NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 R 4.2943 8.1133 119.6906 55.6163 30.7232 175.5949 7 K 3.7171 8.4456 124.3827 59.1143 31.9823 177.5149 8 D 4.4151 8.3021 119.0390 57.3182 41.2108 177.9389 9 E 3.9016 8.1247 119.2961 59.2720 29.6227 178.7966 10 I 3.6688 7.6609 119.3529 64.4521 37.1422 178.3874 11 L 3.7264 8.1437 119.8877 57.8945 41.3891 179.7166 12 Q 3.5355 8.0207 117.7248 58.4110 28.5721 178.5291 13 A 3.7984 7.8092 121.6983 54.9938 18.4220 179.3732 14 A 3.3342 7.7570 119.3889 54.9975 18.3207 179.4482 15 L 3.4530 7.4919 118.6355 58.1419 42.0428 178.9905 16 A 3.8779 7.7297 120.4679 55.3043 18.1895 179.3992 17 C 4.0367 7.8582 114.9868 63.1219 28.2688 176.2990 18 F 4.6028 8.1791 119.6929 60.9871 38.2466 178.0406 19 S 4.2487 8.1306 113.9258 61.3646 62.7072 176.0670 20 E 4.0214 8.0149 121.1245 58.9850 29.6074 177.6021 21 H 4.8536 8.6119 113.2383 54.2260 30.6611 176.0001 22 G 4.1720 7.7644 105.7292 45.4873 0.0000 174.9456 23 V 3.3047 8.2836 119.2453 65.9386 31.8504 178.2539 24 D 4.3018 8.1189 117.5452 57.3392 40.7119 177.6305 25 A 4.2102 7.3118 117.4455 53.9406 18.7205 177.7408 26 T 4.2584 7.5920 113.3600 63.2969 69.1765 174.2693 27 T 4.7230 8.0720 114.9945 59.3181 71.7459 174.0718 28 I 3.8032 8.3389 122.0245 64.3486 38.2925 178.3920 29 E 4.1044 7.7084 118.0338 56.8877 28.8371 178.8492 *31 I 4.0310 7.9508 121.8854 61.3462 39.3075 178.3401 32 R 4.0989 7.9466 118.5877 58.9332 28.8885 178.7271 33 D 4.3494 7.9704 118.8242 57.0572 40.9116 178.3757 34 R 4.0298 7.8713 118.2134 58.8599 30.3021 177.8077 35 S 4.4075 8.3143 112.8524 58.1737 63.5822 175.3824 36 G 3.8202 7.9666 109.2635 45.6704 0.0000 173.1521 37 A 4.5498 7.5883 123.1765 50.4984 20.3980 177.8237 38 S 4.3585 8.2972 116.3568 58.0772 65.3353 175.7517 39 I 3.9318 8.3285 123.1794 64.3475 36.8101 178.7435 40 G 3.7311 8.1802 106.2436 48.0188 0.0000 175.4279 41 S 4.0844 8.1752 115.6778 61.0777 62.4592 176.1044 42 L 4.0891 8.2154 121.7366 58.2417 41.6729 179.2368 43 Y 4.0391 8.3062 116.6879 60.9535 37.5775 177.7367 44 H 4.1941 8.2329 118.6027 59.5837 30.1164 176.8548 45 H 4.1204 8.1339 116.7822 59.0076 28.6120 175.2335 46 F 4.9869 8.7662 114.4091 55.3981 42.7083 179.7316 47 G 3.6445 7.3825 113.9892 45.6861 0.0000 170.7823 48 N 4.2369 7.5442 119.8268 51.6326 40.7592 174.9854 49 K 3.9040 8.5490 119.5864 60.1711 32.1723 178.5389 50 E 3.9984 8.2585 118.9354 59.2874 29.4824 178.6532 51 R 3.9116 8.3504 118.7585 59.4185 30.1106 178.4137 52 I 3.3415 7.9033 119.7744 64.4855 37.1367 177.6304 53 H 4.5542 8.9529 119.5453 59.6590 29.6264 177.5497 54 G 3.7558 8.2657 107.3100 47.8709 0.0000 175.5616 55 E 4.0225 8.5474 121.2763 58.9715 29.4045 179.0725 56 L 4.0113 8.3006 120.9003 58.2452 42.1071 178.3871 57 Y 4.3343 8.4066 119.2559 61.0430 38.8023 178.1124 58 L 4.1210 8.6588 119.9834 57.8050 41.8377 179.4213 59 A 4.2139 8.8033 121.3869 54.9772 17.9113 180.0271 60 G 2.6278 8.3265 104.4590 47.6711 0.0000 176.0957 61 I 3.5096 7.3430 116.4429 63.3016 37.4236 178.4310 62 G 3.6106 8.1985 107.5742 47.6220 0.0000 175.7592 63 Q 3.9077 7.5039 120.0427 58.7335 28.7678 177.8761 64 Y 3.7825 6.8425 119.0654 60.6233 38.7221 178.1110 65 A 3.6342 7.6942 121.3068 54.9087 18.2794 179.4969 66 A 3.8344 7.8450 119.4161 55.0443 18.3311 179.7908 67 L 3.7894 7.6682 117.5860 57.8959 41.6833 179.7927 68 L 3.1687 7.1867 118.5906 57.2949 41.5724 179.0311 69 E 