NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 A 4.1674 8.2649 123.5831 51.8668 19.4878 179.2931 *2 I 4.0646 8.8185 117.1266 61.7407 38.5175 175.4050 3 V 4.3239 8.6412 117.4718 61.3076 33.0475 175.9961 4 G 4.6829 7.5026 105.3402 46.1547 0.0000 172.2458 5 L 5.2615 8.3066 123.3378 53.1307 45.8805 175.2125 6 G 4.8377 9.1549 111.9801 44.0948 0.0000 171.1898 7 T 5.2667 8.2931 115.8547 60.6771 71.1314 172.2320 8 D 4.7969 8.8711 124.7159 53.0873 45.2212 173.6508 9 I 5.1586 8.4620 123.9071 59.1882 41.1429 174.1858 10 A 4.8901 9.4076 129.7594 50.0610 22.6278 174.8456 11 E 4.4059 8.8891 123.0681 55.4257 30.2937 177.2764 12 I 3.7031 8.7579 128.9696 64.4886 37.0634 177.9989 13 E 3.8737 8.0688 119.6175 59.4067 29.3820 179.0243 14 R 3.8519 7.7733 118.1675 59.0019 30.0714 179.1743 15 V 3.5888 7.6363 117.6988 65.9111 31.6600 177.7309 16 E 4.0144 8.4595 118.6326 59.4806 29.3155 179.5170 17 K 3.9472 8.3424 118.4844 59.3579 32.0351 179.2618 18 A 3.7899 7.8677 121.0534 55.0904 18.1709 179.7324 19 L 4.1646 8.2392 117.3447 57.8887 41.4818 179.5831 20 A 4.0990 8.0282 119.8396 54.4597 18.2871 179.5462 21 R 4.1686 7.4815 115.6161 58.6172 31.1041 178.3053 22 S 4.7156 8.4711 112.3741 56.2826 64.8173 176.0394 23 G 3.9606 8.6843 111.7329 45.9589 0.0000 176.4264 24 E 4.0420 8.9994 124.2745 59.0759 28.9515 177.6939 25 N 4.4452 7.9100 115.5708 56.0642 38.6992 176.9090 26 F 4.5130 8.1921 121.2996 61.3409 39.6838 176.9895 27 A 3.3588 7.9754 120.3625 55.1585 17.8682 179.8843 28 R 3.8119 8.2869 115.5508 59.0048 30.1082 178.9740 29 R 4.0247 7.4758 118.2959 59.2909 30.1411 178.1510 30 I 3.5432 7.2859 118.1219 62.0244 37.7726 176.0154 31 L 4.8698 7.2088 118.6426 52.9055 43.7153 177.0741 32 T 4.0117 8.6227 113.2332 61.2518 71.0884 175.5637 33 D 4.3373 8.4705 121.1392 57.6422 40.8349 179.1368 34 S 4.1818 7.9659 113.1458 61.4536 62.5339 175.9336 35 E 4.0687 8.1123 121.1828 59.1787 29.0907 179.2154 36 L 3.9912 7.9991 119.3407 57.6186 41.3481 179.2757 37 E 3.9882 7.5500 117.0216 59.6617 29.5724 179.1602 38 Q 4.1286 7.6063 115.6145 58.6140 28.8059 178.3311 39 F 2.7014 7.9797 121.6930 61.3380 39.1711 176.9701 40 H 3.9893 8.2443 114.3554 58.4185 28.5260 176.9351 41 A 4.1564 7.2145 120.6117 52.3491 19.0387 177.6925 42 S 4.1576 6.9040 112.0874 58.1871 62.9423 173.8708 43 K 4.4261 8.4378 123.6335 56.3811 33.0342 176.8729 44 Q 4.6265 8.1098 117.5041 54.0250 29.3730 176.2052 45 Q 4.0211 7.9321 119.8747 58.8629 29.1615 179.0240 46 G 3.7157 8.1183 106.3968 47.9025 0.0000 175.8977 47 R 3.9716 8.0079 120.1916 58.7638 30.3312 178.4506 48 F 4.0140 8.5662 120.7754 61.5813 39.3114 177.0914 49 L 4.1589 8.8413 119.9036 57.9617 41.8643 178.5921 50 A 4.0820 8.4087 121.0787 55.2155 18.3529 179.7806 51 K 3.9641 8.1381 116.9510 59.7040 32.0772 179.8996 52 R 3.9017 7.8891 118.0366 58.9359 29.8599 178.8420 53 F 3.9738 8.6786 120.7242 61.2081 39.3630 177.0034 54 A 4.5866 8.6463 121.5005 54.6713 18.1250 179.3412 55 A 3.8618 8.0220 119.1906 55.3858 18.3963 180.1159 56 K 3.4002 8.0797 116.9178 59.2755 32.1259 179.5043 57 E 3.5950 8.1492 118.9464 59.1999 29.3722 179.2546 58 A 3.8794 8.1420 120.8518 55.0958 18.4741 179.5193 59 A 3.8522 7.9468 119.7996 55.2295 18.2327 180.0560 60 S 4.1709 7.6017 112.8389 61.3861 63.0385 176.9517 61 K 3.9366 8.0475 122.0339 59.1250 31.7709 179.1135 62 A 4.2445 7.8037 121.9597 54.5682 18.1139 179.3027 63 L 4.1607 7.7751 116.2568 56.0001 41.7881 178.4478 64 G 3.9825 8.0038 106.8118 45.3842 0.0000 173.8209 65 T 4.2595 7.6520 109.0785 60.2552 70.8791 175.7797 66 G 3.9050 7.8193 110.2825 45.7309 0.0000 173.6788 67 I 3.8795 7.8146 117.3074 