NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5009 K 4.2439 8.3149 121.7892 55.7353 34.2177 176.1303 5010 K 3.6856 8.1201 117.8303 56.1271 32.3149 174.1699 5011 P 4.7657 0.0000 0.0000 62.5994 33.4069 175.2406 5012 K 4.8765 9.3329 119.8678 54.9247 36.9923 175.3373 5013 L 5.1517 8.9019 121.8156 53.1255 45.0345 175.8720 5014 L 5.2031 8.6408 122.2577 53.4769 43.9668 174.5305 5015 Y 4.9117 9.3923 127.2823 56.5580 40.4362 173.6594 5016 C 4.5866 8.5422 127.7959 57.5326 32.7675 174.1421 5017 S 4.0556 8.1580 121.1375 59.8594 62.6488 175.0564 5018 N 4.2259 7.9495 118.6072 56.0067 38.7199 175.4772 5019 G 3.9857 7.3685 101.2196 44.1835 0.0000 171.9614 5020 G 3.2510 7.7067 107.1612 46.7250 0.0000 173.2636 5021 H 4.9179 7.4368 115.0176 53.5794 32.0158 174.2285 5022 F 5.1151 9.1606 121.3024 56.3779 40.5559 175.1351 5023 L 4.4539 9.3676 126.6380 55.4401 43.2342 175.6127 5024 R 4.8321 9.4724 126.1895 54.6654 33.5616 173.9860 5025 I 4.8329 8.2976 127.1908 59.3314 38.3235 175.6155 5026 L 4.0883 8.9283 128.1102 53.5244 42.1997 177.0315 5027 P 4.2067 0.0000 0.0000 65.6198 31.2926 177.0697 5028 D 4.5276 8.0050 114.8939 53.4964 39.9655 177.0759 5029 G 4.0539 8.5561 110.0849 45.5400 0.0000 173.6205 5030 T 4.3173 8.1810 118.0597 63.1822 69.0021 173.5532 5031 V 4.8307 8.2344 125.9214 61.1021 33.8975 174.1709 5032 D 4.6235 8.7029 125.9568 52.8309 42.4207 174.0205 5033 G 4.5615 8.8228 105.0290 45.3675 0.0000 172.5405 5034 T 4.9911 8.7714 115.1090 60.5277 71.0243 174.6375 5035 R 4.2842 8.8644 124.9317 56.5851 30.5447 175.9772 5036 D 4.6463 8.1404 119.7760 53.3777 40.9859 176.7217 5037 R 3.6268 8.6683 127.4260 57.8592 30.4332 177.0900 5038 S 4.2639 8.3179 111.3652 59.7813 63.8119 174.1768 5039 D 4.3038 7.5553 120.4670 55.1578 41.0485 177.0354 5040 Q 4.0268 8.6204 124.1018 57.6983 29.2541 176.1171 5041 H 4.7893 9.4216 116.2625 55.4822 28.9064 175.8214 5042 I 4.5527 6.9979 110.9789 59.9094 38.2341 175.6190 5043 Q 4.2349 7.7680 121.6656 55.8119 29.2630 174.8558 5044 L 5.1966 9.1435 124.6908 52.8284 45.5983 175.5193 5045 Q 4.7002 8.8843 121.7125 54.4111 32.0628 173.7863 5046 L 5.2904 8.6891 126.6276 53.1885 43.4803 175.8283 5047 S 4.8054 8.9950 118.8283 56.4435 65.7391 173.0996 5048 A 5.0915 8.6396 126.5455 50.8195 18.6613 176.1843 5049 E 3.9122 9.1004 124.8535 58.8697 29.8251 178.3380 5050 S 4.5361 8.2768 112.1866 57.3037 64.9414 174.1114 5051 V 3.8343 8.0370 115.6351 62.9609 31.7413 177.3710 5052 G 4.0344 9.0161 112.0892 45.2770 0.0000 172.4029 5053 E 5.1376 7.7410 118.9660 54.9195 32.1378 175.6174 5054 V 5.0342 8.9992 115.4973 60.1051 36.8648 173.7315 5055 Y 5.2253 9.0404 120.3840 56.5193 40.9318 175.1131 5056 I 4.5919 8.6971 123.6864 59.6312 39.6973 174.1758 5057 K 4.7836 8.6359 128.7861 54.0185 35.4630 175.0634 5058 S 4.6588 8.8603 122.8075 58.4467 62.6531 174.9116 5059 T 3.8373 8.7314 118.5555 64.2817 68.7009 175.9023 5060 E 4.0500 8.3539 123.0397 58.8363 29.8826 177.1049 5061 T 4.2896 7.9151 105.8004 60.9622 70.0451 175.5523 5062 G 3.8345 8.3642 110.4117 45.1287 0.0000 173.7081 5063 Q 4.4606 7.6172 118.9761 56.0888 30.2381 174.5910 5064 Y 5.0547 9.2572 120.3558 55.9733 40.7242 175.2600 5065 L 4.4290 9.2445 126.1238 55.5291 43.5537 175.4911 5066 A 5.1391 8.4879 125.3391 51.1463 23.3474 174.5955 5067 M 5.3979 8.5089 119.0628 53.8324 34.9814 175.4255 5068 D 5.3963 9.6898 125.9573 52.0397 40.7878 177.0910 5069 T 4.3564 8.5601 108.7480 63.9382 68.5088 174.4192 5070 D 4.6091 8.8633 121.5877 54.4970 41.6081 177.4031 5071 G 3.5114 9.0707 108.7231 44.9180 0.0000 172.6717 5072 L 4.7026 7.8104 119.8173 53.2136 42.9910 175.8651 5073 L 5.0412 8.3932 123.3731 55.0861 42.6840 175.6471 5074 Y 5.0150 8.9736 119.8597 55.9529 42.0346 173.5965 5075 G 4.2350 9.1140 108.9065 45.2375 0.0000 173.0686 5076 S 5.0990 9.1928 121.6186 56.9074 63.7204 175.2650 5077 Q 3.9374 9.1160 126.0375 57.8601 29.0271 176.2431 5078 T 4.7148 7.6045 107.0752 58.5599 71.4858 171.7886 5079 P 3.6793 0.0000 0.0000 62.4177 31.9956 175.0850 