NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 M 4.5229 8.1633 120.3585 55.5304 34.4249 177.5382 9 D 4.3231 8.1377 118.8929 56.4565 40.8302 174.9449 10 E 4.0082 8.3771 119.6898 58.9780 30.1697 178.1275 11 I 3.6250 7.7422 118.4333 63.9501 38.1043 177.8149 12 W 4.1299 8.0782 119.1166 59.4577 28.9430 178.5296 13 A 4.1515 8.0349 121.0740 55.1516 17.8177 179.7137 14 L 4.0220 8.2101 117.6415 57.8931 41.6930 179.0343 15 Y 4.0600 8.0099 119.4725 60.5854 38.6721 177.9327 16 A 3.9001 8.2071 121.8684 54.9945 18.4219 179.0534 17 D 4.2101 8.0857 116.5116 57.6847 41.4696 178.1460 18 D 4.5933 8.6947 119.8718 57.2769 40.8062 179.1690 19 G 3.6733 8.0611 105.9908 47.7651 0.0000 175.6724 20 A 3.9827 7.8116 122.9766 55.0250 17.9629 179.7490 21 Q 4.0351 8.3117 116.4568 58.9332 28.6836 179.0573 22 A 4.0489 8.1615 121.7946 55.0775 18.5382 179.7369 23 L 3.7806 8.0349 117.6012 57.8557 41.5607 179.4760 24 D 4.2975 8.6085 119.1790 57.2934 40.8678 178.7049 25 A 3.9796 7.7351 120.6835 55.1057 18.2151 179.4315 26 M 3.9448 8.0893 116.9534 58.6905 32.2540 178.1476 27 E 3.8709 8.4869 119.6275 59.1943 29.8851 178.4637 28 A 3.9631 8.1435 120.9654 55.4314 18.4420 179.8682 29 S 4.0448 7.9624 113.0778 61.6918 62.9216 176.9700 30 L 3.9982 7.6819 121.8777 57.7751 41.3568 179.5829 31 L 4.0011 8.2537 118.9997 57.5515 41.3493 179.4419 32 A 3.9754 7.9344 120.9202 54.9859 18.0604 179.7006 33 L 4.0654 7.5300 116.6826 58.0050 41.7632 179.2448 34 Q 4.0657 8.0553 118.3999 58.9762 29.0306 177.7641 35 A 4.1555 7.6888 121.4821 53.9728 19.5321 176.7197 36 G 3.8362 6.9002 105.9874 46.5795 0.0000 173.4706 37 E 4.7696 7.5415 116.5858 53.9069 33.8704 176.2897 38 D 4.4466 8.4868 120.7897 53.9536 42.3786 176.9585 39 A 4.0575 8.8960 127.3611 55.2740 18.1454 179.6207 40 A 3.8801 7.9843 117.9810 55.7042 18.5105 179.5586 41 A 4.0652 7.4556 115.7007 54.2036 18.6655 178.3288 42 H 4.8080 7.7855 112.7878 55.8885 30.6551 176.3774 43 V 3.7684 8.4015 121.1215 66.0465 31.3257 178.0213 44 G 3.6393 8.0615 104.7278 47.3684 0.0000 173.3112 45 P 4.3012 0.0000 0.0000 65.2044 31.3324 178.5846 46 L 4.1249 7.8549 118.1554 58.4477 40.2686 179.0602 47 F 4.0688 7.9003 121.2729 61.2839 39.4053 177.0496 48 R 4.1155 8.0892 116.6353 59.0062 30.2278 178.6437 49 A 4.1908 7.8116 120.2800 54.9532 18.3643 180.1766 50 V 3.9372 7.8243 115.9534 63.7255 31.9013 178.1396 *52 T 4.2339 7.8831 114.9762 63.1307 70.4285 176.2292 53 F 4.0399 8.0938 122.3734 61.1421 39.2971 177.1161 54 K 4.1852 7.9652 120.9891 58.7694 31.8596 179.1199 55 G 3.5519 7.9712 105.6491 47.8654 0.0000 175.3513 56 N 4.3263 8.0419 119.1563 55.9390 38.4335 177.7577 57 S 3.9292 7.7252 115.8168 61.3576 62.5575 176.5352 58 R 3.9103 7.9223 122.3646 58.9258 29.5329 178.7521 59 V 3.5142 7.1652 117.5005 65.8099 31.7207 177.3696 60 L 4.1005 7.1401 115.2654 54.0933 41.6337 176.9454 61 G 3.7900 7.3495 106.1826 47.2483 0.0000 175.8569 62 L 4.3748 8.0083 120.3428 52.4057 38.4510 176.5701 63 S 4.1114 7.9451 119.4967 61.8584 63.3814 176.7898 64 V 3.6726 8.7525 122.0641 65.5707 31.4830 178.2626 65 V 3.7015 7.6029 116.7472 65.9754 31.3099 177.6121 66 E 4.0029 8.6860 119.8677 59.1693 29.5342 178.9601 67 S 4.1723 8.2415 114.4348 61.6405 62.6898 176.7729 68 R 4.0747 8.1313 121.5599 58.7666 29.8056 178.9014 69 A 3.8954 8.0976 120.3649 55.1748 18.4466 179.0829 70 H 4.1007 8.4849 116.9594 59.5804 30.0750 177.5763 71 L 4.1678 7.7857 120.7899 57.7860 41.3895 179.3396 72 C 4.1553 7.6828 116.6371 62.7998 28.0134 175.6406 73 E 3.9098 8.0949 120.8342 59.2865 29.1146 178.7009 74 D 4.3345 8.0230 118.8885 57.2668 41.0884 178.4639 75 L 3.9813 7.8163 120.4949 58.2745 42.0683 