176.2618 26 S 3.9364 9.0406 118.0612 61.3973 62.7546 175.0504 27 N 4.5605 8.1699 115.0300 52.8030 37.7285 174.4621 28 G 4.0933 8.2850 109.5536 43.1515 0.0000 171.2689 29 P 4.6893 0.0000 0.0000 62.5188 32.8876 175.9139 30 V 4.5719 8.8385 121.2242 61.1445 33.6162 174.8108 31 K 4.6741 8.9275 128.6025 56.1856 33.5116 176.1808 32 V 4.8591 9.0139 125.2756 60.7906 34.0001 174.2904 33 W 5.5257 8.6805 123.9486 54.8917 32.2604 175.4805 34 G 3.7971 7.2151 105.9727 46.1005 0.0000 170.5265 35 S 4.8666 7.7691 114.6041 56.9520 65.7122 174.2460 36 I 4.7988 8.4930 128.4105 59.5359 39.8536 174.9138 37 K 4.8362 9.0003 124.2831 55.8547 36.6745 176.7387 38 G 3.7696 8.8475 106.1711 45.9451 0.0000 173.1859 39 L 4.4988 7.7775 119.7472 52.7141 43.0216 176.5041 40 T 4.2836 8.2985 112.9267 61.1650 69.3700 173.8763 41 E 4.0208 8.6928 126.0341 57.3552 30.6930 175.0160 42 G 3.8456 8.5021 110.7117 44.0391 0.0000 172.6217 43 L 4.7054 8.2611 119.9470 55.0230 42.8453 176.5287 44 H 5.0902 9.3881 119.1495 53.7240 33.2621 173.4547 45 G 4.0334 8.8937 110.0914 46.8835 0.0000 172.9696 46 F 5.0572 8.4036 125.0142 57.7265 41.8577 172.5444 47 H 5.2770 8.8740 122.7736 53.8063 33.6801 172.8573 48 V 4.3217 8.6233 121.7796 62.4848 32.2358 175.2520 49 H 5.1062 9.4177 125.7631 54.6082 30.6733 176.1499 50 E 3.7335 8.9285 121.7156 59.1000 29.5827 177.0244 51 F 5.0403 7.9644 118.4725 55.8429 40.7875 176.4133 52 G 4.1425 8.4988 113.0213 44.8649 0.0000 173.0913 53 D 4.7700 8.1133 119.0353 52.4042 42.7311 174.8358 54 N 5.2032 8.4418 122.5877 52.7544 39.2456 175.5314 55 T 3.7093 8.2315 113.0969 66.4833 69.0497 175.4166 56 A 4.5998 8.8823 125.6316 51.7185 19.9521 177.9223 57 G 3.9044 7.8223 110.7981 46.7208 0.0000 174.7280 58 C 4.3379 8.6576 115.1696 60.0795 36.8097 175.7406 59 T 3.7769 7.9216 117.1969 66.6578 67.7876 176.4424 60 S 4.1803 8.0818 115.4950 61.0306 63.1800 175.8553 61 A 4.5183 7.5072 124.9531 54.2155 18.1784 178.5403 62 G 4.1972 8.0304 105.6996 44.3976 0.0000 170.5338 63 P 4.7662 0.0000 0.0000 61.8444 34.1950 174.9321 64 H 4.2152 8.6251 116.5484 55.9207 29.3930 175.5387 65 F 4.2682 9.0238 125.9705 58.3193 40.1044 174.7742 66 N 5.1541 7.9853 125.3953 51.7278 39.0086 172.6702 67 P 4.1527 0.0000 0.0000 64.7151 32.4124 177.9700 68 L 4.3269 7.6479 117.1080 53.7631 41.7783 176.3844 69 S 3.6000 7.3428 113.5692 59.9184 60.7049 171.6057 70 R 4.5477 8.0511 117.8239 54.4066 32.6528 176.2504 71 K 4.4794 7.9413 118.3356 55.7383 33.2707 177.0391 72 H 3.9516 8.8969 122.6781 56.8857 30.6069 174.4493 73 G 3.8821 7.5925 108.8327 45.8867 0.0000 172.9705 74 G 4.0506 8.5362 109.2654 43.8901 0.0000 173.3604 75 P 4.2812 0.0000 0.0000 65.4890 31.5111 178.2342 76 K 4.1270 7.9977 117.3622 58.8106 32.3079 177.4176 77 D 4.4539 7.4115 118.2904 54.4565 41.3681 176.3298 78 E 3.9616 8.7799 124.3097 59.3117 29.8459 177.4747 79 E 4.2123 7.8591 121.7237 55.5692 27.8355 175.1827 80 R 4.6925 7.6197 119.3673 54.0464 33.1452 175.1601 81 H 4.4724 8.7479 115.8746 55.3008 29.4221 177.0477 82 V 3.4284 8.3488 122.6427 66.1095 31.3995 177.2575 83 G 3.9075 8.1535 106.3321 46.0997 0.0000 173.1892 84 D 4.7716 7.7001 120.7626 54.0049 39.0541 175.8356 85 L 4.4717 8.2183 121.3750 54.1245 43.2957 178.8293 86 G 4.0680 7.9205 108.4444 46.5641 0.0000 174.1230 87 N 5.6414 8.7066 121.1567 51.3516 41.7764 173.5465 88 V 4.4537 9.0614 113.5847 59.9138 35.6121 174.7389 89 T 4.9785 8.3828 119.7897 61.8995 70.9153 173.0198 90 A 5.0933 9.1239 129.0693 50.4355 21.2329 176.0088 91 D 4.7502 9.8166 122.9377 53.1102 41.4986 179.1708 92 K 4.7170 7.9973 117.2215 59.3474 32.7562 176.6373 93 D 4.6001 7.8973 116.2244 53.5911 39.4975 177.3591 94 G 4.3958 9.1508 109.4699 44.7020 0.0000 173.9890 95 V 4.3632 7.4850 119.9477 62.3704 33.5057 174.9974 96 A 4.8924 9.0044 126.5668 49.3105 21.7546 175.2030 97 D 4.9268 8.7085 123.0750 53.7095 40.5868 176.0011 98 V 3.6118 8.3317 123.7501 62.9311 32.9053 175.1950 99 S 4.6709 8.5573 122.0587 57.5365 63.3594 172.6071 100 I 4.6876 9.0280 126.2749 59.0189 40.5722 173.9436 101 E 5.0695 8.6295 124.2859 54.7282 32.3004 174.1077 102 D 5.0206 9.1942 125.5825 52.9065 44.8395 175.8068 103 S 4.8667 8.8599 