NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.5452 8.2649 122.4707 52.3934 19.2311 175.0248 2 T 4.2819 8.8439 118.0249 62.4618 70.4269 172.2784 3 K 5.3356 8.9583 125.2542 54.9095 37.2264 174.5891 4 A 5.3869 9.0034 123.4483 50.9957 23.3964 175.2770 5 V 4.9864 8.8648 117.6236 60.5842 35.5213 173.7271 6 C 4.9923 9.3360 122.3343 57.9049 35.3203 172.6367 7 V 4.5621 8.4581 125.9983 61.5972 32.8675 174.1579 8 L 4.8803 8.8053 129.2941 53.6773 43.6011 176.1346 9 K 5.0788 8.8525 122.0304 55.0310 36.7513 175.6806 10 G 4.9024 8.4426 109.4643 46.3869 0.0000 172.2001 11 D 4.7488 8.9313 120.2655 53.3333 40.9788 177.6212 12 G 4.8348 7.9712 122.5419 46.4862 0.0000 170.7353 13 P 4.5172 0.0000 0.0000 61.4705 32.8401 174.8402 14 V 4.5926 8.3780 120.8205 61.7859 33.4377 174.7206 15 Q 5.0154 8.8851 125.9861 54.4788 33.2080 174.1812 16 G 4.5102 9.0681 109.6156 44.8593 0.0000 171.4409 17 I 5.1146 8.4719 121.5522 59.2832 40.7751 174.6099 18 I 4.7033 8.7010 127.6421 59.4275 40.4687 174.2861 19 N 4.9613 8.4663 124.4870 51.3136 41.1538 173.9521 20 F 5.3412 8.7785 120.2216 55.8140 43.3712 173.7046 21 E 5.2798 9.5858 122.9807 54.9146 33.5622 173.6887 22 Q 4.7578 9.4526 127.7468 54.2788 31.2144 175.6199 23 K 4.0559 9.0034 127.2044 58.9018 32.6661 177.6708 24 E 4.8134 7.7788 116.2999 54.2609 33.3819 176.5383 25 S 4.2615 8.7398 116.3848 60.7360 63.3965 174.5913 26 N 4.6863 8.2212 117.0593 52.4722 37.3033 174.3832 27 G 4.1274 7.9227 108.5539 42.9684 0.0000 171.4286 28 P 4.6904 0.0000 0.0000 62.6439 32.7780 175.6706 29 V 4.6079 8.9278 120.8711 61.2769 33.6363 174.6332 30 K 4.8684 9.1936 128.3512 55.8601 33.6998 175.9415 31 V 4.9618 9.2291 125.5009 60.8101 34.1200 174.2689 32 W 6.1304 8.3103 123.9815 54.7243 32.0515 175.7898 33 G 4.1547 7.5663 105.6680 45.9891 0.0000 170.8126 34 S 5.0585 7.8309 113.3690 56.6961 66.5082 174.1439 35 I 5.0767 8.9486 126.8507 59.3184 40.3785 174.7282 36 K 4.8466 9.4221 126.0932 55.5455 35.8860 177.0213 37 G 3.8339 8.9927 107.9299 46.6887 0.0000 173.4569 38 V 4.3563 7.3770 112.6221 58.9482 34.0797 175.5201 39 T 4.3179 8.1132 111.2399 61.0503 69.4009 174.1216 40 E 4.1339 8.5243 124.2130 57.3437 30.3976 175.1199 41 G 3.7174 8.5251 110.7993 43.8636 0.0000 172.4368 42 L 4.7669 8.1578 118.6035 54.7624 42.8742 176.6685 43 H 5.0196 9.1686 119.1315 53.7224 32.8207 173.4360 44 G 4.1052 9.0917 111.0863 46.8655 0.0000 172.5962 45 F 5.3971 8.6917 124.3781 57.2827 42.3219 172.8786 46 H 5.0410 8.8153 122.6195 54.1775 33.9850 172.6525 47 V 4.4477 8.5670 121.0022 62.5143 32.4267 175.0471 48 H 5.1547 9.4043 125.2362 54.1911 31.0513 175.7090 49 E 3.8609 8.9509 122.0495 58.6887 29.7435 177.1876 50 F 5.1218 8.1108 117.7894 55.7957 41.2999 175.9057 51 G 4.1629 8.4776 111.7388 44.7525 0.0000 173.5192 52 D 4.8638 8.1457 119.1203 52.4753 42.8776 174.9869 53 N 5.2829 8.4575 124.9494 53.0971 39.8031 176.9400 54 T 3.7541 8.7608 111.1498 64.5594 68.6709 174.9814 55 A 4.5277 8.0090 122.4959 51.4788 19.5184 176.0851 56 G 3.8729 7.6473 105.3000 45.5997 0.0000 174.2446 57 C 4.3381 8.8577 114.5823 60.0523 35.0028 175.9349 58 T 3.7546 7.9757 113.6914 65.1493 66.6419 175.8822 59 S 4.2923 7.7932 115.6067 60.7770 63.0763 175.8975 60 A 4.4751 7.5929 125.0043 54.2511 18.3049 178.4624 61 G 4.1389 8.2753 104.9519 44.5866 0.0000 170.6014 62 P 4.7092 0.0000 0.0000 61.9143 33.9010 175.3344 63 H 4.4045 8.4453 116.5488 55.6690 29.4997 175.6476 64 F 4.2192 9.0218 125.5773 58.2004 40.2341 175.1954 65 N 5.1055 7.8564 125.6507 51.6827 38.8874 173.1106 66 P 4.1854 0.0000 0.0000 64.8251 32.0510 177.7743 67 L 4.4062 7.5180 116.7466 53.7194 42.2345 175.9813 68 S 3.6197 7.5280 113.1303 59.8180 60.4936 171.6732 69 R 