NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 P 4.3911 0.0000 0.0000 62.6592 33.6976 176.8503 5 T 3.7052 7.8499 108.0092 61.6881 69.0090 172.9687 6 I 3.6381 9.4919 127.9154 64.6340 38.8606 178.3316 7 N 4.4901 8.3859 117.4118 54.2780 37.8715 177.4501 8 Q 3.7272 7.2917 123.4616 59.9042 30.3526 177.6611 9 L 3.8651 8.3752 121.2032 58.0304 41.7385 178.1400 10 V 4.2891 7.4197 117.2347 61.8790 31.9519 177.6285 11 R 4.0315 8.1785 120.2242 59.6423 30.1133 177.7902 12 K 4.0641 7.6722 117.0374 59.0322 32.3900 177.0475 13 G 4.1721 6.0604 104.2355 44.0021 0.0000 170.6964 14 R 4.1787 7.3507 119.3403 52.8272 32.8709 180.0487 15 E 3.8921 8.0043 121.5566 55.5448 28.7254 172.1013 16 K 4.5613 8.0667 116.9192 56.1388 35.2200 175.5822 17 V 4.2679 8.1788 113.3776 60.8801 33.6386 173.9835 18 R 4.7352 7.9871 118.3677 54.7698 33.7576 174.3523 19 K 4.6412 8.2859 117.7760 54.8183 35.3605 175.2982 20 K 4.4491 8.3652 122.2751 54.5985 33.9806 175.9870 21 S 3.9837 8.8305 117.4890 58.8105 62.3423 174.3592 22 K 4.0579 8.7536 125.9808 57.6616 32.3441 176.9434 23 V 4.9228 7.6474 119.9743 59.8925 31.2293 174.1755 24 P 4.1509 0.0000 0.0000 65.7719 31.1942 177.7398 25 A 4.6226 8.1449 117.0938 51.5924 20.6043 178.9563 26 L 3.3319 8.3593 116.8253 54.1114 41.3098 174.1363 27 K 3.7792 8.5488 135.0000 57.5851 30.2929 175.9122 28 G 3.6085 7.8522 114.1457 45.5755 0.0000 167.3156 29 A 3.2719 7.9638 134.2393 50.6107 16.2822 174.1720 30 P 3.9954 0.0000 0.0000 61.3495 31.2296 174.5812 31 F 4.5760 6.8819 109.2392 56.2668 40.1817 173.9805 32 R 4.4957 7.8628 120.2322 55.1117 35.8923 173.7932 33 R 4.0222 8.4231 121.5256 56.8054 31.1344 175.9268 34 G 4.9500 8.3492 113.0576 43.5831 0.0000 171.3260 35 V 4.2404 7.9713 118.9604 60.5544 33.9902 174.1700 36 C 3.9878 8.7424 128.3559 61.1701 31.7715 172.1274 37 T 4.3389 8.5995 121.1545 64.4670 70.1963 175.5385 38 V 4.2079 7.3899 127.4898 60.9824 33.7305 173.1795 39 V 4.0473 8.3653 126.8942 62.8500 31.0443 174.8734 40 R 4.3396 8.5110 124.7865 55.5375 34.1141 173.9256 41 T 4.4895 8.7583 121.2675 62.4380 68.5841 172.7321 42 V 4.5977 8.2976 123.8970 60.6789 35.8187 173.1942 43 T 4.9228 8.5693 115.3046 58.5663 68.0548 172.4261 44 P 5.0798 0.0000 0.0000 62.5120 32.1954 175.0999 45 K 4.5156 8.9668 114.7881 56.7697 31.6865 177.4915 46 K 3.9497 9.3386 120.2099 58.9971 32.7905 176.0676 47 P 4.5167 0.0000 0.0000 62.5194 30.8652 175.2655 48 N 4.3249 7.2907 114.5354 54.3208 42.8645 173.8118 49 S 4.6739 8.5822 111.9746 58.4107 62.7481 172.2560 50 A 5.0009 7.7819 121.4845 50.0693 22.7198 175.5390 51 L 5.0825 8.3229 114.3872 52.8499 45.2005 177.3112 52 R 4.5688 9.0188 120.1258 55.0025 34.9990 174.7542 53 K 3.9640 8.9921 124.1124 57.4961 33.1962 176.5076 54 V 4.5507 7.9131 116.1483 59.9429 36.8408 173.6819 55 A 5.5330 7.7953 121.6585 52.7884 23.2435 175.0412 56 K 4.9919 8.0607 116.4694 55.3283 36.6177 175.7939 57 V 5.2913 8.3378 119.2773 63.0047 35.2475 173.1134 58 R 5.3095 8.4362 124.5380 54.3184 31.4549 175.6699 59 L 4.0785 9.0589 126.4596 56.6828 42.5300 178.3279 60 T 4.2727 8.2135 122.9089 68.2238 68.4094 175.3328 61 S 4.1150 8.0127 116.0639 60.3356 63.5884 174.2081 62 G 4.2919 6.1491 118.9619 46.3248 0.0000 169.7808 63 Y 5.0765 7.3250 118.4636 56.3098 42.0506 175.7162 64 E 4.9282 8.3997 116.5799 56.2490 30.0728 176.1876 65 V 4.2184 7.7995 112.8343 61.8798 34.0025 176.0773 66 T 4.7629 8.3647 112.4566 61.5352 70.2396 173.5779 67 A 4.8190 7.8433 119.6895 52.0010 23.0595 174.6932 68 Y 4.5696 8.8684 121.7873 55.7723 41.3552 174.9296 69 I 4.1557 6.3886 126.3139 58.8973 38.2504 174.5439 70 P 4.7044 0.0000 0.0000 64.1366 33.1936 176.5353 71 G 3.8135 8.4730 105.5304 46.7508 0.0000 172.7657 72 E 4.6478 8.3701 