NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2956 8.3044 120.3259 53.8112 34.6711 173.6682 2 D 4.1192 7.9172 117.1579 52.7480 38.5231 171.9630 3 K 3.7842 8.8945 126.9607 59.6017 33.2886 177.3781 4 N 4.6107 8.1563 113.2434 54.3531 38.8153 175.9144 5 E 4.2470 8.2441 119.6098 57.9482 30.3390 177.7146 6 L 4.0221 7.6602 118.6852 57.3924 41.7340 179.5454 7 V 3.5542 7.8319 118.3527 66.1194 31.1882 177.7564 8 Q 4.2443 7.7438 115.2428 56.9357 28.5216 177.8872 9 K 3.8683 7.6864 121.5792 58.7836 32.5728 178.1951 10 A 3.9668 7.8507 121.0074 55.0558 18.2356 179.4078 11 K 3.8019 7.9009 116.8706 59.7504 32.2330 178.8480 12 L 3.8692 7.4089 119.6280 58.3786 41.6913 178.8640 13 A 3.9020 7.6796 118.9986 55.2456 18.6140 178.9187 14 E 3.7552 8.3956 118.0815 59.4852 29.5120 179.0974 15 Q 4.0428 8.2101 117.0181 58.1315 28.9146 177.4870 16 A 4.2614 7.8455 119.9861 51.4905 18.9981 178.3255 17 E 3.2801 7.8847 118.3603 56.7331 30.5767 174.8587 18 R 3.8587 7.0756 117.0212 56.7764 29.9051 176.5637 19 Y 4.1583 8.1038 123.0704 60.7466 38.2497 177.5110 20 D 4.5433 8.1455 119.3709 57.1647 40.8723 178.4934 21 D 4.3185 7.9048 119.2150 57.3058 41.0064 178.1208 22 M 3.9515 7.6163 118.5618 58.7370 32.1795 178.2142 23 A 3.5894 8.3651 120.6912 54.4088 18.3082 179.5977 24 A 3.9203 7.2904 119.0563 55.6028 18.6498 179.6698 25 C 4.1172 8.0817 115.2556 63.1828 28.2851 176.2138 26 M 4.1940 8.2658 120.0638 57.5928 31.4579 178.6180 27 K 4.0496 7.7144 120.4146 59.0689 32.1917 178.7283 28 S 4.1470 7.7485 112.5831 61.3676 62.1254 175.9021 29 V 3.6705 7.7021 120.8492 66.4376 31.0526 177.9195 30 T 3.8100 7.5832 111.2134 64.0128 67.2900 174.2498 31 E 2.8681 7.3657 118.5723 56.2817 31.5728 176.7623 32 Q 4.4444 7.7396 122.4687 57.4203 28.7676 177.5303 33 G 3.9859 8.6362 109.2199 43.3878 0.0000 173.4701 34 A 4.3274 8.4250 128.9727 51.1285 17.2812 177.1310 35 E 3.5263 8.1095 112.8571 57.6946 27.4239 172.7098 36 L 4.2592 8.0595 119.8605 52.9983 41.3978 176.8176 37 S 3.9484 8.5511 117.0816 58.4524 63.8099 174.5331 38 N 4.0413 8.8090 126.0436 56.5004 38.3328 176.9039 39 E 3.9292 8.1233 120.0089 59.3309 29.8457 178.1958 40 E 3.9569 8.2280 118.1139 59.7237 29.0415 179.0802 41 R 3.9285 8.0597 118.3689 59.7183 29.9747 177.9876 42 N 4.6062 8.0277 116.5721 56.7060 39.0860 176.6461 43 L 4.1033 8.3268 120.8380 57.9852 41.7088 179.3024 44 L 4.0906 8.3679 120.1419 58.5922 42.1218 179.3079 45 S 4.4449 8.1852 114.3082 61.5090 62.7365 177.2679 46 V 3.6745 8.5396 122.3004 64.6150 31.3500 178.4454 47 A 4.0110 8.1689 121.5079 55.2719 18.2914 179.2666 48 Y 4.0977 8.1612 115.3656 60.9792 37.8807 179.1654 49 K 4.1332 8.2158 119.6298 60.0048 32.6450 179.1070 50 N 4.1572 7.7022 116.4960 56.1661 38.2182 177.0326 51 V 3.7812 7.7690 119.9366 65.3134 31.6155 178.1689 52 V 3.7879 8.6007 118.9861 65.1938 31.3244 178.3515 53 G 3.5904 7.9993 106.9557 47.0678 0.0000 175.1247 54 A 3.9838 7.6375 122.2559 55.3117 18.4714 180.0527 55 R 3.8946 7.8919 115.9613 59.4067 29.8659 179.2771 56 R 4.0037 8.0520 118.0665 59.0439 29.8993 179.1362 57 S 4.1148 8.0810 112.9716 61.4134 62.4952 175.9917 58 S 4.0501 8.1138 117.9171 61.6544 62.5245 176.6051 59 W 4.0049 8.6958 130.9761 60.6608 30.3185 177.8880 60 R 4.0572 7.8862 117.8058 59.2382 29.5860 179.3000 61 V 3.5594 7.8589 118.7927 64.9939 31.6172 178.8156 62 V 3.5920 8.0059 120.3776 64.0045 31.1397 178.3523 63 S 3.9046 7.4879 116.4275 60.9226 62.7738 176.4943 64 S 4.0695 7.8028 117.1715 61.5745 62.4664 176.6188 65 I 3.8497 7.5542 122.0869 63.4099 37.1722 177.6004 66 E 4.0199 7.7930 120.2357 58.8024 29.1460 178.6257 67 Q 3.9616 7.7130 118.7850 58.1013 30.5928 177.0390 68 K 4.1668 7.3099 120.2639 54.8762 30.8870 175.6236 *73 E 4.3473 8.0571 123.2989 55.8954 31.8003 177.8108 74 K 3.9428 7.8818 118.7290 59.2165 32.4737 178.2367 75 K 3.9911 8.0826 118.8232 58.4240 32.1206 177.5391 76 Q 4.3091 8.1290 119.1168 