NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5037 8.3044 120.3252 55.1599 33.9913 176.0102 2 S 4.4674 7.6985 110.6616 55.7489 63.1990 171.7947 3 R 4.1917 8.2699 115.4118 55.5825 31.0165 175.2985 4 G 4.2116 9.0259 107.4982 45.2572 0.0000 172.8413 5 A 4.8482 8.6958 121.5712 50.2101 21.7978 176.3332 6 L 4.8022 8.9520 123.0027 53.6401 43.8027 175.0540 7 I 4.7330 8.7621 128.5596 59.3956 39.7034 175.0093 8 V 4.8617 8.3789 127.1936 61.1072 34.3238 174.1007 9 F 5.1313 9.4874 126.1519 55.8693 41.4878 174.6040 10 E 5.2814 10.4769 122.4277 53.8468 33.8651 175.4090 11 G 3.8140 8.4282 112.1078 44.8359 0.0000 172.0043 12 L 4.5991 7.6171 120.4827 53.8318 42.5633 176.7981 13 D 4.5310 8.5254 119.9603 55.8743 40.9889 176.9846 14 K 3.9994 8.8243 121.3063 57.5623 28.9889 177.0855 15 S 4.2798 8.2138 112.7455 58.5720 63.7963 174.9125 16 G 3.9292 8.2387 109.9595 46.1258 0.0000 175.4270 17 K 3.9843 7.7071 121.4519 60.1463 32.4295 179.2397 18 T 3.9637 7.8893 116.4688 66.7430 68.5108 176.5181 19 T 3.8258 7.7532 117.0857 66.6853 68.6681 176.6378 20 Q 4.0111 7.9140 119.7267 58.6638 28.5544 178.4819 21 C 3.6669 7.5303 118.2283 62.4836 28.0441 175.7408 22 M 3.7878 7.5201 119.8935 58.4870 31.5624 178.0962 23 N 4.2002 7.7732 115.9343 56.7744 38.5609 177.2399 24 I 3.6986 7.3285 119.2608 64.9365 37.3423 178.0973 25 M 4.1824 8.0290 118.4723 58.5051 31.8162 178.4090 26 E 4.1522 8.2093 118.0347 58.3496 29.8218 178.0077 27 S 4.8155 7.9547 114.4139 57.0534 64.8659 174.0536 28 I 4.4877 7.1759 119.8659 58.9720 41.3793 172.4819 29 P 4.0602 0.0000 0.0000 63.0589 30.9448 176.7170 30 A 3.8101 8.6440 128.4236 56.6028 18.6112 179.3200 *31 N 4.8429 8.0061 109.2673 52.8944 37.5139 177.6483 32 T 4.7948 8.0489 106.2669 61.9683 70.9307 173.0244 33 I 5.1343 7.7278 120.7484 59.6420 41.3002 174.1677 34 K 4.8366 9.1055 127.4787 54.8056 36.0642 174.1984 35 Y 5.2544 8.5459 122.6593 56.1799 41.0449 174.6876 36 L 4.2338 7.6428 126.4220 53.3800 45.8869 174.0533 37 N 5.0880 7.9630 123.7558 51.5625 42.3172 172.6346 38 F 5.2154 8.5185 123.3467 54.6588 42.1250 173.5884 39 P 4.7101 0.0000 0.0000 62.9799 31.9012 176.2971 40 Q 4.1535 9.5707 122.8615 54.1440 27.6951 176.0848 41 R 4.2731 8.3427 121.0363 57.3528 29.7538 177.6387 42 S 4.5916 7.7891 113.3517 58.6526 63.1645 173.9176 43 T 4.7280 7.3342 111.4313 59.1277 72.8190 175.0151 44 V 3.5711 8.1377 119.5339 66.4307 31.4936 177.8605 45 T 3.9470 7.9884 109.2457 64.6680 68.5916 176.3753 46 G 3.6356 8.1603 108.5917 47.7151 0.0000 175.8308 47 K 4.1098 8.3614 120.8862 59.1387 32.0419 179.5103 48 M 4.3191 8.0679 119.3053 58.4696 31.8282 178.8319 49 I 3.5833 7.9761 120.3677 64.2398 37.1690 177.9927 50 D 4.3547 8.1934 119.0040 57.4261 40.7959 178.0832 51 D 4.4178 8.0495 118.8383 57.2663 40.6046 177.7659 52 Y 4.9555 7.9812 121.6539 60.1682 38.7227 177.6867 53 L 3.7467 8.2692 120.2992 57.0374 41.6308 178.1513 54 T 4.4466 7.7522 108.8976 61.6561 69.5859 177.7252 55 R 3.9224 7.6320 121.8764 57.9157 29.8881 178.6441 56 K 4.4291 8.0002 114.8588 55.5200 32.2214 176.7170 57 K 4.4718 7.0555 124.6566 57.2447 35.6445 173.3920 58 T 5.0974 7.9091 114.5696 60.3703 71.4247 172.7070 59 Y 4.8324 8.1117 118.4047 55.5740 42.2348 175.3361 60 N 4.6144 8.6666 119.0931 53.0721 40.6593 175.9569 61 D 4.4654 8.7675 122.8234 58.2532 40.9724 179.1245 62 H 4.1942 8.2222 115.7353 59.1095 28.6989 177.7743 63 I 3.6645 7.7084 120.9173 64.3932 36.9193 178.7790 64 V 