123.9954 55.7877 33.5405 175.4444 73 G 3.9675 8.7842 108.8349 47.0373 0.0000 174.3914 74 H 4.3021 6.5285 109.1760 53.4842 32.5128 174.4545 75 N 4.8258 8.1163 110.9680 52.3778 39.3144 177.0030 76 L 4.3275 7.4692 123.2742 54.0651 43.0243 175.7001 77 Q 4.0206 8.9724 116.2108 57.3900 30.1869 179.4857 78 E 2.9755 8.0064 114.0841 56.1480 31.0089 176.7468 79 H 5.6606 8.1515 117.6052 53.3250 30.6356 173.8781 80 S 4.0347 8.5796 125.1374 60.4643 61.8500 176.3757 81 V 4.4054 5.4500 115.0640 61.0463 36.8232 173.5834 82 V 4.2083 7.1386 121.0311 61.3716 35.2369 170.2843 83 L 4.8334 8.0565 123.2292 53.2552 44.4705 174.9485 84 I 4.8146 8.1214 118.4699 59.5415 40.4992 176.1328 85 R 4.1185 10.1295 119.3141 58.8398 30.5703 177.1183 86 G 3.7511 8.5670 104.4496 42.2081 0.0000 169.7493 87 G 3.4951 9.3833 105.9658 44.4968 0.0000 172.3287 88 R 4.7241 8.1375 126.5102 55.0865 31.0572 176.8505 89 V 4.4433 8.2602 116.9725 59.8195 34.5145 174.4975 90 K 4.6116 8.5030 119.2786 55.7871 35.0982 176.5290 91 D 4.8037 10.6100 120.6242 54.2946 40.8387 175.0480 92 L 4.5549 7.2797 115.6234 54.4861 40.9051 173.9675 93 P 4.3443 0.0000 0.0000 63.9414 32.2194 177.4451 94 G 4.2016 9.4877 106.0453 44.8981 0.0000 174.3692 95 V 4.3758 7.5300 117.7745 60.8593 34.6534 173.9733 96 R 4.3894 8.2881 124.8036 56.3596 31.0481 174.0375 97 Y 4.8451 8.3380 118.9803 57.1074 39.3728 169.3097 98 H 5.5763 8.6482 119.8368 54.8310 31.9079 172.8663 99 I 4.8041 8.5321 119.4413 60.3508 41.9077 176.1665 100 V 4.4639 8.0790 123.7363 61.1797 33.9084 174.5210 101 R 4.3674 9.1424 124.5807 53.9650 31.0907 174.7938 102 G 3.3521 8.0949 113.4355 45.1566 0.0000 174.5382 103 V 4.3194 6.8380 121.4955 62.1412 32.3396 174.5655 104 Y 3.9422 9.3992 111.2363 60.8954 36.5379 178.5518 105 D 4.3895 6.0500 124.5974 55.8990 41.8428 176.4092 106 A 3.9631 9.0147 125.1661 52.1781 18.6461 177.3468 107 A 4.8165 7.9151 123.7590 51.3295 20.6567 178.1663 108 G 3.5215 9.0442 101.5492 45.4268 0.0000 173.2909 109 V 3.0207 7.6693 120.1152 62.3777 29.8220 174.3745 110 K 3.5834 8.9301 130.4088 59.0029 32.8353 176.6887 111 D 4.2265 8.6112 122.5261 54.5998 37.6574 174.8782 112 R 4.3455 7.3808 120.2824 55.9410 32.2186 174.1603 113 K 4.4559 8.5282 124.1899 55.9121 33.2737 176.7826 114 K 4.0146 7.7881 120.3649 57.0782 33.5327 175.9950 115 S 3.6595 8.1671 116.8058 62.6598 60.4040 174.1137 116 R 4.2599 7.2664 121.5636 61.2462 30.9899 178.4837 117 S 4.1012 8.4759 110.9475 62.1289 61.8803 175.5669 118 K 3.6238 6.7333 115.5256 58.3892 33.3692 175.8595 119 Y 5.0042 7.4544 114.4167 56.9988 39.9928 174.7864 120 G 4.1034 9.0432 109.9377 45.6794 0.0000 171.1790 121 T 4.4012 7.7868 112.5420 62.5172 72.4753 172.9667 122 K 4.8615 8.6824 125.6376 54.5788 34.4526 176.6159 123 K 4.3909 8.4002 123.5286 54.4404 31.2445 174.2975 124 P 4.5295 0.0000 0.0000 64.0390 32.3844 178.1247 125 K 4.5419 7.5250 121.8469 52.9587 32.9075 174.8323 126 E 4.7210 8.2338 118.7090 54.0972 32.3559 176.9326 127 A 4.2330 8.2536 122.2791 52.5670 19.4199 175.9362 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 4 P 0.00 4.39 0.00 2.06 2.17 0.00 3.84 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.08 0.00 5 T 7.85 3.71 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 6 I 9.49 3.64 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.54 0.91 0.00 0.00 7 N 8.39 4.49 0.00 2.75 2.63 0.00 0.00 6.71 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 8 Q 7.29 3.73 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.66 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 9 L 8.38 3.87 0.00 1.81 1.88 0.98 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.42 4.29 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 0.87 0.00 0.00 0.93 0.00 0.00 11 R 8.18 4.03 0.00 1.83 2.14 0.00 3.26 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 12 K 7.67 4.06 0.00 1.79 1.85 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.47 1.43 7.81 13 G 6.06 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 14 R 7.35 4.18 0.00 1.75 1.77 0.00 3.50 0.00 0.00 3.22 7.