NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2424 8.1133 119.5882 55.9822 32.3038 173.7812 3 F 5.2598 8.4303 118.9249 54.2230 42.3911 172.7818 4 R 4.8897 9.8792 119.5192 54.5300 33.5420 172.2641 5 P 4.4785 0.0000 0.0000 62.5792 31.9883 176.0416 6 F 5.1091 7.7385 116.7956 55.4421 40.3292 174.3818 7 T 4.8633 8.9040 111.1213 59.5997 71.9738 174.4527 8 E 3.9966 8.7826 119.3481 59.6711 29.4399 179.3584 9 E 4.1153 7.7919 116.5966 58.6136 29.7400 177.7518 10 D 4.7038 8.3299 118.8030 54.0038 40.9293 177.5505 11 L 3.7965 7.6226 123.1511 58.6158 41.9427 178.9069 12 D 4.3430 7.9872 117.9968 57.1809 40.5669 178.6531 13 R 3.9100 7.8716 117.2718 59.4715 30.5854 178.6130 14 L 4.0045 7.8410 118.5331 57.8333 41.6112 179.3948 15 N 4.4236 8.1847 116.3310 56.0369 38.2297 177.6797 16 R 3.9962 8.2293 119.3479 58.6907 30.1900 178.1082 17 L 4.4244 7.6704 116.0899 55.4849 42.5851 177.7084 18 A 4.5233 8.0485 120.1616 51.8378 19.0877 178.3639 19 G 3.6874 8.3731 106.0995 47.0965 0.0000 174.7278 20 K 4.4081 8.7534 124.2826 56.3539 32.0301 177.3790 21 R 4.5468 7.4421 119.3934 53.0710 29.9524 173.7354 22 P 4.5013 0.0000 0.0000 62.3267 32.3276 175.9271 23 V 4.1873 8.3525 120.8585 61.4183 32.6979 176.8061 24 S 4.5008 8.3343 122.1304 57.5446 65.4152 174.9286 25 L 4.0378 8.4172 124.0653 58.1879 41.8702 179.1858 26 G 3.7168 8.1936 105.0145 47.9786 0.0000 175.2583 27 A 4.1477 8.1037 123.4768 54.6132 18.3690 179.3736 28 L 4.0688 8.1632 118.8815 58.6121 41.9660 179.5408 29 R 4.0017 8.2228 116.9368 59.0624 30.1504 178.4930 30 F 4.2125 8.3046 120.4855 61.5424 39.3053 177.2971 31 F 4.1453 8.5146 116.7925 60.0471 38.5343 177.6725 32 A 3.5472 8.2129 119.9659 54.4788 18.2205 179.0393 33 R 4.0479 7.3261 114.9847 57.5652 30.4436 177.7662 34 T 3.7880 7.3155 109.1319 62.3914 69.1884 176.1514 35 G 3.7333 8.1099 108.4087 45.6969 0.0000 172.9114 36 H 5.1720 7.8849 113.4631 54.1051 30.5178 173.4662 37 S 5.1024 7.5353 114.4066 56.9571 65.1042 173.3099 38 F 5.1506 9.1695 120.8744 56.1518 44.2776 172.9680 39 L 5.5392 9.4537 121.4710 53.4856 45.3328 174.7773 40 A 5.2861 9.0384 127.7508 50.2179 20.9444 175.9533 41 E 4.7284 8.6906 119.2677 54.6299 33.3707 174.8288 42 E 4.3374 9.1671 123.8384 55.0280 30.9552 175.9756 43 G 3.6898 8.1092 118.2304 47.2938 0.0000 174.2988 44 E 4.1883 8.8308 123.5267 56.5818 29.9406 175.5436 45 E 4.2631 8.1321 122.3221 54.0634 30.2356 174.2304 46 P 4.7127 0.0000 0.0000 62.6945 32.2321 175.0444 *48 G 3.9555 8.1797 105.4646 46.4344 0.0000 171.3396 49 F 5.7984 8.2396 113.5077 55.4473 41.5110 173.7621 50 A 5.0067 9.8319 121.4366 50.3694 22.4102 174.8371 51 L 4.8534 9.0926 123.0610 52.9179 43.6568 175.7000 52 A 5.4031 8.8006 124.7639 51.1988 22.8621 174.7824 53 Q 4.7725 9.0279 115.9994 54.8759 32.7049 173.3954 54 A 4.8402 8.5929 122.1985 51.5011 19.9028 177.0630 55 V 4.4018 8.9674 122.5876 60.4438 34.3123 174.6070 56 W 4.6530 9.1608 135.0000 57.4993 31.1134 175.5924 57 Q 4.4200 7.8631 125.0752 55.7623 29.0224 175.2818 58 G 4.2156 6.5836 110.6608 45.8833 0.0000 175.2175 59 E 4.3916 6.9581 115.5937 55.8714 31.9664 175.2302 60 A 4.0311 5.8000 119.2417 51.3094 22.2293 174.3539 61 T 5.0147 8.2089 115.9030 62.6147 70.9445 174.1173 62 T 5.0183 8.7547 122.6373 61.8411 71.3974 173.7831 63 V 4.4638 8.8246 127.2245 62.0386 32.8360 174.3082 64 L 4.9429 8.7439 131.5564 53.8536 43.6109 175.4366 65 V 4.1766 8.6600 127.9389 62.2472 31.2315 175.8972 66 T 4.0886 8.6411 126.4128 66.4921 68.6495 174.0866 67 R 4.4993 7.3001 118.9770 55.2789 34.1897 173.1342 *69 E 4.1257 8.6799 118.0368 56.2538 31.1123 175.5884 70 G 4.2316 7.9279 104.6357 46.2776 0.0000 173.7428 71 R 4.5167 8.9674 121.8711 56.3580 31.1494 176.8256 72 S 4.7455 7.4063 112.3965 