NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.4629 8.1576 120.1358 56.9572 34.9391 173.5863 3 S 5.0887 8.5425 113.3004 56.4902 66.3456 171.3108 4 Y 5.1554 9.7545 119.1438 56.2764 41.6390 175.8526 5 F 5.6290 9.3035 125.8943 57.0403 42.3194 173.7867 6 V 4.3189 8.8296 118.5856 60.3283 36.5088 173.8675 7 T 5.3217 7.5544 115.3523 61.0811 69.0474 171.9704 *9 G 3.9214 7.9854 106.8776 45.6871 0.0000 174.1722 10 F 5.1320 8.7152 123.7441 57.1241 39.1533 174.6820 11 N 4.9227 7.9131 119.2166 51.1059 40.7769 174.1193 12 E 4.3159 8.7914 124.5723 57.9375 30.1108 178.4267 13 T 3.8513 8.4946 112.2020 64.8693 68.7234 176.5508 14 F 4.0996 7.9942 120.3180 60.1751 38.9302 177.1969 15 L 3.9412 7.9623 119.5993 58.1312 41.9654 178.8160 16 L 3.9115 7.8352 118.8008 57.6619 41.4415 179.4425 17 R 3.8038 8.1534 118.8313 59.2170 30.0423 178.2020 18 L 3.7170 7.9506 120.1077 58.1827 42.0036 178.9781 19 L 3.3594 7.7188 118.8663 57.4368 41.4068 179.0694 20 N 4.4244 8.0409 118.2795 56.3113 38.7775 176.5601 21 E 4.0249 8.2933 119.8215 58.5025 29.6250 177.8582 22 T 4.4891 7.4876 107.2994 60.3838 70.4083 174.7137 23 S 3.6877 7.9746 114.0996 59.8547 60.6597 172.9891 24 A 4.4373 8.0858 121.6321 52.0664 19.3266 177.5817 25 Q 4.7828 9.3372 121.5321 53.6332 31.0682 176.9205 26 K 3.9440 8.7067 121.5747 59.6278 32.2662 178.2260 27 E 4.3595 8.0704 115.6684 57.4933 29.9645 176.3630 28 D 4.7800 7.8753 118.8126 54.4643 42.0185 175.8853 29 S 4.7163 8.9431 117.3661 57.3471 64.8197 172.9995 30 L 5.2126 8.6550 126.7569 53.3056 44.5951 174.8272 31 V 5.0804 9.2735 126.7431 61.2006 34.6218 174.0975 32 I 5.3443 9.0627 128.3489 59.4764 40.5977 174.5915 33 V 5.1065 8.7256 126.4469 60.1497 33.8710 175.2465 34 V 4.9071 8.8861 117.0787 58.5417 36.0528 173.3844 35 P 4.8825 0.0000 0.0000 63.1362 32.1924 175.2406 36 S 4.8963 8.2815 116.5322 56.0979 63.7132 172.3350 37 P 4.6529 0.0000 0.0000 62.2316 32.1983 175.9022 38 I 4.1126 8.0273 120.4451 60.4812 37.0342 177.2744 39 V 3.9607 8.1739 119.1868 60.6970 33.5873 177.1890 40 S 4.1718 8.6962 116.7981 62.0890 62.6210 177.4983 41 G 2.8756 7.6407 107.5743 47.8048 0.0000 175.8137 42 T 4.4805 7.8179 118.9655 65.9611 68.6546 176.8661 43 R 3.9098 8.3338 120.0958 59.2995 30.0791 179.0089 44 A 3.9666 8.2343 120.2921 55.0007 18.3830 179.4564 45 A 4.1124 8.0085 119.3352 55.4920 18.3926 179.9512 46 I 3.7042 8.0097 118.3417 64.6472 37.2020 178.6099 47 E 3.9778 8.3200 119.4529 59.2323 29.2570 179.3910 48 S 4.0361 8.1279 113.3138 61.1860 62.5091 175.7652 49 L 3.9564 8.3180 123.4446 58.4329 41.8232 179.1701 50 R 3.9407 8.3635 117.9422 59.1623 29.9840 178.9347 51 A 3.9836 7.9463 120.4232 55.4210 18.4395 179.8076 52 Q 3.9491 8.1773 116.5534 58.8875 28.7905 178.7924 53 I 3.8112 8.2752 121.3696 64.5229 36.9328 178.4423 54 S 4.0997 8.1193 115.8174 61.8147 62.5072 176.8148 55 R 3.8617 7.6950 119.6594 58.7645 29.8023 177.4876 56 L 4.1635 7.2767 115.6188 53.0007 42.1435 175.8953 57 N 4.1128 7.4893 114.9865 54.4237 36.9528 173.9834 58 Y 4.8379 7.6745 114.6592 55.8531 39.5591 173.6416 59 P 4.5587 0.0000 0.0000 61.4990 31.7272 174.6044 60 P 4.4100 0.0000 0.0000 61.8411 31.9804 174.0581 61 P 4.7639 0.0000 0.0000 62.6908 32.6941 175.5813 62 R 4.3597 8.8376 122.0788 55.1567 31.6203 175.2291 63 I 4.8722 8.0188 124.9383 59.6208 39.4605 174.6158 64 Y 4.8712 9.1212 125.0349 55.9830 41.0033 174.3069 65 E 5.3197 8.9797 121.9556 54.6937 31.7937 175.1636 66 I 4.8054 8.9030 116.6184 58.9831 41.5880 174.1505 67 E 4.5005 8.7235 122.6431 56.1782 30.4936 177.2537 68 I 4.5338 8.2798 123.6849 59.4179 