179.1275 76 I 4.0188 8.0785 119.9773 64.3054 36.9909 178.6304 77 G 3.7090 8.5935 106.8592 47.8383 0.0000 175.7589 78 L 4.0474 8.0443 121.2162 57.3120 41.2401 179.8284 79 V 4.0244 7.2696 118.5649 65.5698 31.3515 177.9177 80 R 3.6764 7.8618 117.1531 59.3487 30.0501 177.8906 81 D 4.4049 8.2606 118.1868 57.2656 41.3492 178.2202 82 A 3.9646 7.9119 120.0630 53.1156 19.2051 176.7825 83 G 3.6039 7.3492 103.2193 46.3184 0.0000 173.8751 84 V 4.2989 7.5237 118.0423 60.0454 33.6351 173.1389 85 P 4.5056 0.0000 0.0000 62.9422 31.8609 177.0733 86 M 4.2961 8.2836 123.8782 54.2247 30.9205 175.0535 87 D 4.6521 7.8993 123.5042 51.7908 41.2222 178.2425 88 G 3.8560 8.7981 106.0938 48.2567 0.0000 175.3571 89 E 3.9189 7.9192 120.3993 59.1003 29.6772 178.8559 90 I 3.6903 7.7614 119.4603 64.4683 37.1838 178.5035 91 V 3.5756 7.7536 118.3284 66.0336 31.4256 177.5687 92 E 3.9735 8.3493 118.3356 59.6106 29.2632 179.5465 93 I 3.7805 7.8790 119.6090 64.5276 37.2161 178.6510 94 L 4.0218 7.9910 119.6526 57.5277 41.2345 179.5584 95 L 4.0441 8.2078 119.4472 57.5430 41.5730 179.1289 96 F 4.2397 8.3781 120.5456 61.0002 39.3082 177.2008 97 A 3.8580 8.3391 120.9851 54.9465 18.1971 179.3704 98 S 3.8481 8.0816 111.6877 61.8441 62.4992 176.3335 99 D 4.3056 7.7308 121.4595 57.3292 40.4949 179.0380 100 T 3.6749 7.5198 116.3807 66.6077 68.4976 176.9934 101 L 4.0589 8.2839 121.0358 57.4095 41.5253 179.6140 102 R 3.8445 7.7476 118.8731 59.3199 30.0114 178.4389 103 A 4.0496 7.8481 120.1462 55.2097 18.3181 179.6225 104 M 4.0892 8.1637 117.4991 58.3589 32.0652 178.7166 105 L 4.2237 8.4773 122.2668 57.8645 41.8548 178.9196 106 E 4.0476 8.2095 118.4962 59.1807 29.3483 179.1044 107 E 3.9611 8.1616 119.2776 59.5739 29.9372 178.9689 108 T 4.2010 8.4830 111.0180 64.2448 68.5228 176.2989 109 A 4.4062 8.1720 122.7688 55.0459 18.5413 179.1713 110 A 4.0571 7.5944 117.8909 54.8564 18.5803 179.4318 111 S 4.1462 7.9450 111.5769 58.4269 63.6965 174.6326 112 R 2.0000 7.6477 119.3535 55.5880 27.2574 175.3835 113 A 4.5583 6.9682 117.5427 50.8053 22.1694 176.1067 114 D 4.4910 8.4017 119.0987 54.3007 41.9602 176.0318 115 V 4.2319 7.8850 115.6553 59.9496 33.0692 176.3700 116 E 3.9312 8.6721 122.8034 57.6485 29.4701 178.1336 117 G 4.0559 8.3749 105.4743 45.7352 0.0000 175.1492 118 T 3.9341 7.8886 112.2941 64.3216 68.9908 176.1165 119 G 4.0283 8.0664 108.0280 45.8147 0.0000 173.6233 120 S 4.7404 7.7076 112.3599 57.6315 63.8222 175.8898 121 E 3.9877 8.0459 121.1924 59.6198 29.0205 178.9645 122 A 4.0475 8.0074 120.6678 54.8949 18.4431 179.3005 123 L 4.1189 8.0245 118.5606 58.6069 42.3321 178.8412 124 M 4.0831 7.9654 118.3583 58.5177 31.8015 178.2453 125 D 4.4070 8.0196 118.2678 57.1091 40.8813 178.3278 126 Q 3.9868 8.0776 118.8378 58.8188 28.7224 178.7942 127 L 4.0253 8.3081 120.3208 57.8901 41.7751 179.4798 128 R 3.9230 8.0217 118.6781 59.3003 30.0495 178.4357 129 S 4.0558 8.3401 113.2134 61.3262 62.3797 176.1840 130 K 3.9629 7.7123 121.1627 59.5164 32.0983 178.6659 131 I 3.6695 7.8621 119.9269 64.4802 36.7970 178.2982 132 A 4.0219 7.6600 119.9221 55.2751 18.3246 179.6599 133 R 4.0137 7.7254 115.2283 59.4803 30.1398 178.7234 134 C 4.3055 8.2235 116.0421 61.9032 28.3190 174.4316 135 S 4.5195 7.8217 120.0602 58.5768 62.7981 173.8590 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 8 M 8.16 4.52 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.79 0.00 9 D 8.14 4.32 0.00 2.93 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 10 E 8.38 4.01 0.00 2.06 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 2.40 2.38 0.00 11 I 7.74 3.63 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 