57.9079 29.5029 177.1302 77 Q 3.9551 7.7872 120.7195 59.2886 29.1181 177.8227 78 M 4.0383 8.4819 118.1835 58.0396 31.2737 178.1926 79 A 4.1805 7.5525 120.6710 54.4193 18.8687 179.5497 80 R 4.5907 8.4374 119.2162 58.9198 30.1424 178.1235 81 E 4.4005 8.4031 120.8648 58.9455 29.6392 178.3415 82 Y 4.3252 7.8265 119.2526 60.9341 38.5706 177.6979 83 R 3.7510 8.0762 119.5815 59.3499 29.8414 178.0401 84 E 4.0705 8.3652 119.3274 58.8240 29.6153 178.6069 85 K 4.1698 7.7079 119.3397 59.2605 32.5443 178.5054 86 I 4.0531 8.0543 118.9251 62.9637 37.1831 177.3496 87 E 4.2563 8.0656 120.0972 58.5812 29.5808 178.4230 88 T 3.8991 7.5357 114.6654 66.7079 68.4055 176.5619 89 E 3.9939 7.8191 118.6475 59.2860 29.7369 179.1414 90 L 4.0635 7.5609 119.4123 58.2200 42.3046 178.7798 91 R 3.8759 8.3430 118.9597 59.7954 30.1003 178.1761 92 D 4.4309 8.5372 118.6454 57.0264 40.6149 178.9362 93 I 3.9238 7.7921 120.5726 64.4910 37.3033 177.9706 94 C 4.2112 8.1175 117.0270 62.8652 27.9572 175.9622 95 N 4.1554 8.2135 118.0027 56.1569 38.2952 176.6228 96 D 4.3407 7.8100 119.4394 57.5920 41.1773 179.0201 97 V 3.1399 7.6723 119.4305 64.2075 31.6618 177.9400 98 L 3.7230 7.6395 120.1850 57.5736 41.4705 179.5289 99 S 4.0169 7.9449 112.5108 61.4815 62.3888 175.8536 100 L 4.0987 7.3120 120.2331 58.8834 41.3468 178.8918 101 L 3.9414 8.1541 119.0686 57.0574 41.1357 178.9676 102 E 3.9460 8.2068 120.9832 59.7687 29.9792 179.0620 103 K 4.0861 8.4493 116.8309 58.2639 32.6434 177.7464 104 F 4.7123 7.9679 113.1434 58.8062 42.9448 175.3664 105 L 3.9163 7.6515 121.3650 56.1624 41.9954 178.8114 106 I 3.9175 7.9093 115.6565 63.6891 37.5739 175.2381 107 P 4.6341 0.0000 0.0000 62.7446 31.6208 175.8656 108 N 4.9659 8.4012 117.8099 51.6497 38.9083 173.2986 109 A 4.5135 7.5616 124.5426 50.5918 21.0766 174.9884 *112 A 4.3696 8.1531 113.6627 52.7585 21.2057 179.2046 113 E 3.9968 7.9764 112.3712 59.3584 30.1013 179.2240 114 S 3.7806 8.1314 114.9594 60.7145 62.4159 176.7534 115 K 4.0761 7.6086 122.2560 59.5553 31.7681 179.5927 116 V 3.7217 7.9687 119.1143 64.1605 31.2671 178.2502 117 F 4.0359 8.0732 121.2722 61.4561 39.3344 176.5117 118 Y 4.5918 8.0187 116.1841 61.4195 37.7348 178.4962 119 L 4.0995 8.3903 119.6448 57.0417 41.5809 179.7003 120 K 3.9888 7.8671 120.4167 59.7564 32.2864 178.4924 121 M 4.2288 7.7774 118.4097 58.3531 32.1234 178.1926 122 K 4.1286 8.2358 120.2245 59.4559 32.4455 179.1391 123 G 2.6623 7.4658 106.0849 47.5139 0.0000 175.0113 124 D 3.8790 7.9643 121.4972 57.4542 40.9086 178.4882 125 Y 3.6921 7.9601 116.7530 61.2779 37.9345 178.6210 126 Y 3.8629 7.8247 117.2270 60.8606 37.8828 178.4617 127 R 3.9484 7.6572 119.8074 59.5760 30.0054 178.2426 128 Y 5.0587 7.2311 117.9724 60.5228 37.6006 178.1631 129 L 3.9889 7.6460 118.7133 57.0733 42.0621 179.1131 130 A 4.1422 7.8260 121.1677 55.0142 18.5248 179.1927 131 E 3.8201 7.9734 117.1225 59.7021 29.5929 179.6335 132 V 3.3728 7.0506 115.1482 63.8153 31.7498 175.5927 133 A 4.3409 7.3645 121.5677 52.3848 20.5021 176.3301 134 A 4.6286 8.8093 120.7420 52.5020 19.9533 179.7036 135 G 4.2969 8.8571 116.7633 43.4486 0.0000 175.8327 136 D 4.3838 8.9113 124.1980 56.4384 41.1012 177.2253 137 D 4.3766 8.2140 119.4964 57.6095 40.7430 178.1304 138 K 3.8363 8.1635 120.1247 59.7918 32.0748 178.4593 139 K 4.0471 8.0445 117.7401 59.6572 31.9310 179.3473 140 G 3.8299 7.8966 104.4343 47.7354 0.0000 175.2655 141 I 4.1666 7.6957 121.5567 64.0925 37.1287 178.4620 142 V 3.7669 8.0566 120.1210 65.1071 30.8361 177.8971 143 D 4.3685 8.1749 118.6180 57.3595 40.9082 178.2230 144 Q 3.7125 7.7302 117.3769 58.5437 28.8235 178.4195 145 S 3.7594 7.6313 114.1432 60.8419 62.5046 175.7749 146 Q 3.2899 7.4206 121.9524 58.8872 28.7316 177.7614 147 Q 4.1277 7.7584 113.5734 57.0484 28.5538 176.2938 148 A 4.3492 7.0948 122.1644 54.1774 20.6913 178.4924 149 Y 3.8173 6.9422 114.9245 61.2101 37.8753 178.8357 