4.4840 8.1538 118.6996 54.6067 32.2048 176.3036 70 K 4.4679 8.1990 117.4289 55.6145 34.0095 176.3322 71 H 4.0174 8.6186 122.7547 57.1289 30.4719 174.6992 72 G 3.9938 7.9441 109.8335 45.6480 0.0000 172.4034 73 G 4.0999 9.1080 109.7228 43.5747 0.0000 173.2714 74 P 4.3944 0.0000 0.0000 65.5991 31.2366 178.1118 75 K 4.1478 7.9291 116.6543 58.2663 32.3435 176.9821 76 D 4.6066 7.6111 118.9921 53.5391 41.5556 176.2417 77 E 3.9916 8.7542 123.6711 59.3512 29.8037 177.3922 78 E 4.2858 7.8587 119.7892 55.3014 28.0045 175.5915 79 R 4.8406 7.5168 117.5859 53.7412 33.1086 175.2086 80 H 4.4586 9.0730 116.3232 55.2532 29.4167 176.9721 81 V 3.4651 8.3602 122.5947 66.4451 31.2927 177.2787 82 G 3.8529 8.2446 104.7695 47.4665 0.0000 173.3721 83 D 4.9503 8.1584 121.1588 53.8411 40.3385 175.6810 84 L 4.5987 8.4052 122.6327 53.0466 42.8757 178.1556 85 G 4.1034 8.5383 110.2071 46.5058 0.0000 174.7893 86 N 5.5981 8.6945 120.3289 51.3207 41.9820 173.1847 87 V 4.3034 8.6929 115.0951 60.1204 34.3068 174.9818 88 T 4.9832 8.2812 119.0191 61.8817 71.2891 172.9696 89 A 4.9641 8.8689 128.7666 50.3285 22.0292 176.7128 90 D 4.8326 8.2946 119.8555 51.9685 41.3664 177.3810 91 K 3.9653 8.5503 117.5591 59.8805 31.9170 178.1223 92 D 4.4032 8.0967 116.1455 55.1413 41.2331 177.0284 93 G 4.3196 8.4421 108.3637 44.3841 0.0000 172.4261 94 V 4.8376 8.0128 119.8267 60.7080 33.9307 174.2232 95 A 5.1459 9.1889 129.8129 49.4961 21.2664 174.5744 96 D 5.1035 8.6741 122.8493 52.9343 42.8155 176.1246 97 V 4.2514 9.0863 123.9736 61.1502 34.1067 174.7122 98 S 4.9713 8.5575 122.8166 57.6449 63.9312 172.6133 99 I 4.7749 9.2443 128.0877 59.1818 41.1153 174.0989 100 E 5.2053 8.8970 126.1383 54.4773 32.0315 174.4154 101 D 4.9921 9.5208 125.9506 52.8972 44.3771 176.1062 102 S 4.7017 9.0373 120.0158 59.0659 63.8982 174.9506 103 V 4.1532 7.9715 119.1621 64.0226 32.5277 176.2280 104 I 4.0649 7.8766 111.6833 61.0347 38.2360 174.6971 105 S 4.6891 8.4825 114.7607 57.3534 65.5459 174.0462 106 L 4.4235 8.9709 122.6005 54.0749 41.4913 176.1941 107 S 4.4011 7.9870 112.7064 58.3842 66.1466 174.9312 108 G 3.8397 8.4546 108.6921 44.8181 0.0000 173.3655 109 D 4.4709 8.6337 116.7874 56.8576 41.5250 177.1924 110 H 5.0755 8.1107 115.5402 55.7827 28.9627 173.9441 111 C 4.6091 7.8928 120.8549 59.5082 31.9416 173.4506 112 I 3.8427 8.0390 118.9888 60.4815 38.1776 175.6474 113 I 3.6658 7.3048 123.2418 62.9721 37.4948 176.1480 114 G 3.8072 9.3865 113.9087 45.1983 0.0000 172.6612 115 R 4.9491 7.4665 118.6696 54.7260 33.7120 174.6638 116 T 4.9609 7.8746 115.0996 62.0203 70.9039 173.9577 117 L 4.7452 8.5391 128.7004 54.0692 43.9844 175.3457 118 V 4.9385 8.8509 126.0855 61.0039 34.9157 174.2011 119 V 5.0001 8.5863 127.1258 60.5842 33.6438 174.8141 120 H 5.2688 8.8832 121.0297 54.0936 30.6904 174.6233 121 E 4.2058 9.1264 121.8588 59.0866 29.9968 176.5414 122 K 4.8219 8.4605 116.7747 53.7234 36.8163 175.7045 123 A 4.3607 8.3867 123.3784 52.3904 18.8393 176.1809 124 D 4.8660 9.3703 122.3530 53.4370 41.6420 176.3388 125 D 4.5247 9.0769 125.9315 53.6315 39.7777 176.6979 126 L 3.4323 9.1993 119.4617 56.1503 39.2574 175.4240 127 G 3.9249 8.6082 104.0154 46.3042 0.0000 174.9265 128 K 4.3531 7.9311 117.3188 55.8921 32.2792 177.2494 129 G 4.0422 7.2447 108.9293 44.2017 0.0000 173.9244 130 G 3.6602 8.6498 107.4656 47.4102 0.0000 173.3950 131 N 4.9384 7.6483 116.3747 50.6098 40.0551 174.1042 132 E 4.1272 8.5312 114.6723 59.3526 30.1501 178.8464 133 E 3.9698 8.1650 119.0431 59.0982 29.0762 178.7750 134 S 4.1036 7.8983 112.4072 61.2807 62.3285 175.4265 135 T 4.3630 7.9524 110.1719 62.1010 68.6964 175.4664 136 K 4.2788 7.6954 119.4155 57.9243 34.0640 176.7165 137 T 