59.1259 35.6820 174.3893 68 A 4.2543 8.4108 127.6838 52.1058 22.7016 176.1078 69 Q 3.4757 9.9196 114.9114 57.1105 26.1885 175.6785 70 G 3.9171 8.4922 106.1700 45.1606 0.0000 174.4670 71 V 3.9962 7.7573 121.2886 62.3516 32.2181 175.0282 72 T 4.8934 8.1589 115.7309 59.1962 72.1568 174.6471 73 F 4.2927 8.7081 119.8902 61.1561 38.9325 177.2421 74 H 4.6652 7.8567 114.4973 57.4693 28.7016 175.9835 75 D 4.3891 8.0885 119.1445 54.8076 40.9299 175.5188 76 F 5.3326 7.7968 117.6720 55.7786 41.7209 174.9755 77 T 4.7993 8.9285 119.3680 61.8896 71.8125 172.7816 78 I 4.8760 9.1883 128.4401 59.9841 38.9355 175.2080 79 S 5.0070 8.8093 122.2025 57.1761 66.5514 172.4926 80 H 5.2288 8.5756 114.6609 54.5511 32.6332 173.1008 81 D 4.7742 8.6464 122.5407 52.0280 40.7892 177.4462 82 K 3.9849 8.5424 117.7536 59.0939 31.9352 178.1527 83 L 4.2810 7.9881 116.3006 54.7018 42.0996 177.2116 84 G 4.0294 8.2045 107.1642 44.4496 0.0000 173.7356 85 K 4.2658 8.5157 122.8916 55.6129 33.1450 174.4474 86 P 4.8144 0.0000 0.0000 62.6623 32.5215 175.4398 87 L 4.8625 8.9651 121.5466 52.8380 45.6610 175.0191 88 L 5.1276 8.5520 123.9827 53.3456 44.4807 175.3289 89 I 4.6233 8.8096 126.8024 59.5418 40.2647 174.6804 90 L 5.1669 8.5444 126.3394 53.6764 43.7320 175.5124 91 S 4.3528 8.6229 115.8524 57.1512 67.0976 174.2940 92 G 3.7990 8.7221 107.4672 46.5019 0.0000 175.5933 93 Q 3.9034 8.5233 118.4596 58.9431 28.9698 178.3544 94 A 3.8333 7.8853 121.4505 55.0631 18.2951 179.5039 95 A 3.8667 7.7199 118.7249 55.1580 18.4228 179.6528 96 E 3.8776 8.0709 117.1385 59.6968 29.5587 179.7084 97 L 3.9970 8.2299 118.9854 57.6107 41.5807 179.3984 98 A 4.0065 8.2621 121.0805 55.0457 18.2930 179.5815 99 S 4.0033 8.2466 111.7845 61.7747 62.2685 176.5385 100 Q 4.0670 7.8783 119.4086 58.4639 28.5089 177.8634 101 L 4.2548 7.6935 117.6856 54.2167 42.3231 176.6089 102 Q 3.5587 8.1087 117.6567 56.6438 26.6684 173.5576 103 V 4.0832 7.9343 117.9348 63.1636 31.9501 174.9418 104 E 4.7135 9.2115 126.6468 55.8003 31.8829 175.3507 105 N 5.1061 8.0639 115.7737 51.4938 43.0446 173.2754 106 I 4.8958 8.2717 122.6142 59.7893 40.5317 174.5353 107 H 5.0247 9.1943 123.0866 53.8964 32.4111 172.4128 108 L 5.1720 8.4919 123.2302 53.5004 45.2929 175.2014 109 S 4.8312 9.1038 119.3041 56.6950 66.2398 172.5437 110 I 5.0520 8.2516 124.5692 59.8446 40.5505 174.7123 111 S 4.6789 8.4302 118.2906 56.9434 65.4513 172.5306 112 D 5.0976 8.4323 124.5181 51.6308 42.6110 174.8069 113 E 4.7788 8.7062 118.5434 55.0342 32.0587 174.6063 114 R 3.9661 7.6437 118.9042 60.0392 30.2062 178.1116 115 H 4.6078 8.6390 112.1922 55.5447 31.0460 173.2727 116 Y 5.3482 7.9857 115.8284 56.0212 41.9993 174.5343 117 A 5.4527 9.2650 123.6427 49.1538 23.1005 174.8835 *119 A 4.5305 8.2233 119.1663 52.4405 20.5204 175.9789 120 T 5.1411 8.6431 115.2845 61.7638 73.0434 173.3608 121 V 4.9370 8.9574 124.6617 61.1765 35.1181 174.1438 122 I 4.9948 8.8314 127.6995 59.4904 40.7658 174.2198 123 L 5.1023 8.8906 126.4372 52.9411 44.3481 175.1094 124 E 4.9227 9.0457 123.9292 54.2351 33.2868 176.0252 125 R 4.8378 8.4748 122.6061 56.0085 30.3012 176.4434 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 0 A 8.26 4.17 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 *2 I 8.82 4.06 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 1.42 0.59 0.98 0.00 0.00 3 V 8.64 4.32 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 0.71 0.00 0.00 0.97 0.00 0.00 4 G 7.50 4.