150 Q 4.6967 7.9871 119.9326 58.4895 28.8673 177.5566 151 E 4.0662 7.8002 119.0887 59.0000 30.3570 177.6440 152 A 4.1770 8.1717 120.9851 54.8542 18.4299 179.1512 153 F 4.6247 8.7198 121.0468 61.2595 39.2928 177.3823 154 E 3.9764 8.0909 115.8614 58.5094 29.2236 177.8434 155 I 4.3603 7.3105 118.5099 61.7808 38.0632 177.4298 156 S 4.6720 7.6400 115.9400 59.7347 64.7514 174.8325 157 K 4.5996 7.4950 123.6893 55.6015 30.4475 175.2587 158 K 4.5563 8.0932 124.2737 55.9737 37.8868 175.4612 159 E 4.7209 9.1174 113.6968 55.9519 31.3002 174.6974 160 M 4.3619 7.1373 118.8715 54.0609 34.6172 175.0192 *166 I 4.1425 8.3704 119.3623 62.3088 40.2046 178.2389 167 R 3.9454 7.8135 119.1199 59.4195 30.2993 178.0418 168 L 4.1637 7.9853 119.7598 58.1358 42.3315 179.0491 169 G 3.6680 8.1182 105.2822 47.4525 0.0000 175.2786 170 L 3.9118 7.9303 122.2627 57.9624 42.1329 178.5359 171 A 3.9259 7.7726 120.3814 55.5720 18.1571 178.8570 172 L 3.9824 7.7987 117.7020 58.9502 41.8479 178.6321 173 N 4.2868 7.9161 115.1389 56.4383 38.8993 176.5905 174 F 3.4548 8.3366 121.7256 61.3091 39.2731 177.2555 175 S 4.0583 8.5556 112.9982 61.3908 62.1367 176.1259 176 V 3.7649 7.8840 118.8386 63.0819 31.2320 177.2045 177 F 4.5233 7.8135 122.0780 60.5106 40.1122 174.8583 178 Y 4.0336 7.6879 117.1019 56.9475 36.1899 172.2234 179 Y 4.2702 8.2456 128.7069 57.4419 37.2063 170.1267 *188 A 3.9093 7.5124 122.5559 51.7354 19.6351 176.1473 189 C 4.4674 8.4642 107.6678 62.0394 29.3246 175.8952 190 S 4.0605 8.0356 116.1420 61.6379 62.4191 176.2075 191 L 3.9463 7.8580 124.0350 57.2608 41.7909 178.7542 192 A 4.1407 7.9932 120.5702 54.7964 18.2807 179.4668 193 K 4.3849 8.3440 118.2278 60.1380 32.3862 178.7897 194 T 3.8907 7.9411 115.8503 66.8735 68.5015 176.0045 195 A 4.0614 8.0715 122.0802 55.4040 18.3158 179.4384 196 F 4.5381 8.2570 116.9410 60.6613 39.6038 176.3187 197 D 4.1551 8.5543 118.1749 56.7720 40.9960 177.5072 198 E 4.2274 8.0819 116.8975 57.9198 29.6137 178.1607 199 A 4.4549 7.5392 119.8394 54.4015 18.8532 179.5833 200 I 3.7567 7.3417 117.0448 64.2395 37.4011 177.2625 201 A 4.4839 7.9154 120.8158 52.2648 18.0382 177.0735 202 E 4.5372 7.5529 117.2032 57.0910 31.0475 176.4920 203 L 4.1697 7.3665 117.7418 54.8960 42.7198 176.4568 *216 L 4.3493 8.3849 122.6628 55.4517 43.5639 179.0033 217 I 3.6445 7.7975 118.8954 64.8191 36.6456 177.8013 218 M 4.1151 7.9764 118.7293 58.5846 31.9007 178.5459 219 Q 3.6848 7.9937 119.1675 58.7217 29.2158 177.5822 220 L 4.0494 7.7303 120.6386 57.8517 41.5965 179.2259 221 L 4.0892 6.9968 116.6739 57.0726 41.0704 178.6493 222 R 3.1051 6.8361 120.2785 59.1335 29.9838 177.5669 223 D 4.1594 8.5597 118.9846 57.4699 41.2762 177.8685 224 N 3.8472 7.8766 115.8686 54.9677 38.1070 176.7088 225 L 4.1333 7.2313 119.6687 56.8664 42.0243 178.6983 226 T 3.9594 7.4225 115.4948 66.4060 68.3319 176.3670 227 L 4.0549 7.4277 120.0880 56.4959 41.9693 176.8981 228 W 4.4853 7.3201 119.5650 56.5461 28.1585 175.1056 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 8.30 4.30 0.00 2.01 2.35 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.48 0.00 2 D 7.92 4.12 0.00 2.94 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 3 K 8.89 3.78 0.00 1.81 1.80 0.00 1.76 0.00 0.00 1.81 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.47 7.81 4 N 8.16 4.61 0.00 2.87 2.83 0.00 0.00 6.62 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 5 E 8.24 4.25 0.00 2.33 2.05 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 2.22 2.32 0.00 6 L 7.66 4.02 0.00 1.91 1.68 0.90 0.95 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 7 V 7.83 3.55 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 1.04 0.00 0.00 1.10 0.00 0.00 8 Q 7.74 4.24 0.00 2.39 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.50 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 9 K 7.69 3.87 0.00 2.05 1.90 