NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 T 4.2092 8.1744 110.9453 61.5604 70.8881 173.4043 8 D 4.2715 7.8539 122.3473 51.2638 40.6124 173.9508 9 P 4.3723 0.0000 0.0000 65.5266 32.3830 177.3510 10 R 4.1694 7.8738 116.0121 57.0484 30.5079 176.8400 11 A 4.1230 7.4980 121.1704 51.3515 18.9099 177.1540 12 K 3.8316 8.7083 121.5665 56.7784 32.5602 176.3228 13 W 4.3985 8.8296 135.0000 57.1018 31.3963 175.4076 14 V 4.1175 7.5420 124.2980 60.1380 32.2167 173.4423 15 P 3.8114 0.0000 0.0000 62.0297 32.3400 175.2646 16 Q 4.6938 8.5487 116.8784 54.6539 31.6121 174.4019 17 D 5.4522 8.5637 116.0668 54.5187 41.7325 175.5327 18 N 5.0051 9.3444 113.0503 51.9323 38.2488 173.7998 19 D 4.3361 8.0744 119.0445 53.7676 42.9976 175.4045 20 I 2.9172 8.0161 120.6262 62.2797 38.0516 176.5116 21 Q 4.2453 8.2811 119.0078 56.0719 29.0938 175.2501 22 A 4.8591 7.4584 121.4192 50.3671 21.0101 178.0741 23 C 4.5279 8.7871 118.0537 61.9843 28.5993 174.3920 24 D 4.8769 8.1362 118.6209 52.8785 39.6101 175.4014 25 Y 4.6344 8.2407 122.6926 57.5416 39.2531 177.0185 26 W 4.4473 7.9813 124.4695 59.7136 28.0967 177.5411 27 R 3.4727 5.8400 115.3731 57.6825 29.9243 176.3158 28 H 5.1106 8.4084 116.0336 56.0121 28.7727 174.4868 29 C 3.0607 8.4045 117.7450 57.1911 42.3806 174.0524 30 S 5.0761 8.0626 114.0752 56.5686 62.4670 174.0647 31 I 3.3685 7.6614 118.1115 60.3475 39.1606 174.3465 32 D 4.7396 8.8723 126.4103 54.4901 44.2655 172.1375 33 G 4.1538 7.7677 119.4818 44.1780 0.0000 175.0602 34 N 5.4330 9.2809 123.3944 50.9204 42.4118 173.3479 35 I 4.1906 8.2024 122.9987 60.9911 37.7465 176.7951 36 C 4.3027 8.6111 124.1197 59.8251 34.6334 175.6889 37 D 4.2294 8.1171 118.7286 57.0480 40.8570 177.9113 38 C 4.6955 8.0540 114.6602 57.6202 40.4840 173.8495 39 S 4.6320 7.9438 114.1810 58.0938 63.0093 174.8058 40 G 4.0500 8.8414 108.0687 46.1123 0.0000 175.4466 41 G 4.0721 7.6810 112.6800 45.0555 0.0000 171.8943 42 S 5.0293 8.5364 115.3823 56.6273 66.1985 174.2199 43 L 3.9340 8.7041 120.7723 58.2372 41.6595 178.6455 44 T 4.9148 7.7325 105.4418 60.9434 69.5787 172.8630 45 N 5.0435 7.7892 118.3348 52.1515 42.4087 173.5021 46 C 4.7166 8.4901 118.5515 55.7374 36.4160 172.1847 47 P 4.6369 0.0000 0.0000 61.5674 31.6666 174.4466 48 P 4.2141 0.0000 0.0000 64.2607 31.6646 177.1260 49 G 4.0135 9.1311 109.5987 46.3955 0.0000 173.3038 50 T 4.2990 6.6971 109.1221 60.1153 71.3881 174.1567 51 K 4.5737 8.6021 120.7195 54.3889 35.6361 175.3680 52 L 4.7740 8.4115 126.6361 54.0506 43.3081 175.9151 53 A 4.5311 8.7596 128.7929 52.3517 19.1314 177.0906 54 T 4.3710 8.6574 108.8028 62.7563 70.6550 175.4407 55 A 4.6171 8.1562 124.3940 52.4241 19.6711 176.8180 56 S 4.5425 7.6547 112.2354 58.0830 64.8579 173.9803 *58 V 4.3360 8.1709 118.6744 62.3240 32.4543 174.9813 59 A 4.8905 8.6974 122.4321 50.7157 23.2578 175.0745 60 S 5.0307 8.7722 114.9740 57.4641 63.5229 173.9138 61 C 5.2776 9.6094 125.8307 55.3649 40.7291 172.6081 62 Y 4.7344 9.0336 125.3413 57.2253 40.2258 173.3424 63 N 3.9601 8.2588 126.5947 50.8557 39.2959 173.8475 64 P 4.0239 0.0000 0.0000 65.5032 31.9489 178.2390 65 T 3.8325 7.8095 116.1283 66.2786 68.2388 175.0047 66 D 4.5761 7.5586 116.3665 52.3359 40.0088 176.9460 67 G 3.7911 7.7418 107.6175 45.8862 0.0000 173.5846 68 Q 4.4665 7.7823 118.7037 54.4136 31.5678 174.5606 69 S 5.1581 8.1313 116.6799 57.1976 65.4898 172.8622 70 Y 5.1340 8.9991 122.1152 56.0965 41.3552 174.8675 71 L 4.8553 9.1385 123.2375 54.4756 43.3456 175.8052 72 I 4.5218 8.7262 125.3337 59.5586 39.1756 174.7257 73 A 4.4195 7.9690 129.9233 49.9493 19.6138 175.6986 74 Y 4.4298 