NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3629 8.1627 120.6154 55.3825 34.2159 174.5960 2 Q 3.9733 8.5853 126.5729 53.7786 27.9409 173.7147 3 K 4.4205 8.6379 126.0734 56.4390 34.6016 176.2238 4 A 4.3004 7.2303 119.8819 51.6051 22.1988 175.3414 5 V 4.2911 8.6121 122.6205 61.6174 32.0991 175.4157 6 V 4.1428 8.6877 128.6006 64.3196 32.9054 176.0515 7 M 4.9050 7.8198 119.8694 53.7433 36.4045 174.7610 8 D 4.9971 8.6048 122.7299 51.1870 42.3978 176.6132 9 E 3.8621 8.8432 118.9216 59.8730 29.1413 178.4712 10 Q 3.9217 8.1231 118.3332 59.2043 29.0783 178.0189 11 A 3.9833 8.4427 121.7261 55.1860 18.3212 179.7274 12 I 3.6406 7.9030 118.3483 64.3322 37.1795 178.4861 13 R 3.8705 8.2291 119.8365 59.8134 29.9553 178.9216 14 R 3.9915 8.3501 117.6109 58.8647 29.9764 179.0203 15 A 4.0192 8.1455 121.0936 55.0252 18.4309 179.6902 16 L 3.9517 8.2663 117.9043 58.2073 41.6160 179.8442 17 T 3.8882 7.8861 115.7040 66.6646 68.4114 176.6669 18 R 3.9408 8.0395 120.6118 59.4740 30.0801 178.6039 19 I 3.7304 7.9311 119.4753 64.1704 37.0670 178.1466 20 A 3.8415 8.0389 121.5752 55.6193 18.1577 179.4642 21 H 4.0550 8.0389 114.3040 58.8089 28.7032 177.9590 22 E 4.0258 8.2890 120.3839 59.5095 29.2838 179.0816 23 I 3.2648 7.7235 120.0966 64.6595 37.1873 178.4702 24 I 3.8303 7.7176 120.1617 64.3335 36.6395 178.1840 25 E 3.9605 8.4936 120.5437 59.4659 29.3268 179.1034 26 R 4.1068 8.5215 116.9258 58.1586 30.2312 177.6109 27 N 4.7721 7.7761 113.9287 51.4752 39.6494 174.6677 28 K 3.7092 8.7631 118.9521 57.8171 30.4097 172.5825 29 G 3.7759 8.0692 103.8574 44.3235 0.0000 173.7607 30 I 4.3412 8.2688 111.1639 59.8283 38.4935 174.2823 31 D 4.3270 8.1688 120.7145 56.4729 41.0962 176.5642 32 G 3.9377 8.9894 113.5227 45.9286 0.0000 171.8135 33 C 5.0377 8.4299 117.3489 58.5200 29.6729 173.4830 34 V 4.4340 8.6804 121.9672 61.1314 34.8521 173.9004 35 L 4.8953 8.6305 127.4757 53.2125 43.9510 175.7112 36 V 4.3553 8.6869 123.3202 61.0710 34.2973 174.4624 37 G 4.3357 8.6582 116.2193 45.1332 0.0000 172.0467 38 I 5.5199 8.0210 115.5210 57.9290 41.3866 178.8174 39 K 3.7343 8.9154 123.7327 58.1509 31.3400 175.1738 40 T 4.4086 8.5129 122.1074 65.7097 71.1197 176.1023 41 R 4.3888 8.0274 119.8535 59.0925 30.0103 179.3557 42 G 3.6222 7.7647 104.7200 47.6976 0.0000 175.8486 43 I 3.6155 7.4930 121.7111 64.4276 37.0652 178.1797 44 Y 4.2245 7.6262 117.0325 61.1023 37.7177 178.3445 45 L 4.0867 8.3001 119.7762 57.5132 41.6470 179.4589 46 A 3.9393 8.2483 121.3111 55.1672 18.2409 179.8669 47 R 3.9217 8.1405 116.6377 59.3269 30.0591 179.6025 48 R 3.9029 8.0400 117.8025 59.3359 30.0719 178.9564 49 L 3.9380 8.1215 118.6909 57.7916 41.7225 179.5128 50 A 3.9194 8.4039 120.9873 55.1056 17.7942 179.2546 51 E 3.8744 8.3808 118.0973 59.6060 29.4634 179.3269 52 R 3.9615 8.3884 118.4881 59.3258 30.0569 179.1652 53 I 3.8234 8.0721 119.8382 64.0962 36.9232 178.3571 54 E 4.2440 7.9608 120.7855 58.8756 29.1186 178.8426 55 Q 4.1446 7.6782 114.8746 57.4766 28.8468 177.3460 56 I 4.2503 6.9592 120.2639 61.9853 38.7213 176.6051 57 E 4.5515 8.2814 116.6689 54.8567 30.6620 176.1440 58 G 3.8201 9.1813 106.7797 45.7870 0.0000 173.3978 59 A 4.5448 7.4761 119.2520 50.6559 22.0326 176.8130 60 S 4.4726 8.4637 115.9197 57.6964 64.4212 173.5038 61 V 4.3502 7.9137 122.0443 60.4744 32.9995 173.7128 62 P 4.4456 0.0000 0.0000 62.9863 32.6983 175.2198 63 V 4.6750 8.4218 122.3807 61.2249 33.7732 174.8859 64 G 4.1867 9.1403 115.1298 44.5259 0.0000 171.5346 65 E 5.2643 8.9455 118.5807 54.1635 33.7512 174.7513 66 L 4.7838 8.8535 125.5149 53.3068 45.1925 174.4353 67 D 4.9106 8.9136 126.5865 53.4227 41.5874 175.8950 68 I 4.4117 8.5698 126.7087 62.8515 38.3358 178.3086 69 T 3.8848 7.3261 116.9366 66.3416 68.7062 174.3244 70 