37.9890 174.5697 69 T 4.5332 8.0417 111.9575 61.2348 70.9274 175.3116 70 D 4.7030 7.6437 120.5406 51.6449 45.3361 174.5907 71 F 4.0471 9.0049 128.9192 61.9339 39.4677 177.3107 72 N 4.3475 8.3807 115.3196 56.1473 38.6354 177.3829 73 L 3.9515 8.7699 120.7125 57.7087 41.7319 179.4981 74 A 4.0017 8.0865 120.7614 54.9846 18.3430 179.2688 75 L 3.6702 7.9429 119.3228 58.2089 41.9615 179.0001 76 S 4.0287 8.0580 113.0033 61.4940 62.1315 176.5161 77 K 3.9282 7.5717 119.8439 59.4622 31.7414 179.3929 78 I 3.7993 7.7538 120.0637 64.5110 36.9461 178.5290 79 L 3.9447 8.3744 120.1477 57.7695 41.1750 179.0933 80 D 4.2874 7.9268 118.0918 57.4306 41.0146 178.9406 81 I 3.5856 7.3324 119.9534 64.3299 37.1509 178.3647 82 I 3.4596 7.5251 120.5917 64.4128 36.8218 178.2021 83 L 4.1702 7.9805 117.4688 56.3894 41.5069 178.2884 84 T 4.2984 7.4429 108.7416 60.8650 69.8361 174.6165 85 L 4.2976 7.2604 123.0772 53.0599 42.5901 175.0285 86 P 4.3888 0.0000 0.0000 62.7856 31.9965 175.8333 87 E 4.4424 8.3314 119.9107 54.7071 31.1027 174.3860 88 P 4.7253 0.0000 0.0000 62.8271 33.5201 174.8748 89 I 4.9195 8.5108 122.1485 59.7606 38.8507 174.7827 90 I 5.0366 8.6384 128.2756 59.7317 39.5351 174.8066 91 S 5.0582 9.1363 120.0600 56.9791 66.7126 171.9677 92 D 5.1604 8.4959 121.9230 52.6388 43.6218 174.5755 93 L 5.0294 8.4786 124.7861 53.9084 42.4330 177.2989 94 T 3.8756 8.1851 114.8263 64.2017 67.4519 176.2971 *96 G 3.7435 7.7220 110.0687 45.6864 0.0000 175.5377 *98 R 4.0400 7.4095 117.0793 55.3209 32.0146 178.0850 *100 I 4.0601 7.7998 119.9367 61.5367 39.3704 177.9652 101 N 4.2037 7.9978 117.0486 56.4881 38.1737 177.4825 102 T 3.8689 8.0172 117.0988 66.6763 68.5398 176.6804 103 L 3.9167 7.8688 120.3470 57.7489 41.5760 179.5090 104 I 3.6205 7.9001 119.9098 64.1961 37.0625 178.1597 105 L 3.8123 7.9839 121.1230 58.2309 41.8907 178.9942 106 L 4.1165 8.1788 119.1342 57.6735 41.5544 179.7132 107 G 3.6346 8.4234 106.0360 47.9219 0.0000 175.7312 108 I 3.6779 7.6152 121.2885 63.9864 37.2523 178.3744 109 I 3.8836 7.5871 120.4326 64.6351 36.8339 178.9695 110 V 3.8403 7.9079 111.5578 63.6143 31.4681 178.4309 111 S 4.2035 7.9539 113.5106 59.2962 62.8406 175.3284 112 R 3.9886 7.6173 118.9349 56.5120 28.1449 176.4724 113 K 4.4485 7.7843 117.3790 55.9543 32.8831 177.0935 114 R 4.4296 9.1708 121.2158 56.6797 31.1552 175.8046 115 F 5.3650 8.7018 115.9040 56.3999 41.8483 172.9725 116 T 4.7899 8.9327 116.3200 61.8119 72.4847 173.0818 117 V 4.7281 8.3140 125.7093 61.1909 34.6821 173.7516 118 Y 5.1706 8.9443 124.7878 56.3094 41.2800 174.9874 119 V 4.7231 8.9662 121.9508 61.6290 34.9593 174.8870 120 R 5.0991 8.7098 127.0968 53.9925 33.1276 175.4688 121 D 4.4008 8.5829 119.9666 54.5886 41.1224 176.8744 122 E 3.9753 8.8068 126.8191 58.7158 29.7725 177.9324 123 G 3.7972 8.1117 105.8943 45.8702 0.0000 174.5899 124 G 3.9495 8.2675 108.2346 44.8359 0.0000 174.0375 125 G 4.0456 7.9990 107.8072 44.7354 0.0000 173.7651 126 S 4.4676 8.3687 112.3616 59.0872 63.9640 174.9166 127 R 4.3575 7.7607 121.7109 56.5798 30.9917 175.8453 128 V 5.0740 8.2324 121.0006 60.4908 34.4022 173.3279 129 I 4.8868 8.9616 116.5665 59.4127 40.6229 174.3963 130 S 5.0639 8.4854 117.1592 57.3000 66.1450 172.5287 131 F 4.9889 8.0156 115.0605 56.1955 41.8078 172.3294 132 N 4.8356 8.7902 116.4389 50.3938 40.5992 174.6883 133 D 3.7620 7.2597 117.5327 56.4409 39.0239 178.3029 134 N 4.0669 7.8273 117.5396 56.2438 38.7049 177.0528 135 T 3.7756 8.0673 117.1238 66.9242 68.3791 176.6988 136 I 3.8018 7.3366 119.6679 64.1467 37.2463 177.9998 137 R 4.0166 7.9753 