NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2644 8.1648 122.9484 50.8637 19.7678 176.3199 3 P 4.1786 0.0000 0.0000 61.8512 31.8428 170.7330 4 V 4.6452 8.8459 120.5040 61.1824 35.2139 174.2781 5 L 4.9167 8.7009 127.2191 52.8839 44.8783 176.3493 6 E 4.9219 8.9606 122.0511 55.6945 31.8064 174.6762 7 N 4.8987 8.4101 118.2921 51.6851 40.6952 175.4937 8 R 3.8578 8.8237 126.5486 59.1619 30.5904 177.1559 9 R 4.4692 7.7529 111.6302 55.7355 29.8913 177.5385 10 A 3.9981 7.7145 123.4759 55.0908 18.3300 179.2622 11 R 4.6731 7.8768 113.2431 56.3282 30.5302 175.9328 12 H 4.6301 7.8086 117.0661 55.7117 30.9172 173.7783 13 D 4.9816 8.0991 114.1636 53.2006 41.3770 175.0067 14 Y 4.5823 8.1026 115.8168 56.5319 40.9408 174.4794 15 E 4.7353 8.6193 123.9193 54.3425 33.1825 174.1921 16 I 4.7438 8.3017 126.7894 59.7676 38.6030 175.1842 17 L 4.1996 8.9527 130.7649 57.6386 42.6619 176.6607 18 E 4.7966 7.8706 117.8773 54.8120 33.2296 173.7977 19 T 4.9652 8.0191 114.5067 60.1912 71.9867 172.3530 20 Y 5.1995 9.0297 120.4734 56.4490 43.0642 173.6747 21 E 5.3823 9.0426 117.9927 54.6499 32.5627 175.0504 22 A 4.7299 8.9979 123.7521 49.8306 22.5794 175.9773 23 G 3.9088 8.6743 108.4834 46.3332 0.0000 172.3662 24 I 4.9918 7.6363 120.2177 59.0696 40.2657 175.2138 25 A 4.5078 8.7262 127.2640 50.3583 20.8388 176.5332 26 L 4.4803 8.4342 121.4437 54.9654 40.9404 180.7718 27 K 4.7179 8.5247 125.2844 54.6740 37.4696 175.8712 28 G 3.6368 8.7277 108.9282 47.8754 0.0000 175.9326 29 T 3.7974 7.9792 115.0364 65.3655 67.2844 175.7544 30 E 3.8921 8.0466 119.8812 59.2819 29.5132 179.2524 31 V 3.5444 7.5100 118.2264 65.8595 31.4877 178.2109 32 K 3.8428 7.8872 118.1640 59.4783 31.8774 179.2258 33 S 3.8481 7.4323 112.3910 61.2280 62.0526 176.0043 34 L 4.0202 7.8562 122.2307 57.8917 41.6347 178.7383 35 R 3.6069 8.3745 118.4740 58.9498 29.7394 178.8263 36 A 4.0083 7.4751 119.5757 55.6880 18.4167 178.2885 37 G 4.0165 7.8660 104.9063 45.5879 0.0000 175.5390 38 K 4.5060 7.9413 121.3702 55.1759 29.9353 175.8884 39 V 4.9703 7.5021 120.7417 59.9702 35.8147 175.3438 40 D 4.8534 9.2193 119.8966 52.7580 44.6212 175.1896 41 F 5.1104 8.8459 124.6773 58.0171 40.2365 174.3901 42 T 3.9229 7.9924 116.3110 65.5111 67.9915 174.1996 43 G 3.8835 8.7640 114.4363 45.7366 0.0000 172.8664 44 S 4.2754 7.3778 112.7904 57.9876 62.3607 173.1223 45 F 5.0462 7.6558 119.0069 56.2311 40.9255 172.2112 46 A 5.2190 8.6319 119.7382 50.6302 22.3476 175.2465 47 R 4.6736 8.6537 117.0109 54.6230 35.5165 174.1615 48 F 5.1612 8.8107 119.3066 56.5060 40.2756 175.4492 49 E 4.5515 9.3348 124.3083 55.9198 32.5329 175.1596 50 D 4.4743 10.0537 127.4832 55.5687 38.4589 174.6634 51 G 3.9598 8.5295 104.5674 45.4556 0.0000 172.1267 52 E 4.7386 8.4422 119.6519 53.9515 33.2218 173.4552 53 L 4.9143 8.1731 122.7115 53.1987 44.7690 173.9993 54 Y 4.7057 8.8495 127.5929 55.7013 41.9734 174.4738 55 L 4.3115 9.0918 127.6864 54.0933 41.5531 177.3649 56 E 3.9264 8.1941 125.4422 58.4357 30.2058 177.3723 57 N 4.8468 7.5110 117.9020 50.9696 41.9079 173.0375 58 L 4.9924 7.7165 130.3733 55.1058 44.9101 171.8910 59 Y 4.9001 8.2320 126.8976 55.8137 41.7765 174.0715 60 I 4.6519 7.4028 125.8087 59.3053 40.0616 175.0456 61 A 4.2223 8.4506 129.0216 49.9899 19.9216 175.3303 62 P 4.2425 0.0000 0.0000 62.3632 31.9288 175.5096 63 Y 3.8121 8.0042 119.5685 60.9639 38.4427 177.6255 *68 Y 4.1441 7.7691 122.0681 57.9382 40.5401 172.5633 69 A 4.4895 7.0455 121.8026 51.2064 21.9440 177.4750 70 N 