3.2522 7.6789 113.2553 64.1920 31.4106 178.1145 65 N 4.4486 8.3308 116.6181 56.5723 38.4951 177.4093 66 L 3.9972 7.9128 120.6814 58.3526 40.5221 179.2453 67 L 3.8530 7.9085 120.2621 57.6869 41.6562 179.2758 68 F 4.2377 8.2620 117.8411 60.8452 38.8778 177.3741 69 C 4.1424 8.1936 117.6639 62.4173 31.3813 175.4647 70 A 4.2113 8.6330 122.9263 54.9913 17.7231 178.7849 71 N 4.6291 8.2625 116.5575 56.3901 39.2139 176.9470 72 R 3.5774 7.7814 118.4787 59.0760 30.1118 179.0295 73 W 4.2919 8.1586 118.5710 59.9746 28.8412 178.3352 74 E 4.1557 8.8503 118.3679 58.4855 28.8134 178.2185 75 F 4.7850 8.6639 116.1475 57.1031 39.6808 177.1156 76 A 4.1622 8.1043 123.2845 55.4277 18.0726 180.4550 77 S 4.1783 8.1193 113.0910 61.4680 63.1161 176.0878 78 F 4.1883 8.3601 122.8757 61.6139 39.0881 176.7130 79 I 3.5698 8.4960 119.4840 64.6622 37.0052 177.9883 80 Q 3.9363 7.9557 119.4209 59.3095 28.6291 178.3924 81 E 3.8886 8.3162 118.5502 59.5400 29.8595 178.9641 82 Q 3.9874 7.8630 117.9772 58.9770 28.6732 178.9829 83 L 4.1111 7.7160 119.7793 58.0315 41.5005 179.4830 84 E 4.0518 7.9944 116.5207 58.4080 29.4292 178.2292 85 Q 4.4017 7.8045 116.6254 55.4920 29.2263 176.4711 86 G 3.9525 8.0560 108.9112 44.8161 0.0000 173.6191 87 I 4.2776 7.3674 121.3145 61.1767 38.6911 174.9624 88 T 4.7420 8.6080 123.7895 62.6152 70.3903 173.6144 89 L 4.9799 8.8892 126.2636 53.1397 44.5250 175.5616 90 I 4.8098 8.5377 125.2659 60.0386 38.7614 174.6443 91 V 4.4879 9.1994 129.2890 61.1294 33.5456 174.4381 92 D 4.9217 8.9147 129.3556 54.0569 41.2204 173.6484 93 R 4.9958 9.8015 127.6196 56.4720 31.4168 176.2552 94 Y 4.5241 9.0421 122.0054 55.7875 41.0825 175.8414 95 A 3.7457 7.2870 116.4339 54.9976 18.1601 179.7844 96 F 4.4760 7.1438 116.0448 60.8658 39.0790 177.6801 97 S 4.4669 8.6777 114.4868 61.6947 62.8252 176.5991 98 G 3.6412 7.7501 107.8713 48.0510 0.0000 175.8228 99 V 3.6164 8.1221 120.7012 65.3344 31.5493 177.8986 100 A 3.7287 8.2664 120.9063 55.5511 18.0736 179.3624 101 Y 3.6164 8.4862 115.2637 60.7126 37.8609 178.5651 102 A 4.1274 8.0305 121.4428 55.2697 18.5667 179.6142 103 A 4.6025 8.3446 120.4143 54.7548 18.1641 179.7049 104 A 3.7720 7.7864 118.6539 54.8696 18.4365 179.2023 105 K 4.5000 7.5867 114.4782 56.6334 32.5216 177.0784 106 G 3.7926 7.8323 107.0004 45.4456 0.0000 174.4920 107 A 4.2382 8.1364 123.8067 51.5439 19.3120 176.3659 108 S 4.5557 8.3613 113.9057 57.8379 64.0229 174.3190 109 M 3.9257 8.6415 128.8285 59.1417 31.8364 178.4762 110 T 3.7356 7.6358 107.9553 64.6212 69.2764 175.8560 111 L 4.0112 7.6168 122.8349 57.8455 42.1131 179.0487 112 S 4.3957 8.2787 115.2122 61.7400 62.7984 176.7829 113 K 3.7832 7.7993 120.9534 59.3723 31.4518 179.4015 114 S 4.2513 7.7704 114.1045 61.0329 62.6481 175.6711 115 Y 4.4119 7.7401 119.3140 59.6820 38.1951 176.3360 116 E 4.6712 8.2958 118.4670 55.0600 30.1207 175.5395 117 S 4.6502 7.3106 113.8128 60.1166 62.5929 173.6765 118 G 4.3876 9.0818 116.7769 45.5662 0.0000 173.9502 119 L 3.6527 7.5376 119.6837 53.5881 42.8342 175.0290 120 P 4.6141 0.0000 0.0000 63.1852 31.9047 175.8072 121 K 4.2047 8.7212 126.7532 55.0202 32.6312 175.1703 122 P 4.4150 0.0000 0.0000 63.0294 31.9656 175.5890 123 D 4.7013 8.5823 119.9178 55.5306 42.2943 177.0318 124 L 4.4351 7.3762 119.0986 53.3555 46.1292 175.1444 125 V 4.2466 7.9233 124.4233 60.8656 33.8791 174.0207 126 I 4.2737 8.1637 130.2430 60.5376 38.2286 174.8336 127 F 5.1212 9.2918 