118.7475 59.4527 29.9268 178.0590 138 A 4.2379 7.6461 119.3947 55.0242 18.3728 179.2558 139 L 4.2280 7.4080 114.2124 54.5824 42.2474 176.9486 *141 R 3.9048 7.4218 117.8580 56.1791 30.8233 174.6032 142 D 4.6707 8.2941 123.9424 53.2830 40.9474 175.9342 143 Y 4.3380 8.3967 122.6443 56.9506 38.8838 175.9899 144 S 4.4386 8.9056 118.6978 57.6504 64.1361 174.5481 145 R 4.0552 8.6010 120.9662 59.6580 30.0973 177.7095 146 E 4.1407 8.1827 116.8655 59.4184 29.8071 179.1879 147 E 4.1489 8.2608 115.5979 57.0972 29.1241 178.8562 *149 K 4.1984 8.1920 120.2774 56.5459 34.3014 177.9530 150 L 3.9172 8.0586 119.8528 58.2877 41.9497 178.9783 151 L 3.9676 8.0863 119.0255 57.8924 41.4826 179.0896 152 N 4.3985 8.1235 116.4645 56.5631 38.8878 176.9872 153 V 3.5860 7.8902 119.8027 65.9560 31.6669 177.8793 154 L 3.9959 7.9092 118.7835 57.9617 41.5547 178.8648 155 Y 4.1675 8.2204 119.2673 61.0756 38.6296 178.2305 156 E 3.6827 8.3004 118.2342 58.6374 29.6445 178.4978 157 T 4.1914 7.7260 107.6824 60.5957 69.5552 174.4348 158 K 3.6680 8.8110 121.5711 57.4277 31.3366 175.4386 159 G 4.5055 9.1503 102.3511 45.6997 0.0000 173.5085 160 T 4.3905 7.8844 113.2450 59.5154 70.2845 173.1283 161 G 4.0757 8.4658 111.6058 44.0285 0.0000 174.7520 162 I 3.7038 8.2589 121.8640 64.7183 37.0307 178.7129 163 T 4.0987 7.8220 117.0618 66.1996 68.0968 176.3460 164 E 3.9677 8.0151 118.3816 59.2927 29.6885 178.6235 165 L 4.0745 8.0315 119.3815 58.1042 42.3665 178.5805 166 A 4.2045 8.4739 121.2113 54.8356 17.9214 179.7268 167 K 4.3613 7.6881 115.1289 56.9951 31.9392 178.6515 *169 L 4.2242 7.7907 117.8191 53.3151 43.7072 175.9935 170 D 4.3810 7.6831 115.9789 55.3454 39.8887 172.8263 171 K 4.7376 8.1132 116.0769 53.7163 36.5875 177.7106 172 S 4.4328 8.2892 115.8180 58.1154 64.9825 175.1846 173 E 3.9286 8.6742 122.8601 59.3486 29.2741 179.4896 174 K 3.9390 8.0168 119.1719 59.8972 32.3514 178.6386 175 T 3.8319 7.8489 115.7956 66.6103 68.3607 176.3590 176 L 3.9317 8.1056 122.1665 58.2177 42.1264 178.7991 177 I 3.6742 8.2284 120.1256 64.6754 37.1067 178.1569 178 N 4.3340 8.1155 116.9830 56.1652 38.3899 177.4872 179 K 3.9544 8.0243 120.9705 59.4953 32.2269 178.8761 180 I 3.7005 8.5047 120.3176 64.3038 36.8786 178.0087 181 A 3.9893 8.1513 121.6128 55.2286 18.1625 179.3230 182 E 3.8674 8.0993 117.3593 59.6482 29.2958 179.1804 183 L 4.1879 8.1076 118.8511 57.3535 41.5374 179.3770 184 K 4.1788 8.3973 120.2664 59.5810 31.9204 179.0459 185 K 4.1166 7.7861 117.6197 59.1134 32.0515 178.7738 186 F 4.4437 8.0774 119.9986 59.4983 39.3223 175.9817 187 G 3.9506 7.9838 106.0813 45.3089 0.0000 173.6603 188 I 4.6996 7.6524 111.2553 60.4956 39.0401 174.7996 189 L 5.1785 7.6963 121.7757 55.1336 43.5451 174.2397 190 T 4.9519 9.0060 109.7907 60.4747 72.7920 172.3915 191 Q 5.4428 8.2074 117.8421 55.9301 31.3870 173.2037 *197 K 4.1612 8.2920 118.3198 56.4185 33.6325 174.1004 198 V 4.7627 8.6399 128.1502 61.5059 33.5520 174.1682 199 E 4.9915 9.1512 127.8876 54.2359 33.2840 174.7814 200 L 4.5367 8.7189 126.1231 54.8143 42.6385 177.0693 201 N 4.9183 8.1556 119.9063 51.6470 41.1296 175.6466 202 E 3.9741 8.5529 118.3518 59.3792 29.3720 179.2155 203 L 4.0174 8.0124 120.3387 58.1333 42.3060 178.9004 204 G 3.7079 8.7635 106.0728 48.0211 0.0000 175.5664 205 L 3.9881 8.0694 121.1100 57.5947 41.5991 179.3551 206 N 4.3473 8.1129 116.3750 55.9459 38.4266 177.6079 207 V 3.5332 7.6713 119.8567 65.9525 31.5024 177.9942 208 I 3.4493 7.6172 119.4828 64.2148 36.7769 178.1391 209 K 3.7458 7.7023 120.0840 59.6876 31.9936 178.8212 210 L 3.9923 7.9550 