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 15 E 8.00 3.89 0.00 2.15 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 2.19 2.38 0.00 16 K 8.07 4.56 0.00 1.68 1.71 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.33 1.43 7.81 17 V 8.18 4.27 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 0.73 0.00 0.00 0.93 0.00 0.00 18 R 7.99 4.74 0.00 1.74 1.82 0.00 3.15 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 19 K 8.29 4.64 0.00 1.65 1.61 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.31 1.40 7.81 20 K 8.37 4.45 0.00 1.88 1.79 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.76 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.31 1.39 7.81 21 S 8.83 3.98 0.00 3.85 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 22 K 8.75 4.06 0.00 1.84 1.88 0.00 1.99 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.40 7.81 23 V 7.65 4.92 2.18 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 1.29 0.00 0.00 0.96 0.00 0.00 24 P 0.00 4.15 0.00 2.10 2.09 0.00 3.71 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 1.66 1.94 0.00 25 A 8.14 4.62 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 26 L 8.36 3.33 0.00 1.84 0.91 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 27 K 8.55 3.78 0.00 1.78 1.79 0.00 1.77 0.00 0.00 1.45 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.15 1.36 7.81 28 G 7.85 3.61 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 0.00 0.00 0.00 29 A 7.96 3.27 1.07 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 30 P 0.00 4.00 0.00 1.90 1.87 0.00 3.50 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.04 0.00 31 F 6.88 4.58 0.00 2.88 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 32 R 7.86 4.50 0.00 1.67 1.76 0.00 3.03 0.00 0.00 3.00 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.52 0.00 33 R 8.42 4.02 0.00 1.97 1.82 0.00 3.04 0.00 0.00 3.14 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.44 0.00 34 G 8.35 4.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 V 7.97 4.24 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 0.96 0.00 0.00 0.89 0.00 0.00 36 C 8.74 3.99 0.00 2.95 2.73 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 37 T 8.60 4.34 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 1.21 0.00 0.00 38 V 7.39 4.21 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 0.99 0.00 0.00 0.94 0.00 0.00 39 V 8.37 4.05 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 1.11 0.00 0.00 40 R 8.51 4.34 0.00 1.86 1.69 0.00 3.15 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.44 0.00 41 T 8.76 4.49 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 42 V 8.30 4.60 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 0.77 0.00 0.00 0.95 0.00 0.00 43 T 8.57 4.92 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 44 P 0.00 5.08 0.00 2.29 1.69 0.00 3.82 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 45 K 8.97 4.52 0.00 1.64 1.39 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.55 1.27 7.81 46 K 9.34 3.95 0.00 1.84 1.82 0.00 1.60 0.00 0.00 1.86 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.49 7.81 47 P 0.00 4.52 0.00 2.21 2.11 0.00 4.04 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.97 0.00 48 N 7.29 4.32 0.00 2.69 2.79 0.00 0.00 6.53 6.85 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 49 S 8.58 4.67 0.00 