4.6448 8.4089 116.7849 53.6005 35.7101 173.1083 71 V 4.1948 7.6360 118.9231 60.4325 32.9860 174.9273 72 D 4.4731 8.7519 128.0379 53.9090 41.3626 173.8502 73 P 4.8091 0.0000 0.0000 63.2282 32.1245 176.1073 74 R 4.5291 8.4874 117.6571 56.2370 30.5093 176.0836 75 R 4.5113 7.5797 118.5372 54.2115 31.5621 175.8140 76 K 4.3989 8.4176 122.3880 57.4442 33.3841 176.1008 77 R 4.8484 8.8582 120.2037 54.4189 33.8981 175.2370 78 K 3.9252 8.0032 121.1632 55.6775 33.8940 175.7712 79 L 5.0122 7.9645 122.6519 52.9506 44.1941 175.8618 80 L 4.6482 8.3756 124.0114 53.1360 43.1076 175.7310 81 L 4.4322 8.1332 123.5817 53.9119 45.3782 174.4137 82 H 4.3501 8.3446 120.6006 55.7876 29.4190 176.7186 83 K 3.8986 8.8332 123.2287 60.2699 32.3283 178.9258 84 H 4.4057 8.2319 115.3071 59.0748 28.7544 177.6476 85 E 3.9476 8.1170 119.8395 59.2207 29.1193 179.0536 86 L 3.8473 8.2633 120.7740 58.2227 42.0101 179.0495 87 R 3.9618 7.8185 115.5036 58.1136 30.4434 178.3756 88 R 4.0633 8.2885 119.8785 59.0852 30.2451 178.2324 89 L 4.0719 8.1640 119.6185 58.1122 40.4730 179.0245 90 L 3.8125 7.3817 121.4177 58.5928 39.9330 179.0617 91 G 3.7715 7.9564 104.7493 46.1254 0.0000 175.5194 92 K 4.1887 7.8663 121.3493 59.5121 32.1694 179.3880 93 V 3.8282 7.7109 111.3345 63.3897 31.7485 178.0150 94 E 4.0393 8.0307 118.3621 58.8454 29.5115 177.4800 95 Q 4.2367 7.6301 118.7070 55.9624 28.4363 175.6125 96 K 3.7238 8.2094 110.2660 57.4155 28.9835 176.4291 97 G 3.9712 9.1853 108.4897 45.9587 0.0000 173.7405 98 L 4.9839 8.0295 123.1743 53.3050 45.9596 175.8925 99 T 4.4355 8.8406 113.7445 61.0642 70.8591 173.8648 100 L 5.1144 8.6669 124.9496 53.9340 42.6348 176.1195 101 V 4.4555 8.6930 124.5658 59.2592 34.1777 173.3808 102 P 5.0599 0.0000 0.0000 61.9822 31.2008 175.8935 103 L 4.3999 9.2714 127.1032 57.3060 42.7212 177.5114 104 K 5.1674 8.0393 115.8200 55.6021 36.2410 174.5797 105 I 5.1558 8.6944 115.9519 59.5487 40.1222 174.0170 106 Y 5.3124 8.9273 122.3160 56.1837 41.8550 173.1399 107 F 5.0957 8.8778 118.7381 55.4571 41.9272 175.6357 108 N 4.7134 8.8590 121.6087 51.9715 38.1715 175.6302 109 E 4.1325 8.5648 115.4267 58.4603 29.7841 177.7035 110 R 4.0798 8.0838 118.5163 56.8674 30.5400 176.1604 111 G 4.1207 8.2490 104.8724 46.9201 0.0000 172.5631 112 Y 4.4447 8.5713 115.6364 55.4798 41.6018 174.5966 113 A 4.2903 7.3378 121.9349 50.5196 21.3920 176.2981 114 K 4.8415 8.5528 119.0571 54.4744 37.2280 175.6562 115 V 4.9360 8.6840 121.2201 59.9215 34.6766 174.1918 116 L 4.8790 9.2328 126.3829 54.1451 43.5826 174.9559 117 L 5.3007 9.3950 126.8144 52.9205 44.8301 175.7027 118 G 4.4650 8.9750 110.2856 44.2892 0.0000 172.0591 119 L 5.1023 8.9469 123.7937 53.8051 42.7957 175.7966 120 A 5.1593 9.2497 126.1894 49.8447 22.5532 176.1027 121 R 4.5733 8.5517 118.2418 56.0645 31.2507 177.2869 122 G 2.9240 7.1576 109.2131 44.2707 0.0000 174.5913 123 K 4.1093 7.8742 117.8334 56.5588 33.0169 176.3992 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 8.16 4.26 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.18 0.00 1.98 1.91 0.00 3.38 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 2.00 0.00 4 V 8.85 4.65 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 0.90 0.00 0.00 1.01 0.00 0.00 5 L 8.70 4.92 0.00 1.42 1.53 0.82 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.96 4.92 0.00 2.01 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 2.29 2.27 0.00 7 N 8.41 4.90 0.00 2.89 2.63 0.00 0.00 7.26 9.00 0.00 0.00 