1.44 1.09 0.66 0.00 0.00 12 W 8.08 4.13 0.00 3.49 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 A 8.03 4.15 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.21 4.02 0.00 2.04 1.73 0.96 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 8.01 4.06 0.00 2.79 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 16 A 8.21 3.90 1.47 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 17 D 8.09 4.21 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 18 D 8.69 4.59 0.00 2.74 2.69 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 19 G 8.06 3.67 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 0.00 0.00 0.00 20 A 7.81 3.98 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 21 Q 8.31 4.04 0.00 2.26 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.52 0.00 22 A 8.16 4.05 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 L 8.03 3.78 0.00 1.66 1.57 0.65 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 24 D 8.61 4.30 0.00 2.71 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 A 7.74 3.98 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 26 M 8.09 3.94 0.00 2.13 2.08 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.48 0.00 27 E 8.49 3.87 0.00 2.16 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 0.00 2.28 2.29 0.00 28 A 8.14 3.96 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 29 S 7.96 4.04 0.00 4.05 3.95 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 30 L 7.68 4.00 0.00 1.77 1.70 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.25 4.00 0.00 1.84 1.69 0.94 1.21 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 32 A 7.93 3.98 1.26 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 0.00 0.00 0.00 33 L 7.53 4.07 0.00 1.84 1.73 0.96 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 8.06 4.07 0.00 2.23 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.01 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 35 A 7.69 4.16 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 6.90 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 37 E 7.54 4.77 0.00 2.07 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 2.23 2.26 0.00 38 D 8.49 4.45 0.00 2.76 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.90 4.06 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 7.98 3.88 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 41 A 7.46 4.07 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 H 7.79 4.81 0.00 3.17 3.32 0.00 5.64 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 43 V 8.40 3.77 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 1.00 0.00 0.00 0.98 0.00 0.00 44 G 8.06 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 45 P 0.00 4.30 0.00 2.21 2.18 0.00 3.64 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.19 0.00 46 L 7.85 4.12 0.00 1.91 1.94 1.03 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 47 F 7.90 4.07 0.00 3.08 3.26 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 0.00 48 R 8.09 4.12 0.00 2.09 2.03 0.00 3.27 0.00 0.00 3.29 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.92 0.00 49 A 7.81 4.19 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 V 7.82 3.94 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 1.05 0.00 0.00 0.92 0.00 0.00 *52 T 7.88 4.23 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 53 F 8.09 4.04 0.00 3.23 3.01 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 54 K 7.97 4.19 0.00 2.01 1.78 0.00 1.80 0.00 0.00 1.91 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.51 7.81 55 G 7.97 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.04 4.33 0.00 