3.9095 8.0374 119.1359 59.3198 29.3369 178.7454 70 A 4.1569 7.8637 119.5809 55.1935 18.7459 179.5879 71 G 3.5557 8.0860 104.3547 47.7856 0.0000 175.9350 72 F 4.5912 8.4093 120.3728 60.5223 38.6733 177.4063 73 A 4.1809 7.6112 118.2321 54.4025 18.2039 178.2992 74 R 4.4383 7.6286 112.4478 55.6226 31.2862 176.0061 75 A 4.2460 7.6689 121.4509 52.3533 18.6415 177.7316 76 R 4.3692 8.9688 123.0803 56.1707 30.6592 176.1583 77 S 4.4385 7.2192 109.9240 57.0200 66.3593 176.1018 78 A 2.5800 7.4080 124.1607 54.6483 17.8873 179.4306 79 E 2.0000 7.0325 117.0606 58.9761 29.4342 178.7766 80 E 3.8060 7.7997 118.3617 59.6381 29.2159 179.5936 81 T 4.0173 7.5892 115.0406 66.5960 68.6983 176.6089 82 V 3.9105 7.9719 120.1072 66.2017 31.6780 178.1707 83 R 3.9543 8.2218 118.1444 59.2418 29.8764 178.6083 84 L 3.9595 8.1741 120.1469 58.3226 41.5452 179.0050 85 L 4.0955 7.8588 118.7435 57.6752 41.5347 179.7452 86 V 3.6510 7.6451 117.7605 66.1523 31.7560 178.0718 87 T 3.9460 8.4250 109.9069 64.9637 68.4564 176.4262 88 S 4.1751 8.2518 118.0113 61.5147 62.7674 176.1056 89 Y 4.0985 7.9575 121.8838 60.7419 38.5420 177.8444 90 I 3.5006 7.8878 120.6797 64.4809 37.2363 178.1798 91 D 4.2839 8.3323 119.9183 57.1021 40.6417 178.6915 92 W 3.9879 8.2484 128.8595 60.3411 30.4591 178.2290 93 V 3.3795 7.6632 117.3097 65.9676 31.0572 177.8213 94 V 3.6809 7.6809 116.8173 65.9879 31.3917 177.5653 95 A 4.1334 7.7236 119.4101 53.7870 19.5597 177.2257 96 N 4.8816 7.5586 114.3711 50.8871 39.4315 173.9420 97 P 4.4021 0.0000 0.0000 66.1591 31.8818 178.0889 98 D 4.3734 8.0214 118.2384 56.8020 40.7610 178.2997 99 W 4.4862 8.2224 128.2112 60.4640 30.7434 177.6257 100 A 4.3937 8.5488 121.2037 55.3645 17.6719 179.3998 101 R 3.8767 8.1696 116.0949 59.6281 30.5504 178.1064 102 F 4.4411 8.7130 120.3331 61.5588 39.3496 177.0905 103 I 3.8973 8.4729 119.5543 64.5580 36.7308 178.4360 104 L 4.1089 8.1565 118.2229 56.8743 41.4921 178.0372 105 H 4.9413 7.6799 113.2561 55.5378 30.0541 175.1839 106 S 4.4715 7.5515 116.3421 57.6933 63.8022 175.7490 107 R 3.1477 7.8069 122.5734 59.0717 29.9347 178.0420 108 G 3.7029 7.9708 104.9850 48.0712 0.0000 175.1733 109 R 3.8130 7.7175 119.4740 59.0901 29.9406 178.2930 110 V 3.6846 7.4435 117.9850 65.8193 31.2435 177.8581 111 E 3.9399 8.3976 117.6192 59.2512 29.2060 179.0035 112 A 4.0514 7.9774 121.1821 56.0373 18.6143 178.4866 113 G 4.0360 7.8778 106.9569 44.6681 0.0000 174.3845 114 E 4.2518 8.7727 119.7760 57.9078 30.2575 177.0608 115 L 4.6012 7.7975 118.3990 54.5655 42.2931 178.3795 116 G 3.6074 7.8323 108.0841 47.9556 0.0000 176.1992 117 E 4.0148 8.1089 120.4443 59.3114 29.5408 179.5415 118 R 3.9587 7.9477 117.6668 58.9479 30.1608 178.6056 119 L 4.0235 8.2153 120.3992 58.2535 42.0218 179.2536 120 R 3.8972 8.1318 117.6497 59.2716 29.9922 178.9246 121 A 3.9962 8.1655 120.5023 55.1676 18.3181 179.3784 122 D 4.1854 8.4787 117.7253 57.6186 40.9253 178.5882 123 N 4.3170 8.4639 117.2858 56.5243 38.5951 177.1388 124 Q 4.0185 8.4390 120.7706 59.2512 29.1680 178.2555 125 A 4.0619 8.2153 121.8215 55.4468 18.4184 179.3770 126 H 4.2517 8.3826 114.8314 59.0801 28.7921 177.7959 127 F 4.1949 8.5954 122.3206 61.3283 39.1693 177.0062 128 A 3.6664 8.3232 120.4307 54.9169 18.1411 179.6634 129 R 3.7736 7.9934 117.2839 59.5390 30.2883 178.8422 130 I 3.6244 7.6737 119.6151 64.5766 36.9902 177.7925 131 H 3.7419 8.0688 119.2071 