8.0826 118.9159 58.7919 39.4851 175.9392 75 R 4.9110 8.4922 120.4398 54.6068 34.8355 174.2130 76 D 5.1590 8.8458 122.0052 54.1473 43.1262 175.7479 77 C 5.1689 9.2294 119.5950 55.7583 42.7260 172.4476 78 C 5.2335 9.2950 120.6600 55.4529 44.4827 175.0043 79 G 4.1495 9.5634 107.5114 45.4110 0.0000 172.9614 80 Y 4.8857 7.4232 115.6996 55.4122 41.9292 174.4389 81 N 4.5173 8.6081 120.3921 53.2427 38.5784 175.0839 82 V 4.1327 8.6017 121.6417 61.2402 31.8803 177.5372 83 S 4.2024 8.4385 117.9438 59.6471 62.9575 175.8011 84 G 3.9692 7.7003 104.8696 45.2095 0.0000 173.0755 85 R 4.5197 7.6971 118.2918 55.6971 33.1872 175.4536 86 C 4.3728 8.7514 117.6301 57.4913 37.6882 171.1652 87 P 5.0341 0.0000 0.0000 63.3512 32.4487 177.4735 88 C 4.8142 9.2235 119.0456 58.5301 33.3093 173.0931 89 L 4.9000 8.4844 123.6703 53.7795 44.1564 174.8473 90 N 5.0862 9.0044 123.9396 50.9183 42.8636 174.6304 91 T 5.0574 7.4922 109.0364 61.0608 68.9096 173.8237 92 E 4.0869 8.4234 122.5651 58.2680 29.9623 177.6152 93 G 3.7871 8.7964 110.9872 45.9393 0.0000 172.4426 94 E 4.3594 7.8943 121.1907 55.9104 30.2908 176.2783 95 L 4.7293 8.4482 126.2224 52.1914 45.3549 174.0721 96 P 4.6331 0.0000 0.0000 61.9809 32.3484 178.1775 97 V 3.6056 8.4296 120.0076 64.8915 31.2632 177.0059 98 Y 4.3542 7.9320 116.6841 58.4221 38.8713 176.1384 99 R 4.5981 7.4001 122.2207 54.2154 29.5115 175.0086 100 P 4.5037 0.0000 0.0000 65.4517 32.2287 179.4203 101 E 3.7136 8.1824 117.5919 58.4396 29.6297 177.4623 102 F 4.9556 8.3796 115.9030 56.8694 39.5960 174.1556 103 A 5.3299 8.4883 123.9725 49.8912 20.3538 177.0968 104 N 5.0783 9.5607 119.0698 52.7821 37.7237 175.3502 105 D 4.7056 7.8552 117.5982 55.1482 41.5085 176.7492 106 I 3.6097 7.2534 120.2930 60.5958 37.6174 175.8071 107 I 3.8374 7.7801 125.6428 60.7127 36.9214 177.1626 108 W 4.6682 8.4836 131.6339 55.9163 28.0049 176.4635 109 C 4.6858 6.9957 113.7036 56.5280 37.8243 174.4946 110 F 4.5904 7.2216 120.0220 58.9725 38.9307 176.4345 111 G 4.4110 9.3651 111.4046 46.3476 0.0000 173.7702 112 A 4.3883 7.6154 122.4137 51.1016 19.2312 176.9646 113 E 3.9251 8.5565 121.4094 57.5804 30.2912 176.8086 114 D 4.2353 8.9225 121.8542 54.6776 38.2809 173.3600 115 D 4.3948 7.8695 115.2052 54.5871 39.1425 174.0759 116 A 4.0921 7.7621 120.7414 53.2889 18.6631 178.3617 117 M 4.7163 8.4153 119.1425 54.5962 34.7759 175.5061 118 T 4.3827 7.6609 109.9925 61.2150 71.1606 172.8927 119 Y 4.2353 8.5184 124.6867 57.3302 40.1070 174.2604 120 H 4.7082 7.9846 126.2374 57.0657 32.0288 171.5418 121 C 4.9296 6.4627 109.7518 55.1893 40.3815 172.0300 122 T 5.3084 8.7625 115.7799 61.8046 71.4904 174.0150 123 I 4.3864 8.9496 119.4345 59.1684 40.4911 175.1169 124 S 4.9575 8.2101 116.8018 56.6683 61.9003 172.8381 125 P 4.4023 0.0000 0.0000 62.1073 32.8050 176.3143 126 I 4.4083 8.0116 121.5052 61.3561 37.7117 176.1304 127 V 4.3732 8.6028 117.0688 61.0236 33.8036 175.0693 128 G 4.1033 7.5887 106.3492 45.6719 0.0000 172.6366 129 K 4.7784 8.7170 118.8308 55.5435 33.1280 177.3838 130 A 4.2717 8.3463 124.7627 51.6426 19.5982 177.8810 131 S 4.5699 8.7585 112.8672 57.9282 63.0659 174.4625 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 7 T 8.17 4.21 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 1.23 0.00 0.00 8 D 7.85 4.27 0.00 2.88 2.65 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 9 P 0.00 4.37 0.00 2.24 2.21 0.00 3.83 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 10 R 7.87 4.17 0.00 1.80 2.04 0.00 3.18 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 11 A 7.50 4.12 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 