55.7575 67.0838 174.8223 73 V 3.5528 8.4128 122.3908 66.3213 31.2197 177.8605 74 E 3.9505 8.2262 118.1857 59.2652 29.5188 178.5621 75 A 4.2317 8.0597 120.7262 55.2349 18.3989 179.6542 76 L 3.9376 7.9913 117.5216 57.9482 41.6289 179.9012 77 R 3.9321 8.4504 118.5886 59.3350 30.0547 179.4648 78 G 2.7964 8.1254 105.3428 47.2106 0.0000 175.8916 79 L 3.8895 7.8867 121.2688 57.5295 41.6545 179.3742 80 L 3.9345 8.0024 119.1731 57.9724 41.4666 179.8898 81 R 3.8793 8.0174 117.8058 58.9912 29.9463 179.0468 82 A 3.5354 7.5914 120.5776 54.8382 18.1637 179.8124 83 V 3.7519 7.8170 117.1150 66.2412 31.6614 178.3764 84 V 3.6168 8.2452 118.3756 65.9555 31.3262 177.9138 85 K 4.1115 8.3515 119.9263 59.4859 32.1025 178.9776 86 S 4.2439 8.3833 114.4996 61.2546 62.9170 176.4702 87 A 4.1725 8.4572 124.5996 55.1122 18.1518 178.9480 88 Y 4.0330 8.6185 118.3922 61.1405 38.7168 178.0891 89 D 4.1178 8.3078 118.0455 56.9375 41.0263 177.1085 90 A 4.2957 7.6661 118.4416 51.6153 18.8286 177.5622 91 G 3.8520 8.0502 104.1390 46.2660 0.0000 174.4362 92 V 3.8757 7.7630 119.3951 62.5314 32.0903 175.6716 93 Y 4.3853 8.5651 128.7080 60.5000 39.2800 175.0910 94 E 4.6137 8.0384 114.7074 55.1096 33.3411 174.0082 95 V 4.9685 8.2058 119.7606 61.1397 33.8657 174.4639 96 A 5.1397 9.2879 129.1447 50.3760 22.5537 174.5566 97 L 4.7053 8.3991 118.9701 55.2404 43.8509 174.2240 98 H 4.7737 8.5749 116.7064 54.0023 30.1372 174.2330 99 L 4.4499 8.3473 126.4251 53.1096 43.2706 174.9677 100 D 4.5634 8.5164 126.1288 52.9897 41.5128 175.0810 101 P 4.2871 0.0000 0.0000 65.1904 31.4993 177.3225 102 E 4.0819 8.2579 116.5746 57.9071 29.7821 178.0712 103 R 4.2813 7.9897 119.5186 55.1611 29.4752 176.7680 104 K 4.0678 8.2291 124.2038 58.8580 32.3953 178.8060 105 E 3.9238 8.0258 118.5499 59.3426 29.4186 178.9075 106 L 3.8460 7.8065 119.8647 57.9095 42.1740 178.3430 107 E 3.8440 8.1595 119.2974 59.2542 29.6162 178.3404 108 E 3.8635 8.2531 119.0036 59.3364 29.6810 178.6820 109 A 3.9620 8.1418 120.7929 54.9840 18.3629 179.4935 110 L 3.6055 8.0558 117.7778 57.8883 41.8579 179.8057 111 K 3.9316 7.9655 117.9697 59.6814 31.8219 179.3226 112 A 4.1276 7.9827 119.4304 54.2476 18.2193 178.4172 113 E 4.6396 7.8953 115.6035 56.0202 30.1940 176.4850 114 G 3.8445 7.8373 105.5011 46.3059 0.0000 174.0387 115 F 4.2906 8.4128 117.8092 55.8200 39.9641 175.5900 116 A 4.2512 8.4592 128.0028 51.6055 19.0873 176.6345 117 L 4.4341 8.5495 123.4375 53.7265 42.9381 178.1902 118 G 3.9466 8.5647 114.5851 44.2469 0.0000 170.8606 119 P 4.5966 0.0000 0.0000 62.7643 31.8512 176.2935 120 L 4.2098 7.6543 119.4340 54.8185 42.2551 176.3072 121 V 4.4230 7.9415 120.7804 60.6063 34.2680 174.8256 122 L 4.0823 8.5619 128.1443 54.6368 42.4859 175.6154 123 A 4.7551 8.4996 128.8248 50.2538 21.0051 175.6158 124 V 4.4189 8.1808 121.5939 60.8321 34.7164 174.3898 125 R 4.4742 8.5237 125.9171 54.3762 32.0298 174.5546 126 V 4.1396 8.3835 125.3264 61.7776 32.4473 175.1245 127 L 4.2378 8.6375 126.8386 54.6308 42.6942 177.1093 128 G 3.9330 8.2645 102.6325 45.0636 0.0000 172.1302 129 S 4.7781 7.8781 113.9074 56.3762 64.7939 175.0482 130 R 4.0950 8.4623 121.0173 56.7246 29.7526 176.7389 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 R 8.11 4.24 0.00 1.64 1.86 0.00 3.21 0.00 0.00 3.34 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 3 F 8.43 5.26 0.00 2.96 2.94 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 4 R 9.88 4.89 0.00 1.96 2.09 0.00 2.84 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.73 0.00 5 P 0.00 4.48 0.00 1.86 1.76 0.00 3.70 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 2.00 2.02 0.00 6 F 7.74 5.11 0.00 3.11 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 7 T 