59.1802 29.3428 177.1378 132 A 3.8448 7.7762 121.2428 55.0262 18.2378 179.2293 133 A 3.6762 7.4911 118.4006 54.5001 18.5278 179.0731 134 L 4.4849 7.5743 116.2185 56.2507 42.0365 178.9613 135 A 3.9964 7.4871 121.6643 54.9011 18.3337 179.8915 136 G 3.2942 7.6740 103.7683 48.0844 0.0000 175.4053 137 Y 4.2088 7.3475 118.7849 60.7883 37.8734 178.8173 138 R 4.0318 8.2349 118.8133 59.2946 30.0088 178.9820 139 A 4.0677 8.1240 119.6540 54.7994 18.4165 178.6138 140 E 4.2754 7.8130 114.5843 56.1999 29.7810 177.1524 141 G 3.8824 7.8142 107.1535 46.4239 0.0000 174.8062 142 L 4.2332 7.5749 119.6894 55.6126 42.5339 176.6997 143 F 5.8330 7.7492 116.9652 55.0370 42.0469 175.5044 144 R 4.1782 9.0817 118.9601 56.2609 29.8944 176.6013 145 E 4.0880 8.6619 121.0664 55.9445 30.4526 175.3323 *147 P 4.2622 0.0000 0.0000 62.1836 33.9261 177.5288 148 D 4.4189 8.6678 120.7899 58.0273 40.9180 179.2041 149 D 4.4425 8.1451 118.6406 57.3585 40.8599 178.4952 150 C 4.1146 8.0749 116.8218 62.7695 28.2171 175.2831 151 F 3.8673 8.3831 122.1522 61.4694 38.8657 176.9165 152 A 4.1462 8.4021 120.0233 55.7033 18.1644 179.9202 153 S 4.0992 8.0389 113.1886 61.5832 62.6210 177.4023 154 V 3.5120 8.0687 114.9060 64.2303 31.3303 178.5070 155 V 3.5192 7.5893 117.1455 65.5279 31.7320 177.1528 156 I 4.1482 7.6807 116.6982 61.2908 38.3461 177.5514 157 G 3.5608 8.0254 107.1233 47.6479 0.0000 173.7367 158 P 4.2332 0.0000 0.0000 65.0842 31.3146 178.4476 159 A 4.0428 7.9331 118.8483 55.5914 18.3416 179.0351 160 H 4.1571 8.4206 115.0829 59.1428 28.7664 177.5646 161 D 4.3158 8.5337 119.9787 57.3231 41.1719 177.9451 162 L 4.0002 8.5839 120.9747 58.0599 42.0014 178.6592 163 A 4.1889 8.4359 120.9359 55.2599 18.5146 179.3051 164 R 3.9350 8.2917 117.2276 59.9986 30.0994 178.7269 165 Q 4.0654 8.2030 117.5719 58.6192 28.7300 178.5335 166 W 4.2193 8.8657 129.7447 60.6757 30.6042 178.0748 167 L 3.6053 8.3407 117.6414 57.2762 41.1102 178.4683 168 A 4.3494 7.7644 117.6335 51.3316 18.8028 177.1084 169 G 3.7213 7.7986 105.4703 47.3948 0.0000 174.9547 170 R 4.5881 8.5388 115.9848 55.4422 30.8619 176.0992 171 T 4.7792 7.8125 107.4617 60.2072 71.2105 173.7436 172 R 4.7098 8.4226 119.8239 56.1655 30.7438 176.6417 173 V 4.5159 7.5778 108.8894 59.3117 35.8355 175.0397 174 A 4.3694 8.3881 125.2418 51.4678 19.4282 178.0288 175 L 3.4314 7.6456 124.8892 58.3220 41.7850 179.1844 176 A 3.8599 7.4925 119.6087 55.0970 18.0731 178.5490 177 D 4.5490 7.7764 115.2353 55.8948 41.2503 177.2882 178 C 4.6355 7.6643 116.8874 59.1626 28.7208 175.2585 179 R 3.8231 7.6156 122.1759 59.5771 29.6173 178.1125 180 E 3.9102 8.0498 118.4084 59.0632 29.7199 178.0988 181 L 3.9399 7.8995 119.8647 58.4326 42.1143 178.9233 182 L 4.0481 8.1159 118.5398 57.5156 41.5857 179.3759 183 A 3.9987 8.1137 120.8296 55.1974 18.3064 179.4634 184 Q 4.0033 8.4399 118.4731 59.4514 29.0925 178.6427 185 V 3.5828 8.3243 119.5006 65.7139 31.5489 177.7479 186 A 3.9042 8.2158 120.6846 54.8902 18.2575 179.3349 187 W 4.4383 8.1282 126.4836 61.0760 30.6657 177.9721 188 D 4.0361 8.2795 117.4937 57.2550 40.2094 178.7153 189 S 4.1970 8.0125 115.3743 60.6433 63.2008 175.2500 190 V 4.2857 7.3465 112.8234 61.1777 33.3425 176.8079 191 R 4.2808 7.5110 117.2116 55.3647 29.8364 176.7058 192 A 4.1522 8.4833 123.1786 51.9095 19.2731 177.7009 193 A 4.0395 8.4470 121.9819 52.5406 18.4605 177.7159 