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 R 8.82 3.86 0.00 1.76 1.90 0.00 3.33 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 9 R 7.75 4.47 0.00 2.23 2.14 0.00 2.97 0.00 0.00 3.17 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.34 0.00 10 A 7.71 4.00 1.35 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 11 R 7.88 4.67 0.00 1.80 1.94 0.00 3.20 0.00 0.00 3.17 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 12 H 7.81 4.63 0.00 3.05 3.37 0.00 5.92 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.10 4.98 0.00 2.74 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.10 4.58 0.00 3.09 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 15 E 8.62 4.74 0.00 1.97 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 16 I 8.30 4.74 1.89 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.10 0.96 0.00 0.00 17 L 8.95 4.20 0.00 1.62 1.82 0.91 1.17 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 18 E 7.87 4.80 0.00 1.97 1.59 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 1.80 2.15 0.00 19 T 8.02 4.97 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 20 Y 9.03 5.20 0.00 2.91 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 21 E 9.04 5.38 0.00 2.08 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 0.00 2.28 2.36 0.00 22 A 9.00 4.73 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 23 G 8.67 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 24 I 7.64 4.99 1.70 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 1.05 0.54 0.86 0.00 0.00 25 A 8.73 4.51 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 26 L 8.43 4.48 0.00 1.40 0.91 0.76 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 27 K 8.52 4.72 0.00 1.73 1.65 0.00 1.70 0.00 0.00 1.86 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.49 7.81 28 G 8.73 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 29 T 7.98 3.80 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 1.30 0.00 0.00 30 E 8.05 3.89 0.00 2.11 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 2.33 2.33 0.00 31 V 7.51 3.54 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 0.92 0.00 0.00 0.34 0.00 0.00 32 K 7.89 3.84 0.00 1.62 1.47 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.56 1.48 7.81 33 S 7.43 3.85 0.00 3.73 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 34 L 7.86 4.02 0.00 1.84 1.80 0.97 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 35 R 8.37 3.61 0.00 1.92 1.84 0.00 3.21 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.96 0.00 36 A 7.48 4.01 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 37 G 7.87 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 0.00 0.00 0.00 38 K 7.94 4.51 0.00 1.66 1.74 0.00 1.70 0.00 0.00 1.87 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.39 7.81 39 V 7.50 4.97 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 0.65 0.00 0.00 0.91 0.00 0.00 40 D 9.22 4.85 0.00 2.79 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 41 F 8.85 5.11 0.00 2.95 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 42 T 7.99 3.92 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 1.21 0.00 0.00 43 G 8.76 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 44 S 7.38 4.28 0.00 3.96 3.53 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 45 F 7.66 5.05 0.00 3.14 3.09 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 46 A 8.63 5.22 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 47 R 8.65 4.67 0.00 2.05 1.87 0.00 3.19 