117.6207 58.6086 65.0904 175.8623 104 V 3.8422 8.1116 119.8720 65.3222 31.6212 176.4620 105 I 4.0857 7.4821 110.9697 61.1540 38.1836 174.7826 106 S 4.6477 8.1853 113.8298 57.5490 65.0758 173.9696 107 L 4.6877 8.2900 124.4656 54.1721 41.4464 176.7994 108 S 4.5242 7.9450 111.9243 58.6111 66.5232 176.0304 109 G 3.8458 8.6681 109.2526 44.5693 0.0000 173.3391 110 D 4.3650 8.8032 117.8149 57.8699 41.2092 177.9869 111 H 4.8033 8.1145 112.5546 55.6766 28.8608 174.4519 112 C 4.2641 8.0229 121.4903 60.0044 31.5108 173.5294 113 I 3.7742 8.5824 120.7375 61.2359 38.0214 175.9282 114 I 3.7179 7.2543 123.1855 62.7490 37.3373 176.2540 115 G 3.8307 9.0505 113.2696 45.1572 0.0000 172.6584 116 R 4.7710 7.4676 118.3446 54.5930 33.8485 174.6691 117 T 4.8216 7.8447 115.3981 62.3231 70.4707 174.5448 118 L 4.6599 8.5566 128.3927 54.5274 44.3850 175.7197 119 V 4.9404 8.3835 124.3196 61.7564 35.0326 173.6772 120 V 4.9806 8.7948 127.9617 60.9028 33.7027 174.7010 121 H 5.0348 8.5752 118.9731 53.9226 31.7431 173.3530 122 E 4.0501 9.2784 121.1500 59.0303 29.4111 178.1716 123 K 4.5944 8.5965 117.6781 54.6089 34.9908 175.0004 124 A 4.5405 8.2609 122.9885 51.6365 19.3588 176.2956 125 D 4.9532 9.1934 122.4627 54.0481 41.8215 176.0833 126 D 4.5926 9.2248 125.6476 53.1522 39.5760 176.5640 127 L 3.7433 9.1429 118.3324 56.0709 39.6529 175.9142 128 G 4.0685 8.8117 106.4683 45.7360 0.0000 174.7478 129 K 4.4839 7.7184 118.1019 56.5294 32.1915 178.2523 130 G 3.6589 7.8944 110.9219 46.4153 0.0000 175.2939 131 G 4.0527 8.4234 107.6652 45.2124 0.0000 173.3040 132 N 4.7083 7.5502 115.7247 51.4491 39.0508 175.3772 133 E 4.0389 8.7541 118.0196 59.6376 29.5865 178.3139 134 E 3.9618 8.1662 118.5931 59.0870 29.5778 178.4025 135 S 4.0898 9.2295 113.9575 61.3928 62.3541 175.7591 136 T 4.1145 7.8739 117.3895 65.1745 67.9485 174.8318 137 K 4.3577 7.9665 118.0143 57.2136 34.4765 177.2064 138 T 3.8768 7.6577 108.3714 61.2124 70.0099 175.9061 139 G 3.7830 7.9187 110.2231 44.8712 0.0000 173.2892 140 N 4.3333 7.8323 113.8362 54.1155 36.7703 174.8534 141 A 4.4755 7.4285 118.4483 51.4259 19.4958 179.8228 142 G 4.1046 7.9788 104.2879 44.5887 0.0000 173.1259 143 S 4.4003 8.5718 114.6574 58.5298 64.9088 173.8520 144 R 4.4135 8.2514 119.2352 54.9963 29.9637 176.8672 145 L 4.2562 8.5552 125.2364 57.2477 42.7394 177.3028 146 A 5.0721 7.7638 119.1100 50.8349 22.8922 173.5007 147 C 5.1202 9.2902 114.7799 54.8856 46.6279 172.7880 148 G 4.4974 8.3402 103.1213 46.0776 0.0000 172.9868 149 V 4.4099 8.3698 122.3432 62.3711 32.7572 175.5087 150 I 4.0470 9.0616 129.4305 60.9419 38.1824 175.2840 151 G 4.5107 9.0577 113.8924 43.9810 0.0000 171.8792 152 I 4.3645 8.3598 121.8835 61.0201 37.6569 175.4100 153 A 4.8275 8.2670 127.5514 49.6375 22.2495 176.0751 154 Q 4.0698 8.5147 118.6942 56.4488 29.2187 175.9514 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 2 A 8.26 4.43 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 3 T 7.96 4.54 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 1.22 0.00 0.00 4 K 8.96 5.29 0.00 1.71 1.72 0.00 1.87 0.00 0.00 1.98 0.00 0.00 3.09 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.49 7.81 5 A 8.96 5.47 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 6 V 8.89 4.96 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 0.80 0.00 0.00 0.91 0.00 0.00 7 C 9.05 4.83 0.00 3.08 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 8 V 8.48 4.44 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 0.93 0.00 0.00 0.92 0.00 0.00 9 L 8.73 4.61 0.00 1.80 1.60 1.04 0.47 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 10 K 9.07 4.85 0.00 1.64 1.63 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.39 7.81 11 G 7.93 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 0.00 0.00 0.00 0.00 12 D 9.09 4.59 0.00 2.68 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 13 G 7.59 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.02 0.00 2.18 2.18 0.00 3.77 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 1.98 1.94 0.00 15 V 7.07 4.09 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 0.74 0.00 0.00 0.98 0.00 0.00 16 Q 8.41 4.73 