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 6 R 8.11 4.29 0.00 1.97 1.96 0.00 3.28 0.00 0.00 3.34 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 7 K 8.45 3.72 0.00 1.92 1.99 0.00 0.84 0.00 0.00 1.51 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.08 1.42 7.81 8 D 8.30 4.42 0.00 2.72 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 9 E 8.12 3.90 0.00 2.03 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 2.34 2.37 0.00 10 I 7.66 3.67 2.22 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 1.56 0.48 1.07 0.00 0.00 11 L 8.14 3.73 0.00 1.69 1.44 1.01 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 12 Q 8.02 3.54 0.00 1.92 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 13 A 7.81 3.80 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 14 A 7.76 3.33 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.49 3.45 0.00 1.10 1.37 0.80 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 16 A 7.73 3.88 1.25 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 17 C 7.86 4.04 0.00 2.86 2.97 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 18 F 8.18 4.60 0.00 3.07 3.07 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 19 S 8.13 4.25 0.00 3.96 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 20 E 8.01 4.02 0.00 1.95 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 1.83 2.20 0.00 21 H 8.61 4.85 0.00 3.28 3.33 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 22 G 7.76 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 0.00 0.00 0.00 0.00 23 V 8.28 3.30 1.95 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 0.68 0.00 0.00 0.64 0.00 0.00 24 D 8.12 4.30 0.00 2.70 2.71 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 0.00 0.00 0.00 0.00 25 A 7.31 4.21 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 26 T 7.59 4.26 4.76 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 1.29 0.00 0.00 27 T 8.07 4.72 4.44 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 1.24 0.00 0.00 28 I 8.34 3.80 1.94 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 1.56 1.26 1.02 0.00 0.00 29 E 7.71 4.10 0.00 2.11 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 2.35 2.36 0.00 *31 I 7.95 4.03 1.96 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 1.24 0.74 0.81 0.00 0.00 32 R 7.95 4.10 0.00 2.31 2.19 0.00 3.06 0.00 0.00 3.29 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 33 D 7.97 4.35 0.00 2.68 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 R 7.87 4.03 0.00 1.76 1.88 0.00 3.31 0.00 0.00 3.20 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 35 S 8.31 4.41 0.00 4.02 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 36 G 7.97 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 37 A 7.59 4.55 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 38 S 8.30 4.36 0.00 4.08 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 39 I 8.33 3.93 1.93 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.60 1.07 0.00 0.00 40 G 8.18 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 41 S 8.18 4.08 0.00 3.94 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 42 L 8.22 4.09 0.00 2.01 1.75 0.96 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 43 Y 8.31 4.04 0.00 3.35 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 44 H 8.23 4.19 0.00 3.21 3.34 0.00 5.76 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 H 8.13 