3.77 3.76 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 50 A 7.78 5.00 1.29 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 0.00 0.00 51 L 8.32 5.08 0.00 1.50 1.58 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 52 R 9.02 4.57 0.00 1.98 2.17 0.00 3.23 0.00 0.00 3.34 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.73 0.00 53 K 8.99 3.96 0.00 1.61 1.63 0.00 1.48 0.00 0.00 1.79 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.45 7.81 54 V 7.91 4.55 2.19 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 1.06 0.00 0.00 1.02 0.00 0.00 55 A 7.80 5.53 1.17 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 56 K 8.06 4.99 0.00 1.68 1.79 0.00 1.72 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.41 7.81 57 V 8.34 5.29 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 0.78 0.00 0.00 0.95 0.00 0.00 58 R 8.44 5.31 0.00 1.85 1.86 0.00 3.65 0.00 0.00 3.24 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.63 0.00 59 L 9.06 4.08 0.00 1.63 1.45 0.35 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 60 T 8.21 4.27 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 1.17 0.00 0.00 61 S 8.01 4.12 0.00 3.54 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 62 G 6.15 4.29 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 0.00 0.00 0.00 63 Y 7.33 5.08 0.00 2.92 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 64 E 8.40 4.93 0.00 2.03 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 2.16 2.22 0.00 65 V 7.80 4.22 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 0.81 0.00 0.00 1.08 0.00 0.00 66 T 8.36 4.76 4.29 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 1.23 0.00 0.00 67 A 7.84 4.82 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 68 Y 8.87 4.57 0.00 2.92 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 I 6.39 4.16 1.68 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 1.17 0.56 0.79 0.00 0.00 70 P 0.00 4.70 0.00 2.33 2.32 0.00 3.83 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 71 G 8.47 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 72 E 8.37 4.65 0.00 1.93 1.82 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 2.23 2.31 0.00 73 G 8.78 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 H 6.53 4.30 0.00 3.29 2.70 0.00 5.48 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 N 8.12 4.83 0.00 2.75 2.67 0.00 0.00 5.66 7.79 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 76 L 7.47 4.33 0.00 1.67 1.64 0.93 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 77 Q 8.97 4.02 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.45 0.00 0.00 0.00 0.00 0.00 2.30 2.42 0.00 78 E 8.01 2.98 0.00 2.00 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 2.30 0.00 79 H 8.15 5.66 0.00 3.37 3.38 0.00 5.13 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.58 4.03 0.00 3.94 3.69 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 0.00 0.00 0.00 81 V 5.45 4.41 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 0.63 0.00 0.00 0.96 0.00 0.00 82 V 7.14 4.21 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 0.59 0.00 0.00 0.98 0.00 0.00 83 L 8.06 4.83 0.00 1.89 1.66 1.11 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 84 I 8.12 4.81 2.15 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 1.22 1.04 0.92 0.00 0.00 85 R 10.13 4.12 0.00 1.97 2.14 0.00 3.10 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 86 G 8.57 3.75 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 0.00 0.00 0.00 87 G 9.38 3.50 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 88 R 8.14 4.72 0.00 1.70 1.92 0.00 3.16 0.00 0.00 3.77 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.33 0.00 89 V 8.26 4.44 