8.90 4.86 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 1.24 0.00 0.00 8 E 8.78 4.00 0.00 2.07 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 2.45 2.38 0.00 9 E 7.79 4.12 0.00 1.99 2.02 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 2.37 2.44 0.00 10 D 8.33 4.70 0.00 2.83 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 11 L 7.62 3.80 0.00 1.84 1.64 0.89 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 12 D 7.99 4.34 0.00 2.71 2.68 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 13 R 7.87 3.91 0.00 1.94 2.00 0.00 3.44 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 14 L 7.84 4.00 0.00 1.52 1.10 0.53 -0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 15 N 8.18 4.42 0.00 2.81 2.84 0.00 0.00 7.02 7.37 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 16 R 8.23 4.00 0.00 1.94 2.01 0.00 3.15 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.76 0.00 17 L 7.67 4.42 0.00 2.18 1.81 1.15 0.69 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 18 A 8.05 4.52 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 19 G 8.37 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 0.00 0.00 0.00 20 K 8.75 4.41 0.00 1.77 1.85 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.46 7.81 21 R 7.44 4.55 0.00 1.83 1.88 0.00 3.19 0.00 0.00 3.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 22 P 0.00 4.50 0.00 2.04 2.06 0.00 3.67 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 2.03 2.08 0.00 23 V 8.35 4.19 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 0.67 0.00 0.00 0.64 0.00 0.00 24 S 8.33 4.50 0.00 4.09 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 25 L 8.42 4.04 0.00 1.78 1.71 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.19 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 27 A 8.10 4.15 1.54 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 0.00 0.00 28 L 8.16 4.07 0.00 1.68 1.92 0.87 1.09 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 29 R 8.22 4.00 0.00 2.03 2.03 0.00 3.26 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.83 0.00 30 F 8.30 4.21 0.00 2.94 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 31 F 8.51 4.15 0.00 3.56 3.25 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 32 A 8.21 3.55 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 33 R 7.33 4.05 0.00 1.71 1.83 0.00 3.14 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 1.57 1.65 0.00 34 T 7.32 3.79 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 0.88 0.00 0.00 35 G 8.11 3.73 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 0.00 0.00 0.00 36 H 7.88 5.17 0.00 3.28 3.39 0.00 5.59 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.54 5.10 0.00 3.40 3.89 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 38 F 9.17 5.15 0.00 3.13 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 39 L 9.45 5.54 0.00 2.10 1.87 1.12 1.07 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 40 A 9.04 5.29 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 41 E 8.69 4.73 0.00 2.07 1.85 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 2.15 2.18 0.00 42 E 9.17 4.34 0.00 1.99 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 2.19 2.24 0.00 43 G 8.11 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 0.00 0.00 0.00 44 E 8.83 4.19 0.00 1.96 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 2.29 2.28 0.00 45 E 8.13 4.26 0.00 2.05 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 2.27 2.28 0.00 46 P 0.00 4.71 0.00 2.25 2.08 0.00 3.85 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 *48 G 8.18 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 49 F 8.24 5.80 0.00 3.10 2.98 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 