2.70 2.97 0.00 0.00 6.81 7.47 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 57 S 7.73 3.93 0.00 3.92 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 58 R 7.92 3.91 0.00 2.05 2.07 0.00 3.06 0.00 0.00 3.06 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.82 0.00 59 V 7.17 3.51 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 0.74 0.00 0.00 0.87 0.00 0.00 60 L 7.14 4.10 0.00 1.01 1.14 -1.06 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 61 G 7.35 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 0.00 0.00 0.00 62 L 8.01 4.37 0.00 1.67 1.64 0.38 1.07 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 63 S 7.95 4.11 0.00 3.86 3.95 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 64 V 8.75 3.67 2.29 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 1.16 0.00 0.00 1.02 0.00 0.00 65 V 7.60 3.70 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 1.07 0.00 0.00 1.09 0.00 0.00 66 E 8.69 4.00 0.00 2.16 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 0.00 2.30 2.40 0.00 67 S 8.24 4.17 0.00 4.14 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 68 R 8.13 4.07 0.00 2.02 2.06 0.00 3.24 0.00 0.00 3.32 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 69 A 8.10 3.90 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.48 4.10 0.00 3.38 3.53 0.00 5.79 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 71 L 7.79 4.17 0.00 1.71 1.72 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 72 C 7.68 4.16 0.00 3.11 2.96 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 73 E 8.09 3.91 0.00 2.07 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 2.25 1.79 0.00 74 D 8.02 4.33 0.00 2.90 2.69 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 75 L 7.82 3.98 0.00 1.81 1.85 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 76 I 8.08 4.02 2.05 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.54 1.14 0.00 0.00 77 G 8.59 3.71 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 0.00 0.00 0.00 78 L 8.04 4.05 0.00 1.96 1.74 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 79 V 7.27 4.02 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 1.37 0.00 0.00 1.05 0.00 0.00 80 R 7.86 3.68 0.00 1.74 1.74 0.00 2.99 0.00 0.00 2.79 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.53 0.00 81 D 8.26 4.40 0.00 2.75 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 82 A 7.91 3.96 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 G 7.35 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 V 7.52 4.30 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 0.98 0.00 0.00 0.95 0.00 0.00 85 P 0.00 4.51 0.00 2.08 1.97 0.00 3.72 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 86 M 8.28 4.30 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.53 0.00 87 D 7.90 4.65 0.00 2.94 2.80 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 88 G 8.80 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 E 7.92 3.92 0.00 2.18 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 2.30 2.34 0.00 90 I 7.76 3.69 1.95 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.81 0.93 0.00 0.00 91 V 7.75 3.58 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 1.10 0.00 0.00 1.00 0.00 0.00 92 E 8.35 3.97 0.00 2.30 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 2.33 2.36 0.00 93 I 7.88 3.78 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.79 0.97 0.00 0.00 94 L 7.99 4.02 0.00 1.85 1.72 0.94 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 95 L 8.21 4.04 0.00 1.95 1.75 0.95 0.76 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 96 F 8.38 4.24 0.00 3.17 3.24 