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 L 8.31 5.26 0.00 1.71 1.44 0.96 1.02 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 6 G 9.15 4.84 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 7 T 8.29 5.27 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 8 D 8.87 4.80 0.00 2.78 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 I 8.46 5.16 1.88 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.33 0.92 0.00 0.00 10 A 9.41 4.89 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 11 E 8.89 4.41 0.00 2.15 1.86 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 2.25 2.04 0.00 12 I 8.76 3.70 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.59 0.90 0.00 0.00 13 E 8.07 3.87 0.00 1.97 1.89 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 2.34 2.38 0.00 14 R 7.77 3.85 0.00 1.90 1.87 0.00 3.14 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 15 V 7.64 3.59 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 1.29 0.00 0.00 0.84 0.00 0.00 16 E 8.46 4.01 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 2.36 2.52 0.00 17 K 8.34 3.95 0.00 1.85 1.80 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.43 1.60 7.81 18 A 7.87 3.79 0.68 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 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.24 4.16 0.00 1.97 1.87 1.18 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 20 A 8.03 4.10 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 21 R 7.48 4.17 0.00 1.85 1.95 0.00 3.06 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.81 0.00 22 S 8.47 4.72 0.00 3.80 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 23 G 8.68 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 24 E 9.00 4.04 0.00 2.18 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 2.44 2.52 0.00 25 N 7.91 4.45 0.00 3.00 2.93 0.00 0.00 6.97 7.25 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 26 F 8.19 4.51 0.00 3.00 3.21 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 27 A 7.98 3.36 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.29 3.81 0.00 1.84 2.02 0.00 3.19 0.00 0.00 3.17 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.82 0.00 29 R 7.48 4.02 0.00 1.78 2.10 0.00 3.33 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 30 I 7.29 3.54 1.43 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.27 0.66 0.00 0.00 31 L 7.21 4.87 0.00 1.50 1.50 0.47 0.97 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 32 T 8.62 4.01 4.19 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 1.24 0.00 0.00 33 D 8.47 4.34 0.00 2.69 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 34 S 7.97 4.18 0.00 3.89 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 35 E 8.11 4.07 0.00 2.18 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 2.41 2.40 0.00 36 L 8.00 3.99 0.00 1.88 1.61 0.96 0.64 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 37 E 7.55 3.99 0.00 2.20 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 2.37 2.54 0.00 38 Q 7.61 4.13 0.00 2.40 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.80 0.00 0.00 0.00 0.00 0.00 2.47 2.45 0.00 39 F 7.98 2.70 0.00 2.65 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 40 H 8.24 3.99 0.00 3.28 3.25 0.00 5.72 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 A 7.21 4.16 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 42 S 6.90 4.16 0.00 3.63 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 43 K 8.44 4.43 0.00 1.73 1.75 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.29 1.38 7.81 44 Q 8.11 4.63 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.80 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 45 Q 7.93 4.02 0.00 1.92 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 1.63 2.16 0.00 46 G 8.12 