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.55 0.00 0.00 0.00 0.00 0.00 2.43 2.30 0.00 17 G 7.78 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 0.00 0.00 0.00 0.00 18 I 7.68 5.09 1.81 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 1.20 1.24 0.80 0.00 0.00 19 I 8.78 4.72 1.88 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 1.24 1.17 0.56 0.00 0.00 20 N 8.80 4.84 0.00 1.44 1.42 0.00 0.00 6.42 8.01 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 21 F 8.84 5.41 0.00 2.93 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 22 E 9.42 5.00 0.00 2.46 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 0.00 2.32 2.40 0.00 23 Q 8.94 4.81 0.00 2.26 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.58 0.00 0.00 0.00 0.00 0.00 2.42 2.52 0.00 24 K 8.91 4.18 0.00 1.81 1.88 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.47 1.48 7.81 25 E 7.83 4.76 0.00 1.98 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 2.30 2.28 0.00 26 S 9.04 3.94 0.00 3.98 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 27 N 8.17 4.56 0.00 2.85 2.97 0.00 0.00 5.86 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 28 G 8.29 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 0.00 0.00 0.00 0.00 29 P 0.00 4.69 0.00 2.13 2.09 0.00 3.76 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 30 V 8.84 4.57 2.22 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 1.22 0.00 0.00 1.03 0.00 0.00 31 K 8.93 4.67 0.00 1.91 1.82 0.00 1.56 0.00 0.00 1.47 0.00 0.00 2.92 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.49 1.42 7.81 32 V 9.01 4.86 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 0.82 0.00 0.00 1.01 0.00 0.00 33 W 8.68 5.53 0.00 3.50 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 34 G 7.22 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 0.00 0.00 0.00 35 S 7.77 4.87 0.00 3.89 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 36 I 8.49 4.80 1.77 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.34 0.92 0.00 0.00 37 K 9.00 4.84 0.00 1.70 1.84 0.00 1.34 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.29 1.41 7.81 38 G 8.85 3.77 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 0.00 0.00 0.00 39 L 7.78 4.50 0.00 1.88 1.51 0.81 0.13 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 T 8.30 4.28 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 1.27 0.00 0.00 41 E 8.69 4.02 0.00 1.95 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 2.30 2.46 0.00 42 G 8.50 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 43 L 8.26 4.71 0.00 1.50 1.59 0.91 0.93 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 44 H 9.39 5.09 0.00 2.96 3.15 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 G 8.89 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 0.00 0.00 0.00 46 F 8.40 5.06 0.00 2.98 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 47 H 8.87 5.28 0.00 3.04 3.01 0.00 5.85 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 8.62 4.32 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 0.92 0.00 0.00 0.89 0.00 0.00 49 H 9.42 5.11 0.00 3.05 3.42 0.00 5.69 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.93 3.73 0.00 1.65 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 2.09 0.00 51 F 7.96 5.04 0.00 3.24 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 52 G 8.50 4.14 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 53 D 8.11 4.77 0.00 2.62 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 N 8.44 5.20 0.00 2.79 2.69 0.00 0.00 7.65 7.22 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 55 T 8.23 3.71 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 1.19 0.00 0.00 56 A 8.88 4.60 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 57 G 7.82 3.90 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 58 C 8.66 4.34 0.00 2.96 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 59 T 7.92 3.78 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 1.23 0.00 0.00 60 S 8.08 4.18 0.00 4.01 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 61 A 7.51 4.52 1.41 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 0.00 0.00 0.00 62 G 