131.0531 56.6760 41.1337 174.6353 128 L 4.6254 7.7041 127.3892 53.1187 41.4791 176.5841 129 E 4.2548 8.3008 123.2579 56.3008 30.4552 176.9725 130 S 4.8188 8.4397 116.5004 56.4560 65.4627 174.3972 131 G 3.8837 10.1359 115.4513 44.6775 0.0000 173.7402 132 S 4.1952 8.6568 114.7375 60.4689 62.4348 176.1680 *133 K 4.3019 7.9176 119.9583 56.6658 32.3923 183.0204 134 E 4.4312 7.9273 116.2267 58.6949 30.3556 178.5887 135 I 3.7912 8.1026 119.5259 64.2428 37.1945 176.4704 136 N 4.8340 7.6623 114.6001 53.3444 38.1930 175.9565 137 R 4.2059 7.5556 119.4315 57.7378 30.4539 177.1314 138 N 4.7647 7.8599 114.9482 52.8396 36.7347 174.8175 139 V 3.6956 7.9943 116.3992 63.2787 32.1293 177.3687 140 G 4.3715 8.4054 108.2489 44.9381 0.0000 174.6395 141 E 4.0400 8.4480 119.9137 58.5037 29.9699 177.0777 142 E 4.5773 7.9720 117.9914 54.1732 31.2234 176.7693 143 I 3.5522 7.5744 120.8957 63.5939 37.9462 176.3609 144 Y 4.8820 7.8425 115.4966 58.1152 38.5199 176.5741 145 E 4.5486 7.9554 122.6776 55.0141 28.0456 173.9328 146 D 4.9694 7.8666 120.0144 52.8164 44.4181 175.7376 147 V 4.1789 8.2946 117.3036 65.2219 32.3240 177.6746 148 T 4.0671 7.9267 108.4442 64.0822 68.9265 176.3807 149 F 4.1458 8.2709 124.3740 61.2992 39.4601 177.1828 150 Q 3.9875 8.2007 117.2014 58.6216 28.5878 178.1055 151 Q 4.0197 7.7204 120.5957 58.7614 28.6634 178.0780 152 K 3.9320 7.7735 119.6260 59.0106 31.9917 179.4899 153 V 3.1790 7.2467 118.8252 65.3826 31.2862 177.8708 154 L 4.1363 7.6985 120.3002 58.1787 41.9299 178.9210 155 Q 3.9403 7.9512 117.9912 58.9927 28.7496 178.7565 156 E 3.8595 7.7415 118.9815 59.5068 29.4913 178.8366 157 Y 3.9756 7.7978 116.7801 60.9766 37.8975 179.0191 158 K 3.6479 7.8256 119.2044 59.2500 31.9334 179.2709 159 K 3.7856 7.6033 117.3800 59.9188 32.3114 178.9028 160 M 4.2356 7.7381 118.1227 58.5631 31.7105 178.9582 161 I 2.7819 6.9061 118.5053 63.5959 37.1185 177.3446 162 E 4.2871 7.6635 116.8997 56.5025 29.3963 177.2209 163 E 4.0744 7.9450 120.3586 58.3615 29.9294 178.1590 164 G 4.0654 8.4457 104.4726 45.1760 0.0000 173.4964 165 D 4.6296 8.0785 117.9678 54.3755 40.2182 176.2577 166 I 4.4555 7.6817 120.6294 59.5772 39.5580 175.3366 167 H 4.6196 8.5418 124.7583 56.0473 29.0364 174.0563 168 W 4.9985 8.6387 123.8850 55.6000 31.2659 176.0588 169 Q 4.4769 8.9214 120.5483 54.8926 32.2155 173.9678 170 I 4.9272 8.5966 125.8148 59.9579 38.4945 175.4912 171 I 4.2733 8.5520 121.1525 58.8904 39.3512 174.7923 172 S 4.3960 9.0992 122.2248 58.8610 62.7340 175.5758 173 S 4.3878 8.9296 119.9303 60.8272 63.1778 174.7892 174 E 4.2224 8.0153 119.0938 57.0635 29.3164 176.9469 175 F 4.3342 7.6592 117.3618 56.6455 39.9770 174.8729 176 E 4.2835 8.6798 123.5556 55.6276 30.5760 177.2936 177 E 3.9654 9.1025 125.3915 60.0593 29.3769 179.7036 178 D 4.4013 8.0815 118.3797 56.1903 39.5210 178.7907 179 V 3.6241 8.1819 120.0828 65.7109 31.6499 177.7574 180 K 3.6185 8.1935 117.8594 59.6325 31.9033 178.4718 181 K 3.8055 7.9291 119.3244 60.0441 32.1556 178.4775 182 E 4.0573 8.0086 118.4632 58.7876 29.4477 178.9118 183 L 3.8538 8.0858 120.8731 58.2378 42.2053 179.0578 184 I 3.6352 7.7798 119.5776 64.2363 37.2234 178.1410 185 K 3.8512 7.9668 120.4130 59.8914 31.9877 178.4792 186 N 4.3948 8.0939 116.3262 56.1148 38.5766 177.5815 187 I 3.7215 7.6744 114.4746 63.7374 37.6018 178.6387 188 V 3.4708 7.8944 120.2538 65.8601 31.4921 178.1700 189 I 3.6528 7.5680 112.3574 63.7490 37.0952 177.7409 