50 A 9.83 5.01 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 51 L 9.09 4.85 0.00 0.97 0.13 0.66 0.55 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 52 A 8.80 5.40 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 53 Q 9.03 4.77 0.00 2.19 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.91 0.00 0.00 0.00 0.00 0.00 2.49 2.49 0.00 54 A 8.59 4.84 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 55 V 8.97 4.40 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 1.10 0.00 0.00 1.05 0.00 0.00 56 W 9.16 4.65 0.00 3.41 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 57 Q 7.86 4.42 0.00 1.77 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.86 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 58 G 6.58 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 0.00 0.00 0.00 0.00 59 E 6.96 4.39 0.00 1.58 1.73 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 2.08 2.05 0.00 60 A 5.80 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 T 8.21 5.01 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 1.36 0.00 0.00 62 T 8.75 5.02 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 1.26 0.00 0.00 63 V 8.82 4.46 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 0.99 0.00 0.00 0.73 0.00 0.00 64 L 8.74 4.94 0.00 1.91 1.64 0.97 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 65 V 8.66 4.18 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 0.90 0.00 0.00 1.00 0.00 0.00 66 T 8.64 4.09 4.34 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 1.34 0.00 0.00 67 R 7.30 4.50 0.00 1.88 1.83 0.00 3.29 0.00 0.00 3.57 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 *69 E 8.68 4.13 0.00 1.16 1.57 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 1.53 1.86 0.00 70 G 7.93 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 0.00 0.00 0.00 0.00 71 R 8.97 4.52 0.00 1.80 1.97 0.00 3.22 0.00 0.00 3.28 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 72 S 7.41 4.75 0.00 3.99 3.90 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 73 V 8.41 3.55 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 1.09 0.00 0.00 1.01 0.00 0.00 74 E 8.23 3.95 0.00 2.10 1.97 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 2.50 2.45 0.00 75 A 8.06 4.23 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 76 L 7.99 3.94 0.00 1.83 1.66 0.87 0.83 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 77 R 8.45 3.93 0.00 1.92 2.08 0.00 3.11 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.80 0.00 78 G 8.13 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 0.00 0.00 0.00 79 L 7.89 3.89 0.00 1.87 1.77 1.02 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 80 L 8.00 3.93 0.00 1.77 1.71 0.65 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.02 3.88 0.00 1.71 1.79 0.00 3.02 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.71 0.00 82 A 7.59 3.54 0.27 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 83 V 7.82 3.75 2.28 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 1.21 0.00 0.00 1.25 0.00 0.00 84 V 8.25 3.62 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 0.73 0.00 0.00 1.09 0.00 0.00 85 K 8.35 4.11 0.00 1.86 1.74 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.64 1.50 7.81 86 S 8.38 4.24 0.00 4.40 4.45 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 87 A 8.46 4.17 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.62 4.03 0.00 3.03 3.16 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.31 4.12 0.00 2.76 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 90 A 7.67 4.30 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 91 G 8.05 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 