8.03 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 0.00 0.00 0.00 0.00 63 P 0.00 4.77 0.00 2.07 2.23 0.00 3.61 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.98 0.00 64 H 8.63 4.22 0.00 2.84 3.22 0.00 5.73 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 F 9.02 4.27 0.00 2.85 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 66 N 7.99 5.15 0.00 2.59 2.43 0.00 0.00 6.94 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 67 P 0.00 4.15 0.00 2.07 1.94 0.00 3.15 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.21 0.00 68 L 7.65 4.33 0.00 1.56 1.67 0.91 0.89 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 69 S 7.34 3.60 0.00 3.91 3.88 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 70 R 8.05 4.55 0.00 1.89 1.96 0.00 3.16 0.00 0.00 3.27 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 71 K 7.94 4.48 0.00 1.57 1.70 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.51 7.81 72 H 8.90 3.95 0.00 3.13 3.12 0.00 5.98 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 G 7.59 3.88 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 0.00 0.00 0.00 74 G 8.54 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 P 0.00 4.28 0.00 2.22 2.34 0.00 3.79 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.04 0.00 76 K 8.00 4.13 0.00 1.77 1.92 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.47 7.81 77 D 7.41 4.45 0.00 2.78 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 78 E 8.78 3.96 0.00 1.92 1.95 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 2.27 2.28 0.00 79 E 7.86 4.21 0.00 1.92 1.85 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 2.26 2.31 0.00 80 R 7.62 4.69 0.00 1.82 1.88 0.00 3.36 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.60 0.00 81 H 8.75 4.47 0.00 3.54 3.38 0.00 5.65 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 V 8.35 3.43 1.51 0.00 0.00 0.00 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 0.53 0.00 0.00 83 G 8.15 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 0.00 0.00 0.00 84 D 7.70 4.77 0.00 2.84 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 L 8.22 4.47 0.00 1.79 1.80 0.88 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 86 G 7.92 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 0.00 0.00 0.00 87 N 8.71 5.64 0.00 2.61 2.73 0.00 0.00 6.53 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 88 V 9.06 4.45 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 -0.13 0.00 0.00 0.75 0.00 0.00 89 T 8.38 4.98 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 1.20 0.00 0.00 90 A 9.12 5.09 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 91 D 9.82 4.75 0.00 2.71 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 K 8.00 4.72 0.00 1.79 1.83 0.00 1.76 0.00 0.00 1.90 0.00 0.00 3.06 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.43 1.43 7.81 93 D 7.90 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 94 G 9.15 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 V 7.48 4.36 2.21 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 0.94 0.00 0.00 0.92 0.00 0.00 96 A 9.00 4.89 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 97 D 8.71 4.93 0.00 2.56 2.66 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 98 V 8.33 3.61 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 0.78 0.00 0.00 0.59 0.00 0.00 99 S 8.56 4.67 0.00 3.92 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 0.00 100 I 9.03 4.69 1.99 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.73 1.00 0.00 0.00 101 E 8.63 5.07 0.00 1.95 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 2.21 2.32 0.00 102 D 9.19 5.02 0.00 2.88 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.86 4.87 0.00 3.89 3.88 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 0.00 104 V 8.11 3.84 2.22 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 0.78 0.00 0.00 0.94 0.00 0.00 105 I 7.48 4.09 1.95 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.81 1.07 0.00 0.00 106 S 8.19 4.65 0.00 3.89 3.74 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 0.00 107 L 8.29 4.69 0.00 1.82 1.64 1.02 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 