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.38 1.57 7.81 10 A 7.85 3.97 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 11 K 7.90 3.80 0.00 1.84 1.89 0.00 2.07 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.60 7.81 12 L 7.41 3.87 0.00 1.72 1.92 0.90 1.00 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 13 A 7.68 3.90 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 E 8.40 3.76 0.00 2.09 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 2.41 2.62 0.00 15 Q 8.21 4.04 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.63 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 16 A 7.85 4.26 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 17 E 7.88 3.28 0.00 2.06 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 2.10 2.41 0.00 18 R 7.08 3.86 0.00 1.72 1.81 0.00 3.10 0.00 0.00 3.10 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.56 0.00 19 Y 8.10 4.16 0.00 3.05 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.15 4.54 0.00 2.67 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 21 D 7.90 4.32 0.00 2.90 2.65 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 0.00 0.00 0.00 0.00 22 M 7.62 3.95 0.00 2.22 2.04 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.60 0.00 23 A 8.37 3.59 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 7.29 3.92 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 C 8.08 4.12 0.00 2.97 3.17 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 26 M 8.27 4.19 0.00 2.10 2.20 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.81 0.00 27 K 7.71 4.05 0.00 2.10 1.98 0.00 1.95 0.00 0.00 1.61 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.46 7.81 28 S 7.75 4.15 0.00 4.07 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 29 V 7.70 3.67 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 0.91 0.00 0.00 1.00 0.00 0.00 30 T 7.58 3.81 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 0.96 0.00 0.00 31 E 7.37 2.87 0.00 1.65 1.17 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 2.39 2.15 0.00 32 Q 7.74 4.44 0.00 2.25 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.85 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 33 G 8.64 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 34 A 8.43 4.33 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 35 E 8.11 3.53 0.00 2.30 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.32 0.00 36 L 8.06 4.26 0.00 1.73 1.77 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 37 S 8.55 3.95 0.00 3.88 3.76 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 38 N 8.81 4.04 0.00 2.83 2.85 0.00 0.00 6.78 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 39 E 8.12 3.93 0.00 2.04 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 0.00 2.40 2.42 0.00 40 E 8.23 3.96 0.00 2.15 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.50 0.00 41 R 8.06 3.93 0.00 2.02 2.01 0.00 2.67 0.00 0.00 2.88 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.06 0.00 42 N 8.03 4.61 0.00 2.83 2.98 0.00 0.00 7.22 6.63 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 43 L 8.33 4.10 0.00 2.04 1.82 0.98 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 44 L 8.37 4.09 0.00 1.99 2.10 1.05 1.35 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 45 S 8.19 4.44 0.00 4.32 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 46 V 8.54 3.67 2.30 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 0.91 0.00 0.00 0.96 0.00 0.00 47 A 8.17 4.01 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 48 Y 8.16 4.10 0.00 3.32 3.15 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 0.00 0.00 0.00 49 K 8.22 4.13 0.00 1.99 2.30 0.00 1.30 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.69 1.42 7.81 50 N 7.70 4.16 0.00 2.48 2.34 0.00 0.00 7.00 8.72 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 51 V 7.77 3.78 2.33 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 