4.0709 7.9479 106.6112 60.0476 70.3379 175.2832 138 G 4.4730 8.0433 110.1541 45.5193 0.0000 173.4978 139 N 4.1971 7.4942 112.6012 54.0989 36.5291 174.9642 140 A 4.6062 7.0382 118.9314 51.3069 20.2540 179.5022 141 G 3.9826 7.9874 103.2778 44.9490 0.0000 172.8196 142 S 4.5117 8.9781 116.7525 58.3611 65.1605 173.7187 143 R 4.5266 8.3224 118.9704 54.9312 30.4341 176.6277 144 L 4.3737 8.9285 125.3072 57.1453 43.2378 176.9541 145 A 5.1142 7.7281 117.8803 51.3167 22.8659 174.0351 146 C 5.4323 8.1466 113.5450 55.6288 46.1267 172.6035 147 G 4.6198 8.0674 103.7535 46.2817 0.0000 172.6729 148 V 4.5268 8.3302 120.7358 62.2026 32.8246 175.4203 149 I 4.2104 8.8428 129.1056 60.8503 38.1478 175.3049 150 G 4.4569 8.9977 114.3265 43.9789 0.0000 172.2513 151 I 4.3380 8.2973 121.4864 61.0323 37.7624 175.3808 152 A 4.9390 8.5413 127.6823 49.7303 22.3055 176.3387 153 Q 4.1131 8.5097 115.7752 56.4869 29.0451 176.0434 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 A 8.26 4.55 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 2 T 8.84 4.28 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 3 K 8.96 5.34 0.00 1.86 1.71 0.00 1.89 0.00 0.00 1.95 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.65 7.81 4 A 9.00 5.39 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 5 V 8.86 4.99 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 0.84 0.00 0.00 0.94 0.00 0.00 6 C 9.34 4.99 0.00 3.13 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 7 V 8.46 4.56 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 8 L 8.81 4.88 0.00 1.71 1.58 1.03 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.85 5.08 0.00 1.65 1.62 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.37 7.81 10 G 8.44 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 11 D 8.93 4.75 0.00 2.68 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 12 G 7.97 4.83 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 13 P 0.00 4.52 0.00 2.30 2.17 0.00 3.41 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 2.06 2.06 0.00 14 V 8.38 4.59 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 0.97 0.00 0.00 1.03 0.00 0.00 15 Q 8.89 5.02 0.00 2.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.46 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 16 G 9.07 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 17 I 8.47 5.11 1.81 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 1.20 0.63 0.82 0.00 0.00 18 I 8.70 4.70 1.82 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.23 0.45 0.00 0.00 19 N 8.47 4.96 0.00 1.44 1.42 0.00 0.00 6.38 8.37 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 20 F 8.78 5.34 0.00 2.91 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 21 E 9.59 5.28 0.00 2.47 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 22 Q 9.45 4.76 0.00 2.18 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.57 0.00 0.00 0.00 0.00 0.00 2.44 2.53 0.00 23 K 9.00 4.06 0.00 1.81 1.88 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.47 1.50 7.81 24 E 7.78 4.81 0.00 2.02 1.94 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 2.30 2.35 0.00 25 S 8.74 4.26 0.00 3.99 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 26 N 8.22 4.69 0.00 2.83 2.95 0.00 0.00 5.84 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 27 G 7.92 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.69 0.00 2.14 2.11 0.00 3.77 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 29 V 8.93 4.61 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 1.07 0.00 0.00 1.05 0.00 0.00 30 K 9.19 4.87 0.00 1.95 1.79 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.63 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.50 