190 E 3.7972 8.0504 120.8754 59.1413 29.5355 178.6939 191 A 3.9827 7.8270 120.7587 55.1135 18.1550 179.7379 192 I 3.7086 7.5242 117.7600 64.8473 37.2631 178.1122 193 H 4.4992 8.1502 116.3039 57.8001 28.6573 176.2201 194 T 4.4321 7.3445 108.4031 61.0211 69.9766 174.8182 195 V 3.6174 7.4986 123.2455 63.3866 31.7157 174.8722 196 T 4.6621 7.9127 115.9645 60.8413 71.9960 173.3563 197 G 3.7941 8.6122 110.1065 43.9457 0.0000 171.0362 198 P 4.5039 0.0000 0.0000 61.6922 32.3402 175.6484 199 V 3.7820 8.0972 118.9552 62.2079 31.8807 176.0311 200 G 4.0289 8.4667 114.6944 45.9763 0.0000 171.4915 201 Q 5.2035 8.3556 118.0114 53.8133 31.2523 175.7096 202 L 3.9057 9.0666 125.3964 54.8822 43.3243 176.7366 203 W 4.0348 8.3157 125.0798 57.9785 26.7069 174.3908 204 M 4.4583 7.6605 120.2158 55.7754 32.5672 175.7836 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 4.50 0.00 2.02 2.19 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.48 0.00 2 S 7.70 4.47 0.00 3.83 3.74 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 3 R 8.27 4.19 0.00 1.98 1.93 0.00 3.06 0.00 0.00 3.48 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 4 G 9.03 4.21 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 0.00 5 A 8.70 4.85 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 6 L 8.95 4.80 0.00 1.65 1.59 0.65 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.76 4.73 1.88 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 1.00 0.78 0.71 0.00 0.00 8 V 8.38 4.86 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 1.28 0.00 0.00 0.64 0.00 0.00 9 F 9.49 5.13 0.00 3.02 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 10 E 10.48 5.28 0.00 2.28 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 0.00 2.44 2.78 0.00 11 G 8.43 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 0.00 0.00 0.00 12 L 7.62 4.60 0.00 1.71 2.01 0.99 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.53 4.53 0.00 2.97 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 14 K 8.82 4.00 0.00 1.97 2.00 0.00 1.79 0.00 0.00 1.80 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.41 7.81 15 S 8.21 4.28 0.00 4.01 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.24 3.93 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 0.00 0.00 0.00 17 K 7.71 3.98 0.00 2.22 2.13 0.00 1.53 0.00 0.00 1.75 0.00 0.00 3.12 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.52 7.81 18 T 7.89 3.96 4.22 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 1.18 0.00 0.00 19 T 7.75 3.83 4.37 0.00 0.00 0.00 0.00 0.00 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 20 Q 7.91 4.01 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.83 0.00 0.00 0.00 0.00 0.00 2.54 2.60 0.00 21 C 7.53 3.67 0.00 2.93 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 22 M 7.52 3.79 0.00 1.87 2.12 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.66 0.00 23 N 7.77 4.20 0.00 2.89 2.85 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 24 I 7.33 3.70 1.84 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 1.72 0.40 0.96 0.00 0.00 25 M 8.03 4.18 0.00 1.90 2.15 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.84 0.00 26 E 8.21 4.15 0.00 2.03 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 2.29 2.46 0.00 27 S 7.95 4.82 0.00 3.83 3.86 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 28 I 7.18 4.49 1.98 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 1.42 