L 4.4994 7.5905 121.4563 54.5339 40.5751 175.2023 71 Y 4.7272 8.3786 116.3669 58.7038 46.7957 176.2553 72 R 4.0478 8.0303 117.3183 57.5184 28.4162 177.1022 *91 V 4.6508 7.7643 109.7520 60.4582 33.9395 174.7970 92 P 3.8236 0.0000 0.0000 60.4996 30.7056 176.6418 93 F 3.5666 8.7060 112.6269 57.5222 38.7863 174.5899 94 P 4.4652 0.0000 0.0000 62.7595 32.1085 175.0661 95 V 4.3014 8.2072 118.5929 64.7289 33.5616 175.6320 96 T 4.0520 7.8324 114.8050 65.3207 68.4602 173.9300 97 E 3.8070 9.0926 126.0620 56.4502 29.3260 173.7242 98 R 4.6416 7.8825 116.4878 55.3612 33.3378 175.2630 99 N 5.1249 8.9910 120.7915 52.5129 39.3183 173.2293 100 V 4.1838 8.7156 126.5765 62.2262 32.9464 174.8247 101 I 4.8312 8.9969 130.9615 59.5149 38.1140 175.3763 102 L 4.5251 9.1389 128.4324 54.7377 43.1391 176.7601 103 V 4.8813 8.8295 121.8536 61.4495 34.9188 173.7417 104 D 5.0848 8.8700 126.1813 52.7880 45.2147 175.7750 105 D 4.4013 8.9077 121.4423 55.9832 40.5152 176.1621 106 V 4.9678 7.7017 117.5937 60.2108 34.8079 173.9006 107 L 4.4950 8.9057 129.5889 55.0914 43.4281 174.4244 108 F 5.0292 9.1993 126.2060 58.8723 40.1235 176.7827 109 T 3.9029 8.2712 112.8173 62.1723 69.9761 177.0872 110 G 4.0651 8.2894 109.3944 45.3886 0.0000 175.1047 111 R 3.9814 7.7568 119.4857 59.2570 29.8323 179.0328 112 T 3.9199 7.8436 115.4761 66.4439 68.5275 176.6854 113 V 3.5402 7.7117 119.7465 65.9177 31.6464 177.7434 114 R 3.8356 7.8371 117.7351 59.4945 29.8825 178.3137 115 A 3.8991 7.9046 119.8244 55.0677 18.3464 179.4720 116 A 3.7495 8.1694 119.6633 55.3132 18.4210 179.8247 117 M 3.9274 8.4340 117.5139 58.6905 31.8704 178.4828 118 D 4.3453 7.6908 117.2815 57.4283 41.3354 178.6149 119 A 4.3173 7.2759 122.2439 54.5373 18.2378 179.5762 120 V 3.6386 7.7055 116.6532 66.6558 31.3869 177.7144 121 M 5.3107 7.7675 115.2847 55.7661 31.5857 177.0543 122 D 4.6337 7.7849 120.1713 55.5585 42.0080 176.9992 123 L 4.3099 8.1576 117.3523 54.1489 42.5386 176.6887 124 G 3.9236 6.5579 105.3194 46.0011 0.0000 171.1084 125 R 5.1313 7.3959 116.7509 53.2483 30.3632 174.0522 126 P 4.9228 0.0000 0.0000 62.3902 32.0480 176.7956 127 A 4.3144 8.8047 123.8137 55.1776 18.9172 177.8805 128 R 4.5481 7.5143 108.6491 55.6372 32.6443 173.9995 129 I 5.0546 8.3660 120.2545 59.7809 40.1336 174.9747 130 Q 4.9477 9.4901 125.3282 53.9376 33.0146 174.1565 131 L 5.2670 9.5228 122.1693 53.3411 45.6015 174.9022 132 A 5.5003 9.1911 127.6193 50.3901 22.0287 175.2852 133 V 5.4557 8.8438 114.4963 58.5423 36.1353 176.5551 134 L 4.1702 8.7656 126.0084 57.6866 43.2946 177.0792 135 V 5.0389 8.2471 117.4832 59.9017 35.2624 173.9360 136 D 5.1075 8.8730 123.8001 52.4611 42.9612 175.9492 137 R 5.1158 8.0730 122.1952 55.1783 30.3351 178.2926 138 G 3.7726 8.7590 109.9623 46.8176 0.0000 172.7430 139 H 4.0748 8.5296 110.6435 56.7435 25.8621 175.0663 140 R 4.2457 7.9468 117.4073 56.2899 30.6539 175.4288 141 E 4.6770 8.7301 121.7553 55.8625 30.8107 175.6814 142 L 4.6934 7.3337 117.5257 52.5732 46.2726 174.6214 143 P 4.6291 0.0000 0.0000 62.7252 29.8757 176.1763 144 I 4.5858 7.2422 118.5111 60.0370 40.3520 175.9253 145 R 4.6316 8.1405 118.7662 54.2953 32.4971 174.3903 146 A 4.4952 8.2758 121.9928 51.6018 20.0890 177.2844 147 D 4.3270 8.7812 121.0864 55.8568 41.9430 177.2216 148 F 4.8728 7.9141 116.7296 55.4463 42.6403 174.2242 149 V 4.6773 8.5234 123.3760 61.0757 33.1617 175.3606 150 G 3.8197 9.3228 116.5655 48.9018 0.0000 173.9517 151 K 4.4780 8.0181 120.0210 55.0503 36.4409 173.9443 152 N 4.8281 8.9779 125.6817 53.0590 39.4391 174.8748 153 V 4.3345 8.8319 126.1099 60.0348 33.1443 172.9177 154 P 4.8317 0.0000 0.0000 63.1697 31.8000 175.8262 155 T 4.8149 8.2133 111.2074 60.1662 72.1306 173.3143 156 S 4.6254 9.3412 118.1592 57.0952 64.5832 