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.81 0.00 48 F 8.81 5.16 0.00 2.98 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.33 4.55 0.00 2.06 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 2.25 2.30 0.00 50 D 10.05 4.47 0.00 2.83 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 51 G 8.53 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 52 E 8.44 4.74 0.00 1.97 1.90 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 2.01 2.12 0.00 53 L 8.17 4.91 0.00 1.62 1.35 0.13 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 8.85 4.71 0.00 3.14 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.09 4.31 0.00 1.76 1.59 0.90 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 56 E 8.19 3.93 0.00 1.54 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 2.27 0.00 57 N 7.51 4.85 0.00 2.45 2.06 0.00 0.00 6.69 6.66 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 58 L 7.72 4.99 0.00 1.78 1.57 1.02 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 8.23 4.90 0.00 3.14 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 60 I 7.40 4.65 1.63 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.66 0.75 0.00 0.00 61 A 8.45 4.22 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 62 P 0.00 4.24 0.00 2.07 2.04 0.00 3.73 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.11 0.00 63 Y 8.00 3.81 0.00 2.67 2.49 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 *68 Y 7.77 4.14 0.00 3.01 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 A 7.05 4.49 1.01 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 0.00 0.00 70 N 8.41 4.64 0.00 2.70 2.82 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 71 V 7.64 4.19 2.32 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 0.88 0.00 0.00 0.89 0.00 0.00 72 D 8.75 4.47 0.00 2.71 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 73 P 0.00 4.81 0.00 2.25 2.11 0.00 3.89 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.06 0.00 74 R 8.49 4.53 0.00 2.05 2.05 0.00 3.19 0.00 0.00 3.15 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.75 0.00 75 R 7.58 4.51 0.00 1.95 1.84 0.00 3.25 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 76 K 8.42 4.40 0.00 2.02 1.76 0.00 1.10 0.00 0.00 1.45 0.00 0.00 2.48 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.24 1.21 7.81 77 R 8.86 4.85 0.00 1.76 1.94 0.00 3.09 0.00 0.00 3.11 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.74 0.00 78 K 8.00 3.93 0.00 1.48 1.47 0.00 1.55 0.00 0.00 1.56 0.00 0.00 2.79 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.95 1.17 7.81 79 L 7.96 5.01 0.00 1.54 1.46 0.87 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 80 L 8.38 4.65 0.00 1.46 1.54 0.83 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 81 L 8.13 4.43 0.00 1.52 1.37 0.77 0.56 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 82 H 8.34 4.35 0.00 3.20 3.17 0.00 5.69 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 83 K 8.83 3.90 0.00 1.69 1.81 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.46 7.81 84 H 8.23 4.41 0.00 3.18 3.29 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 85 E 8.12 3.95 0.00 1.94 1.93 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 2.48 2.40 0.00 86 L 8.26 3.85 0.00 1.54 1.77 1.03 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 87 R 7.82 3.96 0.00 1.93 1.96 0.00 3.26 0.00 0.00 3.16 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.76 0.00 88 R 8.29 4.06 0.00 1.94 2.11 0.00 