0.43 0.92 0.00 0.00 29 P 0.00 4.06 0.00 2.17 2.06 0.00 3.65 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.13 0.00 30 A 8.64 3.81 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 *31 N 8.01 4.84 0.00 2.76 2.70 0.00 0.00 6.41 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 32 T 8.05 4.79 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 33 I 7.73 5.13 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 1.26 1.05 0.96 0.00 0.00 34 K 9.11 4.84 0.00 1.72 1.72 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.37 7.81 35 Y 8.55 5.25 0.00 2.83 2.82 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 36 L 7.64 4.23 0.00 1.59 1.13 0.97 -0.54 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 37 N 7.96 5.09 0.00 2.29 2.31 0.00 0.00 6.98 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 38 F 8.52 5.22 0.00 3.16 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 39 P 0.00 4.71 0.00 2.27 2.40 0.00 3.93 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.22 0.00 40 Q 9.57 4.15 0.00 1.39 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 7.01 0.00 0.00 0.00 0.00 0.00 1.16 2.21 0.00 41 R 8.34 4.27 0.00 1.83 1.95 0.00 3.25 0.00 0.00 3.24 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 42 S 7.79 4.59 0.00 3.87 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 43 T 7.33 4.73 4.41 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 1.43 0.00 0.00 44 V 8.14 3.57 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 1.09 0.00 0.00 0.94 0.00 0.00 45 T 7.99 3.95 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 46 G 8.16 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.36 4.11 0.00 1.94 1.88 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.47 1.73 7.81 48 M 8.07 4.32 0.00 1.88 2.12 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 2.78 2.67 0.00 49 I 7.98 3.58 1.82 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.42 0.34 0.00 0.00 50 D 8.19 4.35 0.00 2.92 2.82 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 51 D 8.05 4.42 0.00 2.98 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 52 Y 7.98 4.96 0.00 3.30 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 53 L 8.27 3.75 0.00 1.74 1.85 1.12 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 54 T 7.75 4.45 4.21 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 1.29 0.00 0.00 55 R 7.63 3.92 0.00 1.99 2.04 0.00 3.19 0.00 0.00 3.04 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.62 0.00 56 K 8.00 4.43 0.00 1.85 1.88 0.00 1.92 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.57 1.38 7.81 57 K 7.06 4.47 0.00 1.87 1.74 0.00 1.29 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.08 0.71 7.81 58 T 7.91 5.10 4.28 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 1.19 0.00 0.00 59 Y 8.11 4.83 0.00 2.74 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 60 N 8.67 4.61 0.00 2.76 2.74 0.00 0.00 6.84 8.08 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 61 D 8.77 4.47 0.00 2.73 2.84 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 0.00 0.00 0.00 62 H 8.22 4.19 0.00 3.16 3.30 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.71 3.66 1.99 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 1.68 0.46 0.68 0.00 0.00 64 V 7.68 3.25 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 -0.03 0.00 0.00 1.04 0.00 0.00 65 N 8.33 4.45 0.00 2.92 2.85 0.00 0.00 6.80 