5080 N 4.9151 8.1297 117.6200 51.2349 40.4352 174.3634 5081 E 3.8525 8.9659 115.1258 59.8802 28.8266 178.5272 5082 E 4.2363 8.1512 116.1156 57.3039 29.7049 177.2955 5083 C 4.9924 7.9165 115.8367 59.1415 29.2184 173.5096 5084 L 4.3269 7.0721 120.1072 53.7812 42.8222 175.8730 5085 F 5.3338 8.8235 121.2682 55.6172 43.4624 174.0375 5086 L 4.8747 9.2377 123.1948 53.8729 42.7152 175.5089 5087 E 4.6088 8.9551 126.3859 55.4679 30.6706 175.5858 5088 R 4.6341 8.5166 125.7240 54.5017 34.2932 173.5092 5089 L 4.9459 8.5263 127.4191 53.4852 43.3050 175.7359 5090 E 4.4608 9.0256 126.2495 55.0493 31.6983 177.2427 5091 E 3.8854 8.6629 117.8174 60.0035 29.3267 178.7386 5092 N 4.7940 8.6300 112.6952 53.4080 38.7065 174.9484 5093 H 3.9674 8.4128 113.3258 56.9787 26.9188 174.5048 5094 Y 4.5307 8.5511 117.4139 57.6111 39.6457 174.2931 5095 N 5.4716 9.5718 120.1473 52.1474 41.1298 174.2773 5096 T 5.3482 8.6720 112.3911 60.1696 72.6297 172.3441 5097 Y 5.2597 8.8041 119.6486 56.4773 41.6792 174.2767 5098 I 4.8257 8.5196 125.0153 59.0285 40.0766 175.1480 5099 S 4.1228 9.0950 121.9330 58.6004 62.8527 174.8730 5100 K 3.8560 8.7100 129.1829 59.4310 32.2979 178.5613 5101 K 3.6667 7.9347 118.0970 59.2523 32.1417 176.7398 5102 H 4.5842 7.9262 114.3882 55.0918 29.3255 176.2551 5103 A 3.9913 7.8465 125.2489 54.6662 18.3150 180.7130 5104 E 3.8681 8.1308 113.6071 59.4679 29.4818 178.2809 5105 K 4.0982 7.6620 115.0211 55.8928 32.6012 176.1091 5106 N 3.8276 7.8544 115.9886 53.8918 36.4859 175.2503 5107 W 4.8933 7.8332 118.2133 56.4802 30.1747 177.2856 5108 F 5.2270 9.1909 124.5416 56.4126 40.1216 175.9231 5109 V 4.1026 9.0491 121.4169 62.8856 32.6438 175.1639 5110 G 4.3393 8.4353 111.9015 45.5058 0.0000 171.6496 5111 L 5.2989 8.2471 121.1976 52.3615 44.7477 177.2386 5112 K 4.2134 9.0494 123.6322 55.7140 32.8273 178.2828 5113 K 4.0116 8.3532 119.2087 59.3306 31.9445 178.3539 5114 N 4.4324 7.9455 114.3559 53.5852 37.8856 175.8502 5115 G 3.6370 8.0051 108.3885 44.9438 0.0000 173.6156 5116 S 4.7677 7.7890 114.3399 56.7233 64.6517 173.1765 5117 C 4.5700 8.4090 121.9462 59.7478 32.2131 172.7586 5118 K 4.4068 8.6870 127.1878 54.5242 32.8724 175.9453 5119 R 3.8496 8.7018 126.5090 56.9059 30.7535 177.5450 5120 G 3.5025 9.2355 114.2556 48.1599 0.0000 173.8882 5121 P 4.0530 0.0000 0.0000 64.0339 31.1525 176.7959 5122 R 4.3901 7.6931 117.3553 56.1366 30.7304 176.2899 5123 T 5.0557 7.7892 108.5694 60.4964 70.5102 173.5863 5124 H 4.5858 8.0552 115.1452 54.7054 30.6833 172.9211 5125 Y 4.0753 8.2591 118.4387 60.0071 38.1435 176.7970 5126 G 4.0708 8.8675 110.9067 45.5616 0.0000 174.0702 5127 Q 4.0471 7.4663 119.1094 55.3228 29.3649 177.5302 5128 K 3.8097 8.4787 121.4517 58.6941 32.7166 178.9483 5129 A 3.9007 7.9171 122.2435 54.6830 18.2331 178.5377 5130 I 4.4639 6.9898 105.2872 60.1754 38.2606 175.3915 5131 L 4.3723 7.3184 123.3580 54.1304 42.6402 175.6889 5132 F 5.2795 9.2831 122.8623 55.4486 42.9153 174.1730 5133 L 5.2055 9.3393 124.5837 52.7549 44.5011 173.6285 5134 P 5.1643 0.0000 0.0000 62.5872 31.9644 175.8230 5135 L 5.0091 9.1633 124.1159 52.0144 45.9494 174.7558 5136 P 4.7102 0.0000 0.0000 62.4328 32.1476 177.6669 5137 V 3.6046 8.2904 113.5486 64.7131 31.6096 177.4029 5138 S 4.0592 7.8893 118.2275 58.8825 63.0044 175.1756 *5139 S 4.2715 8.6010 121.0361 58.3118 62.7319 169.9610 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 5009 K 8.31 4.24 0.00 1.73 1.91 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.46 7.81 5010 K 8.12 3.69 0.00 1.86 1.75 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.52 7.81 5011 P 0.00 4.77 0.00 1.90 1.94 0.00 3.60 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.08 0.00 5012 K 9.33 4.88 0.00 1.61 1.67 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.41 7.81 5013 L 8.90 5.15 0.00 1.69 1.67 0.54 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 5014 L 8.64 5.20 0.00 1.58 1.67 0.41 0.86 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 5015 Y 9.39 4.91 0.00 3.19 