3.10 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 89 L 8.16 4.07 0.00 2.01 1.92 1.10 -0.02 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 90 L 7.38 3.81 0.00 1.36 1.21 0.79 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 91 G 7.96 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 92 K 7.87 4.19 0.00 2.08 1.92 0.00 1.80 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.49 1.52 7.81 93 V 7.71 3.83 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 0.91 0.00 0.00 0.96 0.00 0.00 94 E 8.03 4.04 0.00 2.18 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 2.29 2.49 0.00 95 Q 7.63 4.24 0.00 2.11 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.46 0.00 0.00 0.00 0.00 0.00 2.39 2.49 0.00 96 K 8.21 3.72 0.00 1.93 1.98 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.31 1.36 7.81 97 G 9.19 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 98 L 8.03 4.98 0.00 1.54 1.57 0.96 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 99 T 8.84 4.44 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 1.27 0.00 0.00 100 L 8.67 5.11 0.00 1.63 1.74 1.12 1.15 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 0.00 101 V 8.69 4.46 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 1.03 0.00 0.00 0.69 0.00 0.00 102 P 0.00 5.06 0.00 2.14 2.25 0.00 3.66 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.18 0.00 103 L 9.27 4.40 0.00 1.65 1.74 0.95 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 104 K 8.04 5.17 0.00 1.91 1.87 0.00 1.15 0.00 0.00 1.66 0.00 0.00 2.32 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.35 7.81 105 I 8.69 5.16 1.73 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.55 0.66 0.00 0.00 106 Y 8.93 5.31 0.00 3.10 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 0.00 107 F 8.88 5.10 0.00 2.86 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 0.00 108 N 8.86 4.71 0.00 2.90 2.88 0.00 0.00 6.48 7.57 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 0.00 109 E 8.56 4.13 0.00 2.12 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 0.00 2.28 2.29 0.00 110 R 8.08 4.08 0.00 1.71 2.04 0.00 3.19 0.00 0.00 3.18 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.55 0.00 111 G 8.25 4.12 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 0.00 0.00 0.00 112 Y 8.57 4.44 0.00 2.72 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 0.00 113 A 7.34 4.29 0.66 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 0.00 114 K 8.55 4.84 0.00 0.79 1.35 0.00 1.45 0.00 0.00 1.50 0.00 0.00 2.78 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.10 0.99 7.81 115 V 8.68 4.94 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 0.78 0.00 0.00 1.06 0.00 0.00 116 L 9.23 4.88 0.00 1.94 1.67 1.06 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 117 L 9.40 5.30 0.00 1.78 1.69 0.97 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 118 G 8.97 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 0.00 119 L 8.95 5.10 0.00 1.62 1.69 1.12 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 120 A 9.25 5.16 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 0.00 121 R 8.55 4.57 0.00 1.72 1.84 0.00 3.13 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.51 0.00 122 G 7.16 2.92 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 0.00 123 K 7.87 4.11 0.00 1.65 1.65 0.00 1.55 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.29 1.39 7.81 * Residues marked with a * may have inaccurate shift predictions.