12 K 8.71 3.83 0.00 1.77 1.82 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.53 1.53 7.81 13 W 8.83 4.40 0.00 3.24 3.20 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 14 V 7.54 4.12 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 0.82 0.00 0.00 0.96 0.00 0.00 15 P 0.00 3.81 0.00 2.25 1.93 0.00 3.72 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.22 0.00 16 Q 8.55 4.69 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.96 0.00 0.00 0.00 0.00 0.00 2.22 2.41 0.00 17 D 8.56 5.45 0.00 2.53 2.64 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 18 N 9.34 5.01 0.00 2.79 2.90 0.00 0.00 6.53 7.92 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 19 D 8.07 4.34 0.00 2.68 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.02 2.92 1.31 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.55 0.13 0.00 0.00 21 Q 8.28 4.25 0.00 2.19 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.72 0.00 0.00 0.00 0.00 0.00 2.33 2.25 0.00 22 A 7.46 4.86 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 23 C 8.79 4.53 0.00 3.14 3.20 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 24 D 8.14 4.88 0.00 2.52 2.74 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 0.00 0.00 0.00 0.00 25 Y 8.24 4.63 0.00 3.36 2.86 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 26 W 7.98 4.45 0.00 3.75 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 27 R 5.84 3.47 0.00 1.49 1.51 0.00 3.03 0.00 0.00 2.79 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 28 H 8.41 5.11 0.00 3.56 3.38 0.00 5.63 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 C 8.40 3.06 0.00 2.58 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 30 S 8.06 5.08 0.00 3.96 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 31 I 7.66 3.37 1.73 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 1.02 1.21 0.89 0.00 0.00 32 D 8.87 4.74 0.00 2.74 2.39 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 33 G 7.77 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 N 9.28 5.43 0.00 2.80 2.82 0.00 0.00 7.39 6.75 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 35 I 8.20 4.19 1.86 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 1.08 0.55 0.96 0.00 0.00 36 C 8.61 4.30 0.00 2.92 3.10 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 37 D 8.12 4.23 0.00 2.71 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.05 4.70 0.00 3.15 3.10 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 39 S 7.94 4.63 0.00 4.00 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 40 G 8.84 4.05 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 0.00 0.00 0.00 41 G 7.68 4.07 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 0.00 42 S 8.54 5.03 0.00 3.92 3.93 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 43 L 8.70 3.93 0.00 1.65 1.67 0.91 0.58 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 44 T 7.73 4.91 4.21 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 1.17 0.00 0.00 45 N 7.79 5.04 0.00 2.64 2.65 0.00 0.00 7.07 7.55 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 46 C 8.49 4.72 0.00 2.89 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 47 P 0.00 4.64 0.00 1.99 2.09 0.00 3.49 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.14 0.00 48 P 0.00 4.21 0.00 2.02 1.97 0.00 3.64 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 49 G 9.13 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 0.00 0.00 0.00 50 T 6.70 4.30 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 0.27 0.00 0.00 51 K 8.60 4.57 0.00 1.61 1.69 0.00 1.66 0.00 0.00 