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 47 R 8.01 3.97 0.00 2.05 2.03 0.00 3.15 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.72 0.00 48 F 8.57 4.01 0.00 3.32 3.38 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 49 L 8.84 4.16 0.00 2.10 1.84 0.62 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 50 A 8.41 4.08 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 51 K 8.14 3.96 0.00 1.88 1.80 0.00 1.64 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.60 7.81 52 R 7.89 3.90 0.00 1.99 1.97 0.00 3.24 0.00 0.00 2.96 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.77 0.00 53 F 8.68 3.97 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 54 A 8.65 4.59 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 55 A 8.02 3.86 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 56 K 8.08 3.40 0.00 1.85 1.71 0.00 1.88 0.00 0.00 2.15 0.00 0.00 3.17 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.71 7.81 57 E 8.15 3.60 0.00 1.90 1.84 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 1.96 1.64 0.00 58 A 8.14 3.88 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 59 A 7.95 3.85 0.97 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 60 S 7.60 4.17 0.00 4.10 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 61 K 8.05 3.94 0.00 1.93 1.85 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.58 7.81 62 A 7.80 4.24 1.37 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 0.00 0.00 0.00 63 L 7.78 4.16 0.00 1.90 1.77 1.05 1.07 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 64 G 8.00 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 65 T 7.65 4.26 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 1.20 0.00 0.00 66 G 7.82 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 67 I 7.81 3.88 1.67 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 -0.11 0.68 0.00 0.00 68 A 8.41 4.25 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 69 Q 9.92 3.48 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.54 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 70 G 8.49 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 71 V 7.76 4.00 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 1.05 0.00 0.00 0.89 0.00 0.00 72 T 8.16 4.89 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 1.19 0.00 0.00 73 F 8.71 4.29 0.00 3.28 3.39 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 74 H 7.86 4.67 0.00 3.18 3.34 0.00 5.67 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 D 8.09 4.39 0.00 2.03 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 0.00 0.00 0.00 76 F 7.80 5.33 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 77 T 8.93 4.80 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 1.24 0.00 0.00 78 I 9.19 4.88 1.95 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 0.56 0.79 0.00 0.00 79 S 8.81 5.01 0.00 3.85 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 80 H 8.58 5.23 0.00 3.09 3.20 0.00 5.89 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 D 8.65 4.77 0.00 2.92 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 82 K 8.54 3.98 0.00 1.78 1.93 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.48 7.81 83 L 7.99 4.28 0.00 1.75 1.71 0.93 1.00 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 84 G 8.20 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 85 K 8.52 4.27 0.00 1.89 2.02 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.14 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.40 7.81 86 P 0.00 4.81 0.00 2.04 1.97 0.00 3.77 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 2.15 1.99 0.00 