0.00 0.00 0.00 92 V 7.76 3.88 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 0.88 0.00 0.00 1.02 0.00 0.00 93 Y 8.57 4.39 0.00 3.04 3.16 0.00 0.00 0.00 0.00 0.00 0.00 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 8.04 4.61 0.00 1.95 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.36 0.00 95 V 8.21 4.97 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 1.10 0.00 0.00 0.97 0.00 0.00 96 A 9.29 5.14 1.23 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 0.00 0.00 0.00 97 L 8.40 4.71 0.00 1.57 1.60 0.77 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 98 H 8.57 4.77 0.00 3.19 3.28 0.00 5.68 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.35 4.45 0.00 1.54 1.56 0.88 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 100 D 8.52 4.56 0.00 2.71 2.52 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 0.00 101 P 0.00 4.29 0.00 2.07 2.10 0.00 3.72 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 102 E 8.26 4.08 0.00 2.10 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 2.34 2.42 0.00 103 R 7.99 4.28 0.00 1.92 1.85 0.00 3.09 0.00 0.00 3.13 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 104 K 8.23 4.07 0.00 1.75 1.83 0.00 1.67 0.00 0.00 1.92 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.46 7.81 105 E 8.03 3.92 0.00 1.97 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 2.38 2.34 0.00 106 L 7.81 3.85 0.00 1.68 1.74 0.78 0.76 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 0.00 107 E 8.16 3.84 0.00 2.06 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 2.29 2.31 0.00 108 E 8.25 3.86 0.00 2.06 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 2.29 2.32 0.00 109 A 8.14 3.96 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 0.00 110 L 8.06 3.61 0.00 1.76 1.63 0.81 0.23 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 0.00 111 K 7.97 3.93 0.00 1.99 1.88 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.58 7.81 112 A 7.98 4.13 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 0.00 113 E 7.90 4.64 0.00 2.16 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 0.00 2.42 2.43 0.00 114 G 7.84 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 0.00 115 F 8.41 4.29 0.00 3.08 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 0.00 116 A 8.46 4.25 1.24 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 0.00 0.00 117 L 8.55 4.43 0.00 1.65 1.63 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 118 G 8.56 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 0.00 0.00 0.00 119 P 0.00 4.60 0.00 2.20 2.17 0.00 3.78 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.98 0.00 120 L 7.65 4.21 0.00 1.66 1.67 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 121 V 7.94 4.42 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 0.81 0.00 0.00 1.01 0.00 0.00 122 L 8.56 4.08 0.00 1.60 1.54 0.83 0.81 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 0.00 123 A 8.50 4.76 1.23 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 0.00 0.00 0.00 124 V 8.18 4.42 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 0.84 0.00 0.00 0.91 0.00 0.00 125 R 8.52 4.47 0.00 1.76 1.76 0.00 3.28 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.57 0.00 126 V 8.38 4.14 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 0.00 127 L 8.64 4.24 0.00 1.67 1.70 0.92 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.26 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 0.00 0.00 0.00 129 S 7.88 4.78 0.00 3.86 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 R 8.46 4.10 0.00 1.79 1.85 0.00 3.23 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 * Residues marked with a * may have inaccurate shift predictions.