3.12 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 5016 C 8.54 4.59 0.00 2.53 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5017 S 8.16 4.06 0.00 3.42 3.63 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 5018 N 7.95 4.23 0.00 2.55 2.71 0.00 0.00 6.74 7.98 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 5019 G 7.37 3.99 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 0.00 0.00 0.00 5020 G 7.71 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 0.00 0.00 0.00 5021 H 7.44 4.92 0.00 3.03 3.18 0.00 5.81 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5022 F 9.16 5.12 0.00 3.13 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 5023 L 9.37 4.45 0.00 1.74 1.52 0.93 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 5024 R 9.47 4.83 0.00 1.91 2.05 0.00 3.28 0.00 0.00 3.29 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 5025 I 8.30 4.83 1.85 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 1.19 0.73 0.91 0.00 0.00 5026 L 8.93 4.09 0.00 1.87 1.56 0.92 0.77 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 5027 P 0.00 4.21 0.00 2.00 2.13 0.00 3.52 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.02 0.00 5028 D 8.00 4.53 0.00 2.79 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 5029 G 8.56 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 5030 T 8.18 4.32 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 1.23 0.00 0.00 5031 V 8.23 4.83 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 0.89 0.00 0.00 0.94 0.00 0.00 5032 D 8.70 4.62 0.00 2.89 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 5033 G 8.82 4.56 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 0.00 0.00 0.00 5034 T 8.77 4.99 4.33 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 1.42 0.00 0.00 5035 R 8.86 4.28 0.00 1.87 1.97 0.00 3.20 0.00 0.00 3.08 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.42 0.00 5036 D 8.14 4.65 0.00 2.81 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 5037 R 8.67 3.63 0.00 1.86 1.89 0.00 3.33 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.87 0.00 5038 S 8.32 4.26 0.00 3.99 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 5039 D 7.56 4.30 0.00 2.93 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 5040 Q 8.62 4.03 0.00 1.88 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.91 0.00 0.00 0.00 0.00 0.00 2.30 2.25 0.00 5041 H 9.42 4.79 0.00 3.34 3.48 0.00 5.78 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5042 I 7.00 4.55 1.97 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.42 1.06 0.00 0.00 5043 Q 7.77 4.23 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 5044 L 9.14 5.20 0.00 1.54 1.45 0.81 0.52 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 5045 Q 8.88 4.70 0.00 2.02 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.79 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 5046 L 8.69 5.29 0.00 1.58 1.65 0.88 0.98 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 5047 S 8.99 4.81 0.00 4.01 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 5048 A 8.64 5.09 1.30 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 0.00 0.00 0.00 5049 E 9.10 3.91 0.00 1.99 1.70 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 2.32 2.43 0.00 5050 S 8.28 4.54 0.00 4.08 3.75 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 5051 V 8.04 3.83 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 0.69 0.00 0.00 0.93 0.00 0.00 5052 G 9.02 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 5053 E 7.74 5.14 0.00 1.87 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 2.20 2.39 0.00 5054 V 9.00 5.03 2.19 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 0.95 0.00 0.00 1.16 0.00 0.00 5055 Y 9.04 5.23 0.00 3.05 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 5056 I 8.70 4.59 1.71 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.71 0.66 0.00 0.00 5057 K 8.64 4.78 0.00 1.14 1.32 0.00 1.27 0.00 0.00 0.61 0.00 0.00 2.55 