1.54 7.81 31 V 9.23 4.96 2.17 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 0.74 0.00 0.00 1.12 0.00 0.00 32 W 8.31 6.13 0.00 3.49 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 33 G 7.57 4.15 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 0.00 34 S 7.83 5.06 0.00 3.84 3.62 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 35 I 8.95 5.08 1.78 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.69 0.87 0.00 0.00 36 K 9.42 4.85 0.00 1.75 1.86 0.00 1.29 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.33 7.81 37 G 8.99 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 38 V 7.38 4.36 1.77 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 0.64 0.00 0.00 0.84 0.00 0.00 39 T 8.11 4.32 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 1.24 0.00 0.00 40 E 8.52 4.13 0.00 2.05 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 2.29 2.43 0.00 41 G 8.53 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 0.00 0.00 0.00 42 L 8.16 4.77 0.00 1.50 1.74 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.17 5.02 0.00 3.02 3.29 0.00 5.63 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 44 G 9.09 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 45 F 8.69 5.40 0.00 3.01 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 46 H 8.82 5.04 0.00 3.07 3.10 0.00 5.85 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 47 V 8.57 4.45 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 0.84 0.00 0.00 0.88 0.00 0.00 48 H 9.40 5.15 0.00 3.15 3.40 0.00 5.67 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.95 3.86 0.00 1.64 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 1.51 2.14 0.00 50 F 8.11 5.12 0.00 3.16 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 51 G 8.48 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 52 D 8.15 4.86 0.00 2.61 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 53 N 8.46 5.28 0.00 2.74 2.74 0.00 0.00 6.84 7.05 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 54 T 8.76 3.75 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 1.21 0.00 0.00 55 A 8.01 4.53 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 56 G 7.65 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 0.00 0.00 0.00 57 C 8.86 4.34 0.00 2.98 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 58 T 7.98 3.75 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 1.22 0.00 0.00 59 S 7.79 4.29 0.00 4.08 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 60 A 7.59 4.48 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 61 G 8.28 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 62 P 0.00 4.71 0.00 2.03 2.19 0.00 3.66 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.97 0.00 63 H 8.45 4.40 0.00 2.80 3.16 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.02 4.22 0.00 2.86 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 65 N 7.86 5.11 0.00 2.59 2.43 0.00 0.00 6.93 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 66 P 0.00 4.19 0.00 2.04 1.87 0.00 2.99 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 1.48 1.09 0.00 67 L 7.52 4.41 0.00 1.53 1.66 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.53 3.62 0.00 4.00 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 69 R 8.15 4.48 0.00 1.88 2.06 0.00 3.11 0.00 0.00 3.53 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.52 0.00 70 K 8.20 4.47 0.00 1.67 1.68 0.00 1.66 0.00 0.00 1.73 0.00 0.00 2.77 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.48 1.41 7.81 71 H 8.62 4.02 0.00 3.17 3.24 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 72 G 7.94 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 