1.54 0.00 0.00 2.78 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.31 1.63 7.81 52 L 8.41 4.77 0.00 1.74 1.51 0.96 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.76 4.53 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 54 T 8.66 4.37 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 1.28 0.00 0.00 55 A 8.16 4.62 1.72 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 56 S 7.65 4.54 0.00 3.81 3.70 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 *58 V 8.17 4.34 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 0.65 0.00 0.00 0.98 0.00 0.00 59 A 8.70 4.89 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.77 5.03 0.00 3.96 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 C 9.61 5.28 0.00 3.18 3.56 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 62 Y 9.03 4.73 0.00 3.15 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 63 N 8.26 3.96 0.00 1.44 2.22 0.00 0.00 6.58 8.42 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 64 P 0.00 4.02 0.00 2.13 2.18 0.00 3.23 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.06 0.00 65 T 7.81 3.83 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 1.11 0.00 0.00 66 D 7.56 4.58 0.00 2.67 2.65 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 67 G 7.74 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 68 Q 7.78 4.47 0.00 1.49 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.69 6.72 0.00 0.00 0.00 0.00 0.00 2.48 2.35 0.00 69 S 8.13 5.16 0.00 3.75 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 70 Y 9.00 5.13 0.00 3.37 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 71 L 9.14 4.86 0.00 1.87 1.63 1.00 0.90 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 72 I 8.73 4.52 1.40 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.89 0.15 0.00 0.00 73 A 7.97 4.42 1.13 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 74 Y 8.08 4.43 0.00 2.93 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 75 R 8.49 4.91 0.00 1.72 1.78 0.00 3.08 0.00 0.00 3.32 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.77 0.00 76 D 8.85 5.16 0.00 2.90 2.65 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 77 C 9.23 5.17 0.00 2.69 2.86 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 78 C 9.29 5.23 0.00 2.83 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 79 G 9.56 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 80 Y 7.42 4.89 0.00 2.69 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 81 N 8.61 4.52 0.00 2.64 2.74 0.00 0.00 7.03 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 82 V 8.60 4.13 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 1.04 0.00 0.00 1.12 0.00 0.00 83 S 8.44 4.20 0.00 3.95 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 84 G 7.70 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 85 R 7.70 4.52 0.00 1.80 1.83 0.00 3.33 0.00 0.00 3.44 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 86 C 8.75 4.37 0.00 3.08 3.08 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 87 P 0.00 5.03 0.00 2.08 2.07 0.00 3.78 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 88 C 9.22 4.81 0.00 2.81 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 89 L 8.48 4.90 0.00 1.51 1.48 0.89 0.87 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 90 N 9.00 5.09 0.00 2.42 2.01 0.00 0.00 6.16 6.99 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 91 T 7.49 5.06 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 1.13 0.00 0.00 92 E 8.42 4.09 0.00 1.90 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 1.89 2.20 0.00 93 G 8.80 