119.0415 57.7189 41.5344 179.0425 211 N 4.5072 8.2840 116.1330 55.3530 38.3169 177.6380 212 K 3.9283 7.9861 120.2220 59.3837 32.2132 178.8826 213 S 4.2408 7.4467 113.3508 61.5124 62.8722 176.3911 214 V 3.7200 7.5413 120.8178 65.6135 31.3952 176.2771 215 I 4.0082 7.6433 122.5544 61.6490 37.0818 175.7189 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 K 8.16 4.46 0.00 1.95 2.00 0.00 1.29 0.00 0.00 1.78 0.00 0.00 2.85 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.69 1.14 7.81 3 S 8.54 5.09 0.00 3.86 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 4 Y 9.75 5.16 0.00 2.98 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 5 F 9.30 5.63 0.00 2.84 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 6 V 8.83 4.32 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 0.77 0.00 0.00 0.97 0.00 0.00 7 T 7.55 5.32 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 1.15 0.00 0.00 *9 G 7.99 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 10 F 8.72 5.13 0.00 3.03 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 11 N 7.91 4.92 0.00 2.75 2.85 0.00 0.00 7.10 7.65 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 12 E 8.79 4.32 0.00 2.22 2.32 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 2.36 2.31 0.00 13 T 8.49 3.85 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 1.19 0.00 0.00 14 F 7.99 4.10 0.00 3.10 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 15 L 7.96 3.94 0.00 1.78 1.83 0.84 0.65 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 16 L 7.84 3.91 0.00 1.88 1.75 0.96 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 17 R 8.15 3.80 0.00 1.92 2.07 0.00 3.12 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 18 L 7.95 3.72 0.00 1.85 1.77 0.81 0.69 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 19 L 7.72 3.36 0.00 1.12 0.25 0.49 -0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 20 N 8.04 4.42 0.00 3.00 2.95 0.00 0.00 6.39 7.19 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 21 E 8.29 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 2.09 2.31 0.00 22 T 7.49 4.49 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 1.30 0.00 0.00 23 S 7.97 3.69 0.00 4.09 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.09 4.44 0.80 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 25 Q 9.34 4.78 0.00 2.12 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.69 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 26 K 8.71 3.94 0.00 1.96 1.86 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.52 7.81 27 E 8.07 4.36 0.00 2.02 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 2.32 2.41 0.00 28 D 7.88 4.78 0.00 2.89 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 29 S 8.94 4.72 0.00 3.81 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 30 L 8.65 5.21 0.00 1.79 1.55 1.04 0.81 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 31 V 9.27 5.08 2.20 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 1.20 0.00 0.00 1.02 0.00 0.00 32 I 9.06 5.34 1.93 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 1.35 0.76 0.95 0.00 0.00 33 V 8.73 5.11 2.36 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 0.79 0.00 0.00 1.06 0.00 0.00 34 V 8.89 4.91 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 0.77 0.00 0.00 1.04 0.00 0.00 35 P 0.00 4.88 0.00 2.09 2.06 0.00 3.76 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 36 S 8.28 4.90 0.00 3.96 3.80 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.14 1.08 0.00 0.00 54 S 8.12 4.10 0.00 4.02 