0.00 0.00 0.00 73 G 9.11 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 74 P 0.00 4.39 0.00 2.23 2.26 0.00 3.80 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.06 0.00 75 K 7.93 4.15 0.00 1.77 1.92 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.47 7.81 76 D 7.61 4.61 0.00 2.74 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 77 E 8.75 3.99 0.00 1.90 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 2.28 2.38 0.00 78 E 7.86 4.29 0.00 1.97 1.87 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 2.29 2.21 0.00 79 R 7.52 4.84 0.00 1.91 1.88 0.00 2.82 0.00 0.00 3.91 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 80 H 9.07 4.46 0.00 3.47 3.37 0.00 5.66 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 81 V 8.36 3.47 1.50 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 0.84 0.00 0.00 0.48 0.00 0.00 82 G 8.24 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 83 D 8.16 4.95 0.00 2.71 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 84 L 8.41 4.60 0.00 1.73 1.86 0.87 0.99 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 85 G 8.54 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 86 N 8.69 5.60 0.00 2.59 2.70 0.00 0.00 6.67 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 87 V 8.69 4.30 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 -0.16 0.00 0.00 0.84 0.00 0.00 88 T 8.28 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 89 A 8.87 4.96 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 90 D 8.29 4.83 0.00 2.95 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 91 K 8.55 3.97 0.00 1.76 1.93 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.18 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.60 1.42 7.81 92 D 8.10 4.40 0.00 2.83 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 93 G 8.44 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 0.00 0.00 0.00 0.00 94 V 8.01 4.84 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 0.92 0.00 0.00 0.92 0.00 0.00 95 A 9.19 5.15 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 96 D 8.67 5.10 0.00 2.55 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 97 V 9.09 4.25 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 0.81 0.00 0.00 0.59 0.00 0.00 98 S 8.56 4.97 0.00 3.90 3.73 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 0.00 0.00 0.00 99 I 9.24 4.77 1.99 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.64 1.03 0.00 0.00 100 E 8.90 5.21 0.00 1.97 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.31 0.00 101 D 9.52 4.99 0.00 2.83 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 S 9.04 4.70 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 0.00 103 V 7.97 4.15 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 0.84 0.00 0.00 0.95 0.00 0.00 104 I 7.88 4.06 1.94 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 1.49 0.81 1.04 0.00 0.00 105 S 8.48 4.69 0.00 3.82 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 0.00 106 L 8.97 4.42 0.00 1.74 1.61 1.03 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.99 4.40 0.00 3.90 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 0.00 108 G 8.45 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 D 8.63 4.47 0.00 2.66 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 0.00 110 H 8.11 5.08 0.00 3.28 3.42 0.00 5.69 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 0.00 111 C 7.89 4.61 0.00 2.93 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 0.00 112 I 8.04 3.84 1.60 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.12 0.95 0.00 0.00 113 I 7.30 3.67 1.77 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 1.19 0.35 0.83 