87 L 8.97 4.86 0.00 1.49 1.53 0.92 0.40 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 88 L 8.55 5.13 0.00 1.60 1.53 1.06 1.00 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 89 I 8.81 4.62 1.88 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 1.23 0.66 0.90 0.00 0.00 90 L 8.54 5.17 0.00 1.46 1.44 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 91 S 8.62 4.35 0.00 3.76 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 92 G 8.72 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 93 Q 8.52 3.90 0.00 2.12 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.54 2.44 0.00 94 A 7.89 3.83 0.88 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 95 A 7.72 3.87 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 96 E 8.07 3.88 0.00 2.17 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 2.49 0.00 97 L 8.23 4.00 0.00 1.65 1.70 0.90 1.14 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 98 A 8.26 4.01 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 99 S 8.25 4.00 0.00 3.98 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 0.00 100 Q 7.88 4.07 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.67 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 101 L 7.69 4.25 0.00 1.78 1.71 0.97 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 102 Q 8.11 3.56 0.00 2.29 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 7.00 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 103 V 7.93 4.08 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 0.71 0.00 0.00 0.93 0.00 0.00 104 E 9.21 4.71 0.00 1.92 1.89 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 2.20 2.24 0.00 105 N 8.06 5.11 0.00 2.63 2.54 0.00 0.00 6.93 7.26 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 0.00 106 I 8.27 4.90 1.83 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 1.33 0.58 0.91 0.00 0.00 107 H 9.19 5.02 0.00 3.02 3.14 0.00 5.56 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 8.49 5.17 0.00 1.55 1.45 0.88 0.80 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 0.00 109 S 9.10 4.83 0.00 3.89 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 0.00 110 I 8.25 5.05 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.76 0.90 0.00 0.00 111 S 8.43 4.68 0.00 3.81 3.65 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.43 5.10 0.00 2.93 2.59 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 0.00 0.00 0.00 113 E 8.71 4.78 0.00 2.05 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 0.00 2.28 2.37 0.00 114 R 7.64 3.97 0.00 1.78 1.96 0.00 3.17 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 1.54 1.31 0.00 115 H 8.64 4.61 0.00 3.05 2.63 0.00 5.81 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 Y 7.99 5.35 0.00 2.94 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 0.00 117 A 9.27 5.45 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 *119 A 8.22 4.53 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 0.00 120 T 8.64 5.14 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 1.20 0.00 0.00 121 V 8.96 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 1.10 0.00 0.00 0.87 0.00 0.00 122 I 8.83 4.99 1.92 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.61 0.93 0.00 0.00 123 L 8.89 5.10 0.00 1.57 1.55 0.98 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 124 E 9.05 4.92 0.00 2.04 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 0.00 2.20 2.26 0.00 125 R 8.47 4.84 0.00 1.84 1.82 0.00 3.34 0.00 0.00 4.01 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.68 0.00 * Residues marked with a * may have inaccurate shift predictions.