175.1273 157 R 3.9475 8.4239 120.0199 58.6522 29.8560 176.8997 158 S 4.5046 7.5723 109.8896 58.6020 63.6739 173.9546 159 E 4.5854 7.4195 119.7009 55.8294 30.7874 175.4941 160 L 4.7153 8.8454 123.0233 53.3881 45.7643 174.9972 161 I 4.7747 8.1502 125.4201 59.7229 39.0488 174.9771 162 V 4.2546 8.7577 127.4750 61.0575 33.7814 174.2103 163 V 4.7158 8.4600 128.1858 61.3656 33.0378 174.2787 164 E 4.9818 9.4277 128.2838 54.6055 31.9851 175.0894 165 L 5.1304 9.0441 124.3049 52.6096 44.7685 177.6785 166 S 3.8321 9.6403 118.5414 61.6911 62.8396 176.8673 167 E 3.8302 7.8722 118.7332 58.0109 29.2738 177.6833 168 V 4.2113 7.4050 115.4414 62.6220 33.6181 175.3696 169 D 4.7460 8.8971 117.3366 53.4116 41.6600 177.0777 170 G 4.0233 9.4027 108.4658 45.2716 0.0000 173.3636 171 I 4.5648 7.0610 110.5376 59.8576 40.7416 173.8555 172 D 5.0341 8.2624 123.2025 53.4271 42.0384 175.8185 173 Q 4.7410 8.6422 122.1879 55.2697 33.4792 172.6036 174 V 5.0036 8.8119 125.9296 61.1821 34.4553 174.4788 175 S 5.1933 9.0883 121.1131 56.9485 67.5106 172.4381 176 I 4.8714 9.0909 121.4185 60.0414 39.1141 174.9541 177 H 5.3999 9.1671 123.8980 54.4008 32.3491 172.6430 178 E 4.9041 8.5720 118.9577 54.8341 33.0501 175.1646 179 K 4.1144 8.6930 125.5289 56.8497 32.2570 176.4352 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 1 M 8.16 4.36 0.00 2.10 1.99 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 2.54 2.51 0.00 2 Q 8.59 3.97 0.00 1.94 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.84 0.00 0.00 0.00 0.00 0.00 2.24 2.22 0.00 3 K 8.64 4.42 0.00 1.77 1.87 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.37 1.56 7.81 4 A 7.23 4.30 1.20 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 0.00 0.00 5 V 8.61 4.29 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 0.79 0.00 0.00 0.92 0.00 0.00 6 V 8.69 4.14 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 0.81 0.00 0.00 0.92 0.00 0.00 7 M 7.82 4.91 0.00 1.95 1.88 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.53 0.00 8 D 8.60 5.00 0.00 2.80 2.79 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 9 E 8.84 3.86 0.00 2.04 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 2.38 2.40 0.00 10 Q 8.12 3.92 0.00 2.15 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 11 A 8.44 3.98 1.41 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 12 I 7.90 3.64 2.02 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 1.41 0.85 0.91 0.00 0.00 13 R 8.23 3.87 0.00 1.92 2.12 0.00 3.09 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 1.63 1.68 0.00 14 R 8.35 3.99 0.00 1.88 1.96 0.00 3.17 0.00 0.00 3.17 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 15 A 8.15 4.02 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 16 L 8.27 3.95 0.00 1.74 1.72 0.93 0.77 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 17 T 7.89 3.89 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 1.26 0.00 0.00 18 R 8.04 3.94 0.00 2.01 2.10 0.00 3.12 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 19 I 7.93 3.73 2.01 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.63 0.77 0.00 0.00 20 A 8.04 3.84 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 21 H 8.04 4.06 0.00 3.31 3.38 0.00 5.63 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.29 4.03 0.00 2.32 2.34 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 2.44 2.56 0.00 23 I 7.72 3.26 1.72 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.16 0.49 0.70 0.00 0.00 24 I 7.72 3.83 1.95 0.00 0.00 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 1.34 0.61 0.94 0.00 0.00 25 E 8.49 3.96 0.00 2.18 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 2.34 2.38 0.00 26 R 8.52 4.11 0.00 2.00 2.07 0.00 3.24 0.00 0.00 3.19 