4.12 0.00 2.82 2.47 0.00 5.65 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 F 8.77 4.99 0.00 3.14 2.78 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 47 G 7.38 3.64 0.00 0.00 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 0.00 0.00 0.00 0.00 123 N 8.46 4.32 0.00 2.97 2.92 0.00 0.00 6.74 7.53 0.00 0.00 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 Q 8.44 4.02 0.00 2.23 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 125 A 8.22 4.06 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 0.00 126 H 8.38 4.25 0.00 3.42 3.42 0.00 5.65 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 F 8.60 4.19 0.00 3.22 3.34 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 0.00 128 A 8.32 3.67 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 0.00 129 R 7.99 3.77 0.00 2.01 2.17 0.00 3.15 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 1.77 1.95 0.00 130 I 7.67 3.62 1.97 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.22 0.99 0.00 0.00 131 H 8.07 3.74 0.00 2.28 2.89 0.00 5.59 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 A 7.78 3.84 1.22 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 0.00 133 A 7.49 3.68 0.18 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 0.00 0.00 134 L 7.57 4.48 0.00 1.51 1.59 0.69 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 135 A 7.49 4.00 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 0.00 136 G 7.67 3.29 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 0.00 137 Y 7.35 4.21 0.00 3.11 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 R 8.23 4.03 0.00 2.08 2.04 0.00 3.04 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.18 0.00 139 A 8.12 4.07 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 0.00 140 E 7.81 4.28 0.00 2.14 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 2.31 2.40 0.00 141 G 7.81 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 0.00 0.00 0.00 142 L 7.57 4.23 0.00 1.17 1.56 0.97 1.23 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 0.00 143 F 7.75 5.83 0.00 3.02 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 0.00 144 R 9.08 4.18 0.00 1.77 2.12 0.00 3.03 0.00 0.00 3.27 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 145 E 8.66 4.09 0.00 2.01 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 2.36 2.36 0.00 *147 P 0.00 4.26 0.00 2.22 2.04 0.00 3.65 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 2.03 2.20 0.00 148 D 8.67 4.42 0.00 2.80 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 0.00 149 D 8.15 4.44 0.00 2.72 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 0.00 150 C 8.07 4.11 0.00 3.21 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 0.00 151 F 8.38 3.87 0.00 3.10 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 0.00 152 A 8.40 4.15 1.52 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 0.00 0.00 153 S 8.04 4.10 0.00 3.91 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 0.00 154 V 8.07 3.51 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 0.72 0.00 0.00 0.72 0.00 0.00 155 V 7.59 3.52 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 0.77 0.00 0.00 0.24 0.00 0.00 156 I 7.68 4.15 1.73 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.39 0.70 0.00 0.00 157 G 8.03 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 0.00 0.00 0.00 158 P 0.00 4.23 0.00 2.15 2.11 0.00 