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.98 0.85 7.81 5058 S 8.86 4.66 0.00 3.86 3.66 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 5059 T 8.73 3.84 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 1.16 0.00 0.00 5060 E 8.35 4.05 0.00 1.99 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 2.17 2.36 0.00 5061 T 7.92 4.29 4.25 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 1.25 0.00 0.00 5062 G 8.36 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 0.00 0.00 0.00 5063 Q 7.62 4.46 0.00 1.97 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.73 0.00 0.00 0.00 0.00 0.00 2.43 2.36 0.00 5064 Y 9.26 5.05 0.00 2.87 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 5065 L 9.24 4.43 0.00 1.62 1.53 0.81 0.48 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 5066 A 8.49 5.14 0.62 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 0.00 0.00 5067 M 8.51 5.40 0.00 2.22 2.23 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.71 0.00 5068 D 9.69 5.40 0.00 3.01 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 5069 T 8.56 4.36 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 1.36 0.00 0.00 5070 D 8.86 4.61 0.00 2.87 2.73 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 5071 G 9.07 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5072 L 7.81 4.70 0.00 2.14 1.64 0.92 0.62 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 5073 L 8.39 5.04 0.00 1.58 1.62 0.91 0.95 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 5074 Y 8.97 5.02 0.00 3.06 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 5075 G 9.11 4.24 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 0.00 5076 S 9.19 5.10 0.00 3.98 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5077 Q 9.12 3.94 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.49 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 5078 T 7.60 4.71 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 1.23 0.00 0.00 5079 P 0.00 3.68 0.00 1.37 0.49 0.00 3.58 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.48 0.00 5080 N 8.13 4.92 0.00 2.86 2.92 0.00 0.00 5.98 7.66 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 5081 E 8.97 3.85 0.00 2.11 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 0.00 2.36 2.33 0.00 5082 E 8.15 4.24 0.00 2.15 2.31 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 2.43 2.40 0.00 5083 C 7.92 4.99 0.00 3.24 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 5084 L 7.07 4.33 0.00 1.39 1.31 0.81 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 5085 F 8.82 5.33 0.00 3.04 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 5086 L 9.24 4.87 0.00 1.56 1.61 0.89 0.71 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 5087 E 8.96 4.61 0.00 2.12 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 2.19 1.86 0.00 5088 R 8.52 4.63 0.00 1.92 1.72 0.00 3.29 0.00 0.00 3.22 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 5089 L 8.53 4.95 0.00 1.64 1.49 0.83 0.92 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 5090 E 9.03 4.46 0.00 2.30 2.18 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 2.35 2.72 0.00 5091 E 8.66 3.89 0.00 2.05 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 2.35 2.43 0.00 5092 N 8.63 4.79 0.00 3.24 2.93 0.00 0.00 6.93 8.16 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 5093 H 8.41 3.97 0.00 3.13 3.34 0.00 5.84 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 5094 Y 8.55 4.53 0.00 3.06 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 5095 N 9.57 5.47 0.00 2.73 2.42 0.00 0.00 6.66 6.98 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 5096 T 8.67 5.35 4.60 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 1.27 0.00 0.00 5097 Y 8.80 5.26 0.00 2.85 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 5098 I 8.52 4.83 1.76 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.22 0.72 0.00 0.00 5099 S 9.09 4.12 0.00 4.09 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 5100 K 8.71 3.86 