0.00 0.00 114 G 9.39 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 0.00 0.00 0.00 115 R 7.47 4.95 0.00 1.63 1.84 0.00 2.21 0.00 0.00 2.38 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.23 0.00 116 T 7.87 4.96 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 1.18 0.00 0.00 117 L 8.54 4.75 0.00 1.80 1.54 0.51 0.66 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 0.00 118 V 8.85 4.94 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 0.72 0.00 0.00 0.73 0.00 0.00 119 V 8.59 5.00 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 0.71 0.00 0.00 1.01 0.00 0.00 120 H 8.88 5.27 0.00 3.32 3.58 0.00 5.67 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.13 4.21 0.00 2.02 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 0.00 2.37 2.35 0.00 122 K 8.46 4.82 0.00 1.76 1.67 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.38 7.81 123 A 8.39 4.36 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 0.00 124 D 9.37 4.87 0.00 2.70 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 D 9.08 4.52 0.00 2.95 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 0.00 126 L 9.20 3.43 0.00 1.80 1.84 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.61 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 0.00 128 K 7.93 4.35 0.00 1.87 1.84 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.58 1.51 7.81 129 G 7.24 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 0.00 130 G 8.65 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 N 7.65 4.94 0.00 2.95 2.86 0.00 0.00 6.04 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 0.00 132 E 8.53 4.13 0.00 2.21 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 0.00 2.35 2.38 0.00 133 E 8.17 3.97 0.00 2.07 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 2.39 2.41 0.00 134 S 7.90 4.10 0.00 4.10 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 0.00 135 T 7.95 4.36 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 1.21 0.00 0.00 136 K 7.70 4.28 0.00 1.66 1.79 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.09 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.31 1.43 7.81 137 T 7.95 4.07 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 1.12 0.00 0.00 138 G 8.04 4.47 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 N 7.49 4.20 0.00 3.01 2.90 0.00 0.00 6.79 7.23 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 0.00 140 A 7.04 4.61 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 0.00 141 G 7.99 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 0.00 0.00 0.00 142 S 8.98 4.51 0.00 3.92 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 R 8.32 4.53 0.00 1.68 1.83 0.00 3.19 0.00 0.00 3.13 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.65 0.00 144 L 8.93 4.37 0.00 1.70 1.69 0.94 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.73 5.11 1.20 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 0.00 146 C 8.15 5.43 0.00 3.06 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 0.00 147 G 8.07 4.62 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 0.00 0.00 0.00 148 V 8.33 4.53 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 0.77 0.00 0.00 0.96 0.00 0.00 149 I 8.84 4.21 1.79 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.51 0.40 0.00 0.00 150 G 9.00 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 0.00 0.00 0.00 0.00 151 I 8.30 4.34 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 1.24 0.54 0.90 0.00 0.00 152 A 8.54 4.94 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 0.00 153 Q 8.51 4.11 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.60 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00