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 55 R 7.69 3.86 0.00 1.77 2.04 0.00 3.20 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 56 L 7.28 4.16 0.00 0.95 0.43 0.73 0.89 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 57 N 7.49 4.11 0.00 2.75 2.86 0.00 0.00 6.89 7.22 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 58 Y 7.67 4.84 0.00 3.08 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 59 P 0.00 4.56 0.00 2.22 2.38 0.00 3.26 0.00 0.00 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.86 0.00 60 P 0.00 4.41 0.00 2.21 2.12 0.00 3.80 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 61 P 0.00 4.76 0.00 2.11 2.10 0.00 3.76 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 62 R 8.84 4.36 0.00 1.88 1.79 0.00 3.24 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 63 I 8.02 4.87 1.77 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 1.33 0.53 0.94 0.00 0.00 64 Y 9.12 4.87 0.00 3.02 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 65 E 8.98 5.32 0.00 1.99 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 2.23 2.32 0.00 66 I 8.90 4.81 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.72 0.98 0.00 0.00 67 E 8.72 4.50 0.00 1.88 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 2.31 2.29 0.00 68 I 8.28 4.53 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.46 0.90 0.00 0.00 69 T 8.04 4.53 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 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0.00 0.00 3.19 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.71 0.00 115 F 8.70 5.37 0.00 3.17 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 0.00 116 T 8.93 4.79 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 0.89 0.00 0.00 117 V 8.31 4.73 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 0.85 0.00 0.00 0.75 0.00 0.00 118 Y 8.94 5.17 0.00 2.98 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 0.00 119 V 8.97 4.72 2.16 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 1.06 0.00 0.00 1.05 0.00 0.00 120 R 8.71 5.10 0.00 1.72 1.99 0.00 3.66 0.00 0.00 3.31 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.66 0.00 121 D 8.58 4.40 0.00 2.83 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 0.00 122 E 8.81 3.98 0.00 1.96 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 2.19 2.21 0.00 123 G 8.11 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 0.00 0.00 0.00 124 G 8.27 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 0.00 125 G 8.00 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 0.00 126 S 8.37 4.47 0.00 4.02 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 0.00 127 R 7.76 4.36 0.00 1.83 1.92 0.00 3.15 0.00 0.00 3.41 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.66 0.00 128 V 8.23 5.07 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 0.77 0.00 0.00 1.15 0.00 0.00 129 I 8.96 4.89 1.96 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.30 0.96 0.00 0.00 130 S 8.49 5.06 0.00 3.09 3.23 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 0.00 131 F 8.02 4.99 0.00 3.08 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 0.00 132 N 8.79 4.84 0.00 2.59 2.67 0.00 0.00 7.12 7.56 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 0.00 133 D 7.26 3.76 0.00 2.66 2.40 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 0.00 134 N 7.83 4.07 0.00 2.72 2.68 0.00 0.00 7.16 7.05 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 0.00 135 T 8.07 3.78 4.43 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 1.21 0.00 0.00 136 I 7.34 3.80 2.03 