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 94 E 7.89 4.36 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 2.61 2.41 0.00 95 L 8.45 4.73 0.00 1.71 1.43 0.82 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 96 P 0.00 4.63 0.00 1.69 2.05 0.00 3.21 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.08 0.00 97 V 8.43 3.61 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 0.84 0.00 0.00 0.93 0.00 0.00 98 Y 7.93 4.35 0.00 3.14 3.14 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 99 R 7.40 4.60 0.00 1.83 2.02 0.00 3.38 0.00 0.00 3.33 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.44 0.00 100 P 0.00 4.50 0.00 2.61 2.55 0.00 3.75 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.08 0.00 101 E 8.18 3.71 0.00 1.38 1.42 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 2.07 2.16 0.00 102 F 8.38 4.96 0.00 3.08 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 0.00 103 A 8.49 5.33 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 0.00 104 N 9.56 5.08 0.00 2.69 2.88 0.00 0.00 7.02 8.03 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 0.00 105 D 7.86 4.71 0.00 2.62 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 0.00 106 I 7.25 3.61 1.03 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 1.11 0.27 -0.42 0.00 0.00 107 I 7.78 3.84 1.68 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.68 0.97 0.00 0.00 108 W 8.48 4.67 0.00 3.46 3.10 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 0.00 109 C 7.00 4.69 0.00 2.75 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 0.00 110 F 7.22 4.59 0.00 3.27 3.03 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 0.00 111 G 9.37 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 0.00 0.00 0.00 0.00 112 A 7.62 4.39 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 0.00 113 E 8.56 3.93 0.00 2.01 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 2.38 2.34 0.00 114 D 8.92 4.24 0.00 2.88 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 0.00 115 D 7.87 4.39 0.00 2.81 2.74 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 0.00 0.00 0.00 0.00 116 A 7.76 4.09 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 0.00 117 M 8.42 4.72 0.00 1.90 2.02 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.57 0.00 118 T 7.66 4.38 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 0.00 119 Y 8.52 4.24 0.00 3.16 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 0.00 120 H 7.98 4.71 0.00 3.17 3.18 0.00 5.87 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 0.00 121 C 6.46 4.93 0.00 3.10 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 0.00 122 T 8.76 5.31 4.36 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 1.41 0.00 0.00 123 I 8.95 4.39 2.02 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 1.37 0.91 0.93 0.00 0.00 124 S 8.21 4.96 0.00 3.76 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 0.00 125 P 0.00 4.40 0.00 2.15 2.11 0.00 3.63 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 2.11 1.93 0.00 126 I 8.01 4.41 1.84 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.44 1.05 0.00 0.00 127 V 8.60 4.37 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 0.62 0.00 0.00 0.96 0.00 0.00 128 G 7.59 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 0.00 129 K 8.72 4.78 0.00 1.64 1.66 0.00 1.51 0.00 0.00 1.09 0.00 0.00 2.63 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.33 7.81 130 A 8.35 4.27 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 0.00 131 S 8.76 4.57 0.00 3.93 3.94 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.