3.58 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 2.07 2.13 0.00 159 A 7.93 4.04 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 0.00 160 H 8.42 4.16 0.00 3.27 3.28 0.00 5.64 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 0.00 161 D 8.53 4.32 0.00 2.89 2.81 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 0.00 162 L 8.58 4.00 0.00 1.88 1.70 0.98 1.03 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 0.00 163 A 8.44 4.19 1.66 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 0.00 0.00 164 R 8.29 3.93 0.00 2.15 2.19 0.00 3.14 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 165 Q 8.20 4.07 0.00 2.37 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.58 0.00 0.00 0.00 0.00 0.00 2.69 2.57 0.00 166 W 8.87 4.22 0.00 3.39 3.49 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.34 3.61 0.00 1.87 1.70 1.08 0.87 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 0.00 168 A 7.76 4.35 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 0.00 169 G 7.80 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 0.00 170 R 8.54 4.59 0.00 1.87 1.94 0.00 3.13 0.00 0.00 3.29 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.66 0.00 171 T 7.81 4.78 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 1.38 0.00 0.00 172 R 8.42 4.71 0.00 1.84 2.00 0.00 3.17 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 173 V 7.58 4.52 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 0.74 0.00 0.00 0.97 0.00 0.00 174 A 8.39 4.37 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 0.00 175 L 7.65 3.43 0.00 0.27 0.13 0.74 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 176 A 7.49 3.86 1.21 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 0.00 0.00 177 D 7.78 4.55 0.00 2.82 2.70 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 0.00 178 C 7.66 4.64 0.00 2.98 2.87 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 0.00 0.00 0.00 179 R 7.62 3.82 0.00 1.81 1.97 0.00 3.05 0.00 0.00 3.07 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 180 E 8.05 3.91 0.00 2.11 1.92 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 2.38 2.43 0.00 181 L 7.90 3.94 0.00 1.79 1.80 0.92 0.65 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 0.00 182 L 8.12 4.05 0.00 1.74 1.71 0.95 0.60 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 0.00 183 A 8.11 4.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 Q 8.44 4.00 0.00 2.25 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.75 0.00 0.00 0.00 0.00 0.00 2.40 2.60 0.00 185 V 8.32 3.58 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 1.01 0.00 0.00 186 A 8.22 3.90 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 0.00 187 W 8.13 4.44 0.00 3.44 3.28 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 0.00 188 D 8.28 4.04 0.00 2.69 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 0.00 189 S 8.01 4.20 0.00 3.86 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 0.00 190 V 7.35 4.29 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 -0.02 0.00 0.00 0.86 0.00 0.00 191 R 7.51 4.28 0.00 0.83 0.66 0.00 2.42 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.13 0.00 192 A 8.48 4.15 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 0.00 193 A 8.45 4.04 1.22 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 * Residues marked with a * may have inaccurate shift predictions.