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 66 L 7.91 4.00 0.00 1.78 1.72 0.84 0.43 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 67 L 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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 0.00 101 Y 8.49 3.62 0.00 2.96 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 0.00 102 A 8.03 4.13 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 0.00 103 A 8.34 4.60 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 0.00 104 A 7.79 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 K 7.59 4.50 0.00 2.01 2.19 0.00 1.77 0.00 0.00 1.99 0.00 0.00 3.48 0.00 0.00 3.41 0.00 0.00 0.00 0.00 1.75 1.93 7.81 106 G 7.83 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 0.00 0.00 0.00 107 A 8.14 4.24 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 0.00 108 S 8.36 4.56 0.00 3.90 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 M 8.64 3.93 0.00 2.08 1.96 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 2.52 2.56 0.00 110 T 7.64 3.74 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 1.11 0.00 0.00 111 L 7.62 4.01 0.00 1.79 1.74 0.86 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 112 S 8.28 4.40 0.00 4.06 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 0.00 113 K 7.80 3.78 0.00 1.57 1.07 0.00 1.04 0.00 0.00 1.18 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 1.02 7.81 114 S 7.77 4.25 0.00 3.83 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 0.00 115 Y 7.74 4.41 0.00 3.27 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 0.00 116 E 8.30 4.67 0.00 2.46 1.80 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 2.64 2.68 0.00 117 S 7.31 4.65 0.00 4.19 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 0.00 118 G 9.08 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 0.00 0.00 0.00 0.00 119 L 7.54 3.65 0.00 1.19 1.14 -0.01 -0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.61 0.00 1.93 1.99 0.00 3.62 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.10 0.00 121 K 8.72 4.20 0.00 1.78 1.70 0.00 1.97 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.35 7.81 122 P 0.00 4.41 0.00 1.96 1.80 0.00 3.73 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 1.96 0.00 123 D 8.58 4.70 0.00 2.43 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 0.00 124 L 7.38 4.44 0.00 1.49 1.22 0.60 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 125 V 7.92 4.25 0.67 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 -0.76 0.00 0.00 0.16 0.00 0.00 126 I 8.16 4.27 0.90 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.11 0.69 0.00 0.00 127 F 9.29 5.12 0.00 3.59 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 0.00 128 L 7.70 4.63 0.00 1.35 1.50 1.09 0.96 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 0.00 129 E 8.30 4.25 0.00 2.03 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 2.68 2.42 0.00 130 S 8.44 4.82 0.00 3.83 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 0.00 131 G 10.14 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 0.00 132 S 8.66 4.20 0.00 3.88 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 *133 K 7.92 4.30 0.00 1.81 1.70 0.00 1.85 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.33 1.02 7.81 134 E 7.93 4.43 0.00 2.19 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 0.00 2.36 2.33 0.00 135 I 8.10 3.79 1.90 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 