1.15 0.00 0.00 0.94 0.00 0.00 52 V 8.60 3.79 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 0.83 0.00 0.00 0.90 0.00 0.00 53 G 8.00 3.59 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 0.00 0.00 0.00 54 A 7.64 3.98 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 55 R 7.89 3.89 0.00 2.05 1.99 0.00 3.21 0.00 0.00 3.53 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.80 0.00 56 R 8.05 4.00 0.00 1.79 1.79 0.00 2.21 0.00 0.00 2.35 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.40 0.00 57 S 8.08 4.11 0.00 3.94 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 58 S 8.11 4.05 0.00 4.02 3.79 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 59 W 8.70 4.00 0.00 3.46 3.18 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 60 R 7.89 4.06 0.00 2.19 1.98 0.00 3.21 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.05 0.00 61 V 7.86 3.56 2.05 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 0.88 0.00 0.00 0.90 0.00 0.00 62 V 8.01 3.59 1.83 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 0.48 0.00 0.00 0.83 0.00 0.00 63 S 7.49 3.90 0.00 3.57 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 S 7.80 4.07 0.00 4.02 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 0.00 65 I 7.55 3.85 1.95 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.57 0.90 0.00 0.00 66 E 7.79 4.02 0.00 2.07 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.26 0.00 67 Q 7.71 3.96 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.05 0.00 0.00 0.00 0.00 0.00 2.34 2.51 0.00 68 K 7.31 4.17 0.00 1.93 1.74 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.34 7.81 *73 E 8.06 4.35 0.00 1.98 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 2.27 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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 0.00 0.00 0.00 83 R 8.08 3.75 0.00 1.94 1.92 0.00 3.33 0.00 0.00 2.25 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.14 0.00 84 E 8.37 4.07 0.00 2.27 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 2.36 2.37 0.00 85 K 7.71 4.17 0.00 2.13 2.27 0.00 1.79 0.00 0.00 1.97 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.56 1.57 7.81 86 I 8.05 4.05 1.88 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.65 0.97 0.00 0.00 87 E 8.07 4.26 0.00 2.69 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 0.00 2.31 2.31 0.00 88 T 7.54 3.90 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 1.25 0.00 0.00 89 E 7.82 3.99 0.00 1.98 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 0.00 2.40 2.58 0.00 90 L 7.56 4.06 0.00 1.94 1.75 0.81 0.46 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 2.18 2.16 0.00 3.76 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.05 0.00 108 N 8.40 4.97 0.00 2.82 2.76 0.00 0.00 6.80 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.56 4.51 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 *112 A 8.15 4.37 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 0.00 113 E 7.98 4.00 0.00 2.22 2.22 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 2.31 2.29 0.00 114 S 8.13 3.78 0.00 3.77 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 0.00 115 K 7.61 4.08 0.00 1.97 1.95 0.00 1.68 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.52 1.64 7.81 116 V 7.97 3.72 2.14 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 1.00 0.00 0.00 1.01 0.00 0.00 117 F 8.07 4.04 0.00 2.96 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 Y 8.02 4.59 0.00 3.19 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 L 8.39 4.10 0.00 1.91 1.88 1.09 0.93 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 0.00 120 K 7.87 3.99 0.00 2.03 1.95 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.73 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.54 7.81 121 M 7.78 4.23 0.00 2.35 2.26 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 