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.06 0.00 27 N 7.78 4.77 0.00 2.91 2.84 0.00 0.00 7.12 8.91 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 28 K 8.76 3.71 0.00 1.86 1.85 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.38 7.81 29 G 8.07 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 0.00 0.00 0.00 30 I 8.27 4.34 1.84 0.00 0.00 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 1.28 0.93 0.86 0.00 0.00 31 D 8.17 4.33 0.00 2.65 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 32 G 8.99 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 0.00 0.00 0.00 33 C 8.43 5.04 0.00 2.92 2.83 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 34 V 8.68 4.43 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 0.89 0.00 0.00 0.98 0.00 0.00 35 L 8.63 4.90 0.00 1.67 1.46 0.89 0.38 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 36 V 8.69 4.36 1.81 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 0.65 0.00 0.00 0.10 0.00 0.00 37 G 8.66 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 38 I 8.02 5.52 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 1.90 0.88 0.00 0.00 39 K 8.92 3.73 0.00 1.89 1.13 0.00 1.88 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.39 1.46 7.81 40 T 8.51 4.41 4.30 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 1.32 0.00 0.00 41 R 8.03 4.39 0.00 1.91 2.07 0.00 3.17 0.00 0.00 3.43 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.80 0.00 42 G 7.76 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 0.00 0.00 0.00 43 I 7.49 3.62 1.67 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.75 0.70 0.00 0.00 44 Y 7.63 4.22 0.00 3.18 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 45 L 8.30 4.09 0.00 1.86 1.73 0.95 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 46 A 8.25 3.94 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 47 R 8.14 3.92 0.00 2.09 2.03 0.00 3.17 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 48 R 8.04 3.90 0.00 2.04 1.98 0.00 3.15 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 1.68 2.02 0.00 49 L 8.12 3.94 0.00 1.77 1.64 0.85 0.97 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 50 A 8.40 3.92 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 E 8.38 3.87 0.00 2.11 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 2.35 0.00 52 R 8.39 3.96 0.00 1.98 1.92 0.00 3.16 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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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 0.00 113 V 7.71 3.54 2.23 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 0.91 0.00 0.00 0.94 0.00 0.00 114 R 7.84 3.84 0.00 1.92 2.06 0.00 3.15 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 1.62 1.65 0.00 115 A 7.90 3.90 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 0.00 116 A 8.17 3.75 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 0.00 117 M 8.43 3.93 0.00 1.99 2.22 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.55 0.00 118 D 7.69 4.35 0.00 2.62 2.79 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 0.00 119 A 7.28 4.32 1.05 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 0.00 120 V 7.71 3.64 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 1.17 0.00 0.00 0.96 0.00 0.00 121 M 7.77 5.31 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.41 0.00 122 D 7.78 4.63 0.00 2.98 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 0.00 123 L 8.16 4.31 0.00 1.81 1.59 0.77 1.11 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 0.00 124 G 6.56 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 0.00 125 R 7.40 5.13 0.00 1.75 1.85 0.00 3.30 0.00 0.00 3.22 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 126 P 0.00 4.92 0.00 