1.34 0.76 0.95 0.00 0.00 136 N 7.66 4.83 0.00 2.94 2.85 0.00 0.00 6.97 7.54 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 0.00 137 R 7.56 4.21 0.00 1.88 1.98 0.00 3.45 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 138 N 7.86 4.76 0.00 2.83 3.01 0.00 0.00 6.97 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 0.00 139 V 7.99 3.70 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 0.70 0.00 0.00 0.98 0.00 0.00 140 G 8.41 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.45 4.04 0.00 2.09 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 2.49 2.35 0.00 142 E 7.97 4.58 0.00 2.28 1.88 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 2.33 2.30 0.00 143 I 7.57 3.55 1.35 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.51 -0.16 0.00 0.00 144 Y 7.84 4.88 0.00 3.22 3.22 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 0.00 145 E 7.96 4.55 0.00 2.21 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 2.66 2.40 0.00 146 D 7.87 4.97 0.00 2.66 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 0.00 147 V 8.29 4.18 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 1.10 0.00 0.00 0.98 0.00 0.00 148 T 7.93 4.07 4.28 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 1.25 0.00 0.00 149 F 8.27 4.15 0.00 3.26 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 0.00 150 Q 8.20 3.99 0.00 2.34 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.70 0.00 0.00 0.00 0.00 0.00 2.79 2.51 0.00 151 Q 7.72 4.02 0.00 2.29 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 152 K 7.77 3.93 0.00 1.73 1.56 0.00 1.72 0.00 0.00 1.52 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.48 7.81 153 V 7.25 3.18 1.80 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 0.44 0.00 0.00 -0.25 0.00 0.00 154 L 7.70 4.14 0.00 2.05 1.83 1.10 0.80 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 0.00 155 Q 7.95 3.94 0.00 2.21 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.59 0.00 0.00 0.00 0.00 0.00 2.57 2.49 0.00 156 E 7.74 3.86 0.00 1.87 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 0.00 2.36 2.46 0.00 157 Y 7.80 3.98 0.00 3.13 2.43 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 0.00 158 K 7.83 3.65 0.00 1.85 1.71 0.00 1.50 0.00 0.00 1.31 0.00 0.00 2.84 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.62 1.52 7.81 159 K 7.60 3.79 0.00 1.80 1.80 0.00 1.63 0.00 0.00 1.80 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.59 7.81 160 M 7.74 4.24 0.00 2.39 2.24 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.75 0.00 161 I 6.91 2.78 1.41 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.54 0.00 0.00 162 E 7.66 4.29 0.00 1.98 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 2.39 0.00 163 E 7.95 4.07 0.00 2.20 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 2.30 2.47 0.00 164 G 8.45 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 D 8.08 4.63 0.00 2.96 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 0.00 166 I 7.68 4.46 2.17 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 1.63 1.18 0.44 0.00 0.00 167 H 8.54 4.62 0.00 3.19 3.24 0.00 5.67 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 W 8.64 5.00 0.00 3.11 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 0.00 169 Q 8.92 4.48 0.00 1.86 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.85 0.00 0.00 0.00 0.00 0.00 2.33 2.45 0.00 170 I 8.60 4.93 