2.81 0.00 122 K 8.24 4.13 0.00 1.90 1.89 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.55 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.38 1.68 7.81 123 G 7.47 2.66 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 0.00 124 D 7.96 3.88 0.00 2.55 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 0.00 0.00 0.00 0.00 125 Y 7.96 3.69 0.00 2.96 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 Y 7.82 3.86 0.00 3.03 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 R 7.66 3.95 0.00 1.91 1.82 0.00 3.45 0.00 0.00 3.42 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.76 0.00 128 Y 7.23 5.06 0.00 3.12 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 0.00 129 L 7.65 3.99 0.00 1.74 1.71 0.87 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 130 A 7.83 4.14 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 0.00 131 E 7.97 3.82 0.00 1.91 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 132 V 7.05 3.37 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 0.60 0.00 0.00 -0.32 0.00 0.00 133 A 7.36 4.34 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 0.00 134 A 8.81 4.63 1.15 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 0.00 0.00 0.00 0.00 0.00 135 G 8.86 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 0.00 0.00 0.00 0.00 136 D 8.91 4.38 0.00 2.74 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 D 8.21 4.38 0.00 2.82 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 0.00 138 K 8.16 3.84 0.00 2.05 1.92 0.00 1.61 0.00 0.00 1.73 0.00 0.00 3.08 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.47 1.58 7.81 139 K 8.04 4.05 0.00 2.02 1.86 0.00 1.76 0.00 0.00 1.85 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.56 1.53 7.81 140 G 7.90 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 0.00 141 I 7.70 4.17 2.06 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 1.66 0.70 1.04 0.00 0.00 142 V 8.06 3.77 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.00 0.00 0.00 143 D 8.17 4.37 0.00 2.87 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 0.00 144 Q 7.73 3.71 0.00 2.15 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 145 S 7.63 3.76 0.00 3.86 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 0.00 146 Q 7.42 3.29 0.00 2.22 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.73 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 147 Q 7.76 4.13 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.50 0.00 0.00 0.00 0.00 0.00 2.44 2.19 0.00 148 A 7.09 4.35 1.07 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 0.00 149 Y 6.94 3.82 0.00 1.82 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 0.00 150 Q 7.99 4.70 0.00 2.33 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.79 0.00 0.00 0.00 0.00 0.00 2.59 2.91 0.00 151 E 7.80 4.07 0.00 2.17 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 2.27 2.36 0.00 152 A 8.17 4.18 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 0.00 153 F 8.72 4.62 0.00 3.45 3.44 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 0.00 154 E 8.09 3.98 0.00 2.11 1.98 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 2.28 2.25 0.00 155 I 7.31 4.36 2.00 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 1.53 0.70 0.93 0.00 0.00 156 S 7.64 4.67 0.00 4.08 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 0.00 157 K 7.50 4.60 0.00 1.60 1.67 0.00 1.74 0.00 0.00 1.56 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.38 7.81 158 K 8.09 4.56 0.00 1.70 1.47 0.00 1.81 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.42 7.81 159 E 9.12 4.72 0.00 1.96 1.90 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 2.21 2.31 0.00 160 M 7.14 4.36 0.00 2.15 1.98 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.49 0.00 *166 I 8.37 4.14 1.99 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.47 0.98 0.00 