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 1.91 1.15 1.00 0.00 0.00 137 R 7.98 4.02 0.00 1.87 1.84 0.00 3.36 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 138 A 7.65 4.24 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 0.00 139 L 7.41 4.23 0.00 1.81 1.71 0.87 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 *141 R 7.42 3.90 0.00 1.77 2.17 0.00 2.61 0.00 0.00 2.83 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 142 D 8.29 4.67 0.00 2.64 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 Y 8.40 4.34 0.00 2.96 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 0.00 144 S 8.91 4.44 0.00 3.96 3.87 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 0.00 145 R 8.60 4.06 0.00 1.80 2.01 0.00 3.24 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 146 E 8.18 4.14 0.00 2.04 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 2.40 2.28 0.00 147 E 8.26 4.15 0.00 2.41 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 0.00 2.38 2.31 0.00 *149 K 8.19 4.20 0.00 2.03 1.90 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.85 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.43 1.60 7.81 150 L 8.06 3.92 0.00 1.81 1.85 0.93 0.53 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 0.00 151 L 8.09 3.97 0.00 1.62 1.60 0.55 0.76 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 0.00 152 N 8.12 4.40 0.00 2.84 2.98 0.00 0.00 6.83 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 0.00 153 V 7.89 3.59 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 0.98 0.00 0.00 0.94 0.00 0.00 154 L 7.91 4.00 0.00 1.95 1.74 0.94 0.84 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 0.00 155 Y 8.22 4.17 0.00 3.04 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 0.00 156 E 8.30 3.68 0.00 1.94 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 2.23 2.56 0.00 157 T 7.73 4.19 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 1.21 0.00 0.00 158 K 8.81 3.67 0.00 1.85 1.84 0.00 1.73 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.33 7.81 159 G 9.15 4.51 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 0.00 160 T 7.88 4.39 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 1.21 0.00 0.00 161 G 8.47 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 0.00 0.00 0.00 162 I 8.26 3.70 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.88 0.97 0.00 0.00 163 T 7.82 4.10 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 1.28 0.00 0.00 164 E 8.02 3.97 0.00 2.03 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 2.31 2.42 0.00 165 L 8.03 4.07 0.00 1.73 1.90 0.93 1.39 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 0.00 166 A 8.47 4.20 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 0.00 167 K 7.69 4.36 0.00 1.92 1.83 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.65 7.81 *169 L 7.79 4.22 0.00 1.72 1.76 0.93 1.10 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 0.00 170 D 7.68 4.38 0.00 2.81 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 0.00 171 K 8.11 4.74 0.00 1.72 1.64 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.49 7.81 172 S 8.29 4.43 0.00 4.05 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 0.00 173 E 8.67 3.93 0.00 2.03 2.04 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 2.40 2.37 0.00 174 K 8.02 3.94 0.00 1.82 1.81 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.54 7.81 175 T 7.85 3.83 4.39 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 1.21 0.00 0.00 176 L 8.11 3.93 0.00 1.75 1.80 0.93 1.11 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 