108 S 7.95 4.52 0.00 3.89 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 0.00 109 G 8.67 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 0.00 110 D 8.80 4.36 0.00 2.65 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 0.00 111 H 8.11 4.80 0.00 3.20 3.37 0.00 5.79 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 C 8.02 4.26 0.00 3.21 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 0.00 113 I 8.58 3.77 1.64 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.18 0.94 0.00 0.00 114 I 7.25 3.72 1.78 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 1.19 0.38 0.83 0.00 0.00 115 G 9.05 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 0.00 116 R 7.47 4.77 0.00 1.61 1.80 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.31 0.00 117 T 7.84 4.82 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 1.24 0.00 0.00 118 L 8.56 4.66 0.00 1.83 1.56 0.53 0.62 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 0.00 119 V 8.38 4.94 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 0.84 0.00 0.00 0.78 0.00 0.00 120 V 8.79 4.98 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 0.86 0.00 0.00 1.00 0.00 0.00 121 H 8.58 5.03 0.00 3.22 3.53 0.00 5.66 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 9.28 4.05 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 123 K 8.60 4.59 0.00 1.79 1.75 0.00 1.89 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.42 7.81 124 A 8.26 4.54 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 0.00 125 D 9.19 4.95 0.00 2.73 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 0.00 126 D 9.22 4.59 0.00 2.95 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 0.00 127 L 9.14 3.74 0.00 1.83 1.78 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.81 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 0.00 0.00 0.00 129 K 7.72 4.48 0.00 1.80 1.83 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.50 7.81 130 G 7.89 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 0.00 0.00 0.00 131 G 8.42 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 N 7.55 4.71 0.00 2.84 2.85 0.00 0.00 5.97 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 0.00 133 E 8.75 4.04 0.00 2.10 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 2.37 2.43 0.00 134 E 8.17 3.96 0.00 2.11 1.92 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 2.37 2.41 0.00 135 S 9.23 4.09 0.00 4.15 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 0.00 136 T 7.87 4.11 4.46 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 0.00 0.00 0.00 1.20 0.00 0.00 137 K 7.97 4.36 0.00 1.81 1.71 0.00 1.67 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.32 7.81 138 T 7.66 3.88 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 0.00 139 G 7.92 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 N 7.83 4.33 0.00 3.08 2.91 0.00 0.00 6.85 6.88 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 0.00 141 A 7.43 4.48 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 0.00 142 G 7.98 4.10 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 0.00 0.00 0.00 143 S 8.57 4.40 0.00 3.93 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 R 8.25 4.41 0.00 1.66 1.86 0.00 3.18 0.00 0.00 3.13 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.58 0.00 145 L 8.56 4.26 0.00 1.54 1.69 0.96 0.72 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 0.00 146 A 7.76 5.07 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 0.00 147 C 9.29 5.12 0.00 3.06 3.13 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 0.00 148 G 8.34 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 V 8.37 4.41 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 0.82 0.00 0.00 0.93 0.00 0.00 150 I 9.06 4.05 1.86 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.74 0.47 0.00 0.00 151 G 9.06 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 I 8.36 4.36 1.86 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 1.25 0.54 0.91 0.00 0.00 153 A 8.27 4.83 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 0.00 154 Q 8.51 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00