0.00 167 R 7.81 3.95 0.00 1.98 1.95 0.00 3.28 0.00 0.00 3.32 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.77 0.00 168 L 7.99 4.16 0.00 1.86 1.70 1.02 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 169 G 8.12 3.67 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 0.00 0.00 0.00 170 L 7.93 3.91 0.00 1.93 2.05 0.89 1.39 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 0.00 171 A 7.77 3.93 1.48 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 0.00 0.00 172 L 7.80 3.98 0.00 1.84 1.95 0.98 0.54 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 0.00 173 N 7.92 4.29 0.00 2.77 2.73 0.00 0.00 7.10 6.73 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 0.00 174 F 8.34 3.45 0.00 2.45 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.56 4.06 0.00 4.01 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 0.00 176 V 7.88 3.76 2.56 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 0.98 0.00 0.00 1.37 0.00 0.00 177 F 7.81 4.52 0.00 3.07 3.15 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 0.00 0.00 0.00 178 Y 7.69 4.03 0.00 2.96 2.66 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 0.00 179 Y 8.25 4.27 0.00 2.59 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 *188 A 7.51 3.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.46 4.47 0.00 3.36 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 0.00 190 S 8.04 4.06 0.00 4.01 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 L 7.86 3.95 0.00 1.63 1.88 0.78 0.65 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 0.00 192 A 7.99 4.14 1.62 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 0.00 193 K 8.34 4.38 0.00 2.03 2.07 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.41 7.81 194 T 7.94 3.89 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 195 A 8.07 4.06 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 0.00 196 F 8.26 4.54 0.00 2.93 3.53 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 0.00 0.00 0.00 0.00 197 D 8.55 4.16 0.00 2.54 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 0.00 198 E 8.08 4.23 0.00 2.03 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 2.34 2.53 0.00 199 A 7.54 4.45 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 I 7.34 3.76 1.90 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.01 0.88 0.00 0.00 201 A 7.92 4.48 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 0.00 202 E 7.55 4.54 0.00 1.97 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 0.00 2.24 2.26 0.00 203 L 7.37 4.17 0.00 1.78 1.59 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 *216 L 8.38 4.35 0.00 1.74 1.70 0.91 0.99 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 0.00 217 I 7.80 3.64 1.89 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 1.65 0.69 0.93 0.00 0.00 218 M 7.98 4.12 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.67 0.00 219 Q 7.99 3.68 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 220 L 7.73 4.05 0.00 2.00 1.68 0.95 0.51 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 0.00 221 L 7.00 4.09 0.00 1.94 1.78 1.03 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 222 R 6.84 3.11 0.00 0.94 1.72 0.00 3.21 0.00 0.00 2.95 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.65 0.00 223 D 8.56 4.16 0.00 2.63 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 0.00 224 N 7.88 3.85 0.00 2.47 1.54 0.00 0.00 7.07 6.25 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 0.00 225 L 7.23 4.13 0.00 1.78 1.70 1.19 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 226 T 7.42 3.96 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 1.15 0.00 0.00 227 L 7.43 4.05 0.00 1.09 1.53 0.64 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 228 W 7.32 4.49 0.00 3.27 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 * Residues marked with a * may have inaccurate shift predictions.