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 97 A 8.34 3.86 1.40 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 98 S 8.08 3.85 0.00 3.91 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 99 D 7.73 4.31 0.00 2.50 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 0.00 100 T 7.52 3.67 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 1.07 0.00 0.00 101 L 8.28 4.06 0.00 1.35 1.31 0.71 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 102 R 7.75 3.84 0.00 2.05 2.04 0.00 3.10 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.81 0.00 103 A 7.85 4.05 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 M 8.16 4.09 0.00 2.22 2.35 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.59 0.00 105 L 8.48 4.22 0.00 2.12 1.98 0.44 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 106 E 8.21 4.05 0.00 2.11 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 0.00 2.35 2.42 0.00 107 E 8.16 3.96 0.00 2.22 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 2.31 2.32 0.00 108 T 8.48 4.20 4.53 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 1.43 0.00 0.00 109 A 8.17 4.41 1.53 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 0.00 0.00 110 A 7.59 4.06 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 S 7.95 4.15 0.00 3.95 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 0.00 112 R 7.65 2.00 0.00 1.41 1.01 0.00 2.82 0.00 0.00 2.61 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.92 0.00 113 A 6.97 4.56 1.15 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 0.00 114 D 8.40 4.49 0.00 2.66 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 0.00 115 V 7.88 4.23 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 0.98 0.00 0.00 116 E 8.67 3.93 0.00 1.91 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 2.30 2.37 0.00 117 G 8.37 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 0.00 0.00 0.00 118 T 7.89 3.93 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 0.00 119 G 8.07 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 0.00 120 S 7.71 4.74 0.00 4.03 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 0.00 121 E 8.05 3.99 0.00 2.22 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 0.00 2.35 2.57 0.00 122 A 8.01 4.05 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 0.00 123 L 8.02 4.12 0.00 2.08 1.97 1.16 0.96 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 0.00 124 M 7.97 4.08 0.00 2.09 2.26 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.73 0.00 125 D 8.02 4.41 0.00 2.88 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 0.00 126 Q 8.08 3.99 0.00 2.36 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.60 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 127 L 8.31 4.03 0.00 1.86 1.73 0.99 0.83 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 0.00 128 R 8.02 3.92 0.00 2.16 1.94 0.00 3.11 0.00 0.00 3.11 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 129 S 8.34 4.06 0.00 4.03 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 0.00 130 K 7.71 3.96 0.00 1.95 1.79 0.00 1.59 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.53 7.81 131 I 7.86 3.67 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.96 0.92 0.00 0.00 132 A 7.66 4.02 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 0.00 133 R 7.73 4.01 0.00 2.05 2.01 0.00 3.16 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.79 0.00 134 C 8.22 4.31 0.00 2.94 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 S 7.82 4.52 0.00 3.92 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 * Residues marked with a * may have inaccurate shift predictions.