2.26 2.16 0.00 3.82 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 127 A 8.80 4.31 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 0.00 128 R 7.51 4.55 0.00 1.85 1.99 0.00 2.94 0.00 0.00 3.36 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 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3.19 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.55 0.00 146 A 8.28 4.50 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 0.00 147 D 8.78 4.33 0.00 2.03 1.79 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 0.00 148 F 7.91 4.87 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 0.00 149 V 8.52 4.68 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 0.92 0.00 0.00 0.94 0.00 0.00 150 G 9.32 3.82 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 0.00 0.00 0.00 151 K 8.02 4.48 0.00 1.83 1.61 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.30 1.38 7.81 152 N 8.98 4.83 0.00 2.65 2.76 0.00 0.00 6.84 7.68 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 0.00 153 V 8.83 4.33 2.06 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 0.98 0.00 0.00 0.98 0.00 0.00 154 P 0.00 4.83 0.00 2.11 2.04 0.00 3.78 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 1.98 1.97 0.00 155 T 8.21 4.81 4.30 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 1.24 0.00 0.00 156 S 9.34 4.63 0.00 4.00 4.08 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 0.00 157 R 8.42 3.95 0.00 1.77 2.00 0.00 3.09 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 158 S 7.57 4.50 0.00 4.03 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 0.00 159 E 7.42 4.59 0.00 1.91 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 2.31 2.25 0.00 160 L 8.85 4.72 0.00 1.63 1.43 0.89 1.05 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 0.00 161 I 8.15 4.77 1.73 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.87 0.87 0.00 0.00 162 V 8.76 4.25 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 0.88 0.00 0.00 0.70 0.00 0.00 163 V 8.46 4.72 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 0.88 0.00 0.00 0.93 0.00 0.00 164 E 9.43 4.98 0.00 1.96 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 2.22 2.25 0.00 165 L 9.04 5.13 0.00 1.43 1.61 1.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 166 S 9.64 3.83 0.00 3.88 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 0.00 167 E 7.87 3.83 0.00 1.16 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 2.11 2.17 0.00 168 V 7.41 4.21 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 0.86 0.00 0.00 0.91 0.00 0.00 169 D 8.90 4.75 0.00 2.58 2.62 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 0.00 170 G 9.40 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 0.00 0.00 0.00 171 I 7.06 4.56 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 1.33 0.49 0.89 0.00 0.00 172 D 8.26 5.03 0.00 2.54 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 0.00 173 Q 8.64 4.74 0.00 2.05 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.75 0.00 0.00 0.00 0.00 0.00 2.18 2.36 0.00 174 V 8.81 5.00 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 1.01 0.00 0.00 0.93 0.00 0.00 175 S 9.09 5.19 0.00 3.98 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 0.00 176 I 9.09 4.87 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 1.20 0.66 0.89 0.00 0.00 177 H 9.17 5.40 0.00 3.02 3.17 0.00 5.85 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 0.00 178 E 8.57 4.90 0.00 1.95 1.75 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 2.22 2.24 0.00 179 K 8.69 4.11 0.00 1.76 1.69 0.00 1.87 0.00 0.00 1.75 0.00 0.00 2.83 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.43 1.45 7.81 * Residues marked with a * may have inaccurate shift predictions.