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 1.54 0.60 1.09 0.00 0.00 171 I 8.55 4.27 1.77 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.15 0.70 0.00 0.00 172 S 9.10 4.40 0.00 4.15 4.40 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 0.00 173 S 8.93 4.39 0.00 4.20 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 0.00 174 E 8.02 4.22 0.00 1.94 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 2.30 2.27 0.00 175 F 7.66 4.33 0.00 3.11 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 0.00 176 E 8.68 4.28 0.00 2.09 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 0.00 2.39 2.41 0.00 177 E 9.10 3.97 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 2.44 2.37 0.00 178 D 8.08 4.40 0.00 2.88 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 0.00 179 V 8.18 3.62 2.42 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 1.35 0.00 0.00 1.03 0.00 0.00 180 K 8.19 3.62 0.00 2.02 1.84 0.00 1.96 0.00 0.00 1.75 0.00 0.00 3.12 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.63 7.81 181 K 7.93 3.81 0.00 1.92 2.10 0.00 1.51 0.00 0.00 1.63 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.55 7.81 182 E 8.01 4.06 0.00 2.09 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 2.33 2.46 0.00 183 L 8.09 3.85 0.00 1.81 1.52 0.09 1.15 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 0.00 184 I 7.78 3.64 1.91 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.74 1.08 0.00 0.00 185 K 7.97 3.85 0.00 2.05 1.98 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.64 7.81 186 N 8.09 4.39 0.00 2.79 2.82 0.00 0.00 6.80 6.56 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 0.00 187 I 7.67 3.72 1.80 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 1.56 0.56 0.90 0.00 0.00 188 V 7.89 3.47 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 1.06 0.00 0.00 0.97 0.00 0.00 189 I 7.57 3.65 1.76 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 1.50 0.37 1.02 0.00 0.00 190 E 8.05 3.80 0.00 2.13 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 2.28 2.31 0.00 191 A 7.83 3.98 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 0.00 192 I 7.52 3.71 1.97 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 1.50 0.75 0.94 0.00 0.00 193 H 8.15 4.50 0.00 3.11 3.34 0.00 5.63 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 T 7.34 4.43 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 1.26 0.00 0.00 195 V 7.50 3.62 2.21 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 0.87 0.00 0.00 0.97 0.00 0.00 196 T 7.91 4.66 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 1.33 0.00 0.00 197 G 8.61 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 0.00 0.00 0.00 198 P 0.00 4.50 0.00 2.19 2.08 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 1.98 1.95 0.00 199 V 8.10 3.78 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 0.81 0.00 0.00 0.91 0.00 0.00 200 G 8.47 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 Q 8.36 5.20 0.00 1.96 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.87 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 202 L 9.07 3.91 0.00 1.51 1.28 0.23 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 203 W 8.32 4.03 0.00 3.59 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 0.00 204 M 7.66 4.46 0.00 2.00 1.96 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 2.83 2.61 0.00 * Residues marked with a * may have inaccurate shift predictions.