0.00 177 I 8.23 3.67 2.06 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 1.53 0.57 0.92 0.00 0.00 178 N 8.12 4.33 0.00 2.90 2.86 0.00 0.00 6.69 6.93 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 0.00 179 K 8.02 3.95 0.00 1.89 1.93 0.00 1.56 0.00 0.00 1.66 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.53 7.81 180 I 8.50 3.70 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.78 0.97 0.00 0.00 181 A 8.15 3.99 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 0.00 0.00 0.00 0.00 0.00 182 E 8.10 3.87 0.00 2.07 2.16 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 2.24 2.32 0.00 183 L 8.11 4.19 0.00 1.79 1.79 0.95 0.68 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 0.00 184 K 8.40 4.18 0.00 2.01 2.02 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.63 7.81 185 K 7.79 4.12 0.00 1.94 1.93 0.00 1.78 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.47 7.81 186 F 8.08 4.44 0.00 3.13 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 0.00 187 G 7.98 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 0.00 188 I 7.65 4.70 1.91 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.86 1.04 0.00 0.00 189 L 7.70 5.18 0.00 1.76 1.66 1.01 0.59 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 0.00 190 T 9.01 4.95 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 1.22 0.00 0.00 191 Q 8.21 5.44 0.00 2.22 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.56 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 *197 K 8.29 4.16 0.00 1.89 1.78 0.00 1.70 0.00 0.00 1.75 0.00 0.00 2.80 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.41 1.45 7.81 198 V 8.64 4.76 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 0.93 0.00 0.00 0.94 0.00 0.00 199 E 9.15 4.99 0.00 2.02 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 2.21 2.28 0.00 200 L 8.72 4.54 0.00 1.72 1.61 1.04 1.01 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 0.00 201 N 8.16 4.92 0.00 2.97 2.98 0.00 0.00 7.04 8.81 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 0.00 202 E 8.55 3.97 0.00 2.00 2.04 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 2.41 2.32 0.00 203 L 8.01 4.02 0.00 1.74 1.85 0.90 1.01 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 0.00 204 G 8.76 3.71 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 0.00 0.00 0.00 205 L 8.07 3.99 0.00 1.88 1.73 1.02 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 206 N 8.11 4.35 0.00 2.89 2.83 0.00 0.00 6.57 7.21 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 0.00 207 V 7.67 3.53 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 0.49 0.00 0.00 1.05 0.00 0.00 208 I 7.62 3.45 1.70 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 1.39 0.49 0.05 0.00 0.00 209 K 7.70 3.75 0.00 1.92 1.87 0.00 1.59 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.43 7.81 210 L 7.96 3.99 0.00 1.87 1.71 0.97 0.48 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 0.00 211 N 8.28 4.51 0.00 2.72 2.81 0.00 0.00 6.96 7.03 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 0.00 212 K 7.99 3.93 0.00 1.83 1.83 0.00 1.61 0.00 0.00 1.72 0.00 0.00 2.77 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.53 7.81 213 S 7.45 4.24 0.00 3.95 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 0.00 214 V 7.54 3.72 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 0.87 0.00 0.00 1.00 0.00 0.00 215 I 7.64 4.01 2.00 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 1.38 0.80 0.91 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.