2.01 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 0.70 0.00 0.00 0.84 0.00 0.00 90 K 8.50 4.61 0.00 1.56 1.65 0.00 1.74 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.31 1.38 7.81 91 D 10.61 4.80 0.00 2.68 2.97 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 92 L 7.28 4.55 0.00 1.83 1.72 0.86 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 93 P 0.00 4.34 0.00 2.04 2.12 0.00 3.60 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 94 G 9.49 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 95 V 7.53 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 1.05 0.00 0.00 0.94 0.00 0.00 96 R 8.29 4.39 0.00 1.57 1.28 0.00 3.08 0.00 0.00 3.07 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.45 0.00 97 Y 8.34 4.85 0.00 3.17 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 H 8.65 5.58 0.00 3.41 3.37 0.00 5.79 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 99 I 8.53 4.80 2.02 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.73 0.95 0.00 0.00 100 V 8.08 4.46 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 0.85 0.00 0.00 1.05 0.00 0.00 101 R 9.14 4.37 0.00 1.71 1.66 0.00 3.00 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.50 0.00 102 G 8.09 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 V 6.84 4.32 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 0.70 0.00 0.00 0.93 0.00 0.00 104 Y 9.40 3.94 0.00 2.90 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 0.00 105 D 6.05 4.39 0.00 2.91 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 0.00 106 A 9.01 3.96 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 0.00 107 A 7.92 4.82 1.17 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 0.00 108 G 9.04 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 V 7.67 3.02 2.18 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 0.84 0.00 0.00 1.20 0.00 0.00 110 K 8.93 3.58 0.00 1.73 1.75 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.12 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.44 1.57 7.81 111 D 8.61 4.23 0.00 2.78 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 0.00 112 R 7.38 4.35 0.00 1.93 1.96 0.00 3.23 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 113 K 8.53 4.46 0.00 1.77 1.81 0.00 1.80 0.00 0.00 1.64 0.00 0.00 2.74 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 1.40 7.81 114 K 7.79 4.01 0.00 1.72 1.71 0.00 1.94 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.37 7.81 115 S 8.17 3.66 0.00 4.01 3.76 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 0.00 116 R 7.27 4.26 0.00 1.85 1.92 0.00 3.48 0.00 0.00 3.81 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 117 S 8.48 4.10 0.00 3.80 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 0.00 118 K 6.73 3.62 0.00 1.69 1.61 0.00 1.81 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.25 1.00 7.81 119 Y 7.45 5.00 0.00 3.05 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 G 9.04 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 0.00 121 T 7.79 4.40 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 1.28 0.00 0.00 122 K 8.68 4.86 0.00 1.69 1.69 0.00 1.61 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.33 1.48 7.81 123 K 8.40 4.39 0.00 1.72 2.00 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.34 7.81 124 P 0.00 4.53 0.00 2.17 2.13 0.00 3.71 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.98 0.00 125 K 7.53 4.54 0.00 1.68 1.73 0.00 1.59 0.00 0.00 1.76 0.00 0.00 3.15 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.46 7.81 126 E 8.23 4.72 0.00 2.04 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 2.17 2.21 0.00 127 A 8.25 4.23 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