0.00 1.70 1.64 0.00 1.67 0.00 0.00 1.45 0.00 0.00 2.77 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.32 1.29 7.81 5101 K 7.93 3.67 0.00 1.58 1.62 0.00 1.71 0.00 0.00 1.56 0.00 0.00 2.97 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.07 1.32 7.81 5102 H 7.93 4.58 0.00 3.09 2.41 0.00 5.69 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5103 A 7.85 3.99 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 5104 E 8.13 3.87 0.00 1.83 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 2.22 2.21 0.00 5105 K 7.66 4.10 0.00 0.96 1.42 0.00 1.42 0.00 0.00 1.42 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.24 1.04 7.81 5106 N 7.85 3.83 0.00 2.86 2.78 0.00 0.00 6.96 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 5107 W 7.83 4.89 0.00 3.33 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 5108 F 9.19 5.23 0.00 2.91 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 5109 V 9.05 4.10 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 0.64 0.00 0.00 0.55 0.00 0.00 5110 G 8.44 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 0.00 0.00 0.00 0.00 5111 L 8.25 5.30 0.00 1.43 1.47 1.03 0.92 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 5112 K 9.05 4.21 0.00 1.92 1.66 0.00 1.75 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.40 1.48 7.81 5113 K 8.35 4.01 0.00 1.70 1.84 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.65 1.36 7.81 5114 N 7.95 4.43 0.00 2.81 2.91 0.00 0.00 6.31 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5115 G 8.01 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 5116 S 7.79 4.77 0.00 3.97 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 5117 C 8.41 4.57 0.00 3.02 2.88 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 5118 K 8.69 4.41 0.00 1.73 1.68 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.30 1.34 7.81 5119 R 8.70 3.85 0.00 1.63 1.62 0.00 3.11 0.00 0.00 3.27 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 5120 G 9.24 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 0.00 0.00 0.00 5121 P 0.00 4.05 0.00 2.05 1.93 0.00 2.79 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.46 0.00 5122 R 7.69 4.39 0.00 1.83 1.94 0.00 3.28 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.62 0.00 5123 T 7.79 5.06 4.32 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 1.31 0.00 0.00 5124 H 8.06 4.59 0.00 3.37 3.44 0.00 5.68 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 5125 Y 8.26 4.08 0.00 3.02 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 5126 G 8.87 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 5127 Q 7.47 4.05 0.00 1.87 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.75 0.00 0.00 0.00 0.00 0.00 2.04 1.98 0.00 5128 K 8.48 3.81 0.00 1.80 1.62 0.00 1.57 0.00 0.00 1.70 0.00 0.00 2.76 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.35 1.31 7.81 5129 A 7.92 3.90 1.16 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 0.00 0.00 5130 I 6.99 4.46 1.73 0.00 0.00 -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 1.23 1.16 0.69 0.00 0.00 5131 L 7.32 4.37 0.00 1.28 1.14 0.51 0.74 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 5132 F 9.28 5.28 0.00 3.36 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 5133 L 9.34 5.21 0.00 2.12 1.87 0.83 1.10 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 5134 P 0.00 5.16 0.00 2.07 2.09 0.00 3.79 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.31 0.00 5135 L 9.16 5.01 0.00 1.64 1.58 0.94 0.94 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 5136 P 0.00 4.71 0.00 2.03 1.98 0.00 3.70 0.00 0.00 3.68 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 5137 V 8.29 3.60 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 0.70 0.00 0.00 0.90 0.00 0.00 5138 S 7.89 4.06 0.00 3.84 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 *5139 S 8.60 4.27 0.00 3.60 3.68 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 * Residues marked with a * may have inaccurate shift predictions.