NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 K 4.3390 8.3031 121.8009 56.3212 34.1261 176.3279 10 G 3.5784 7.8685 106.1371 43.4744 0.0000 171.5096 11 F 4.9201 7.2825 115.2349 54.9611 41.8675 172.2930 12 N 4.4844 8.4871 119.9626 52.7215 40.2714 173.6912 *14 I 4.2674 7.8709 110.9026 60.5842 38.6842 175.7917 15 S 4.5099 8.8462 116.7507 57.8193 65.0736 175.2667 16 I 3.7939 8.3592 123.2295 64.9642 36.6919 178.4373 17 E 4.0439 8.1821 118.5395 59.6300 29.3808 179.3375 18 Q 4.0478 8.4391 118.2579 58.9204 28.6612 178.4422 19 E 4.0522 8.5931 120.6509 58.8591 29.6482 178.7233 20 K 3.8711 8.4105 118.9101 59.7043 32.3158 178.6893 21 E 3.9292 7.9741 119.3286 59.1173 29.4572 178.4608 22 L 4.0465 8.1453 120.5387 58.2042 42.0953 179.2634 23 G 3.7527 8.3390 107.2382 47.2403 0.0000 175.2172 24 N 4.3099 8.2565 118.9752 56.1722 38.7020 177.6666 25 K 3.9323 7.9303 119.2955 59.5596 32.1496 179.4317 26 F 4.2044 8.4277 118.0430 60.4367 38.8018 177.6306 27 A 4.2025 8.3132 121.8286 54.8204 18.0566 179.9023 28 V 3.5961 7.4115 115.0015 66.0033 31.7172 177.5928 29 E 4.0887 8.1382 118.6561 59.3699 29.6150 178.8227 30 I 3.7632 8.2785 120.3260 64.4691 37.2456 178.1344 31 E 4.4628 8.3027 119.9654 58.0173 29.0580 179.2830 32 K 4.1138 7.7813 118.2710 58.5598 32.1463 177.5327 33 Q 4.4564 7.7160 115.1947 55.6676 29.2299 175.3294 34 Q 4.5772 7.6598 117.5728 54.3996 30.9815 174.3787 35 Q 4.8976 8.2837 119.4027 53.6393 30.4645 173.6087 36 P 4.7461 0.0000 0.0000 62.4536 32.6967 176.0683 37 V 3.8882 8.1885 122.2425 61.9958 32.0025 176.5527 38 N 4.9043 8.4942 127.5278 53.0339 38.9398 175.9562 39 D 4.7684 7.6473 118.2384 51.9571 43.0800 172.8311 40 P 4.2729 0.0000 0.0000 65.8517 31.3378 178.4868 41 E 3.9735 8.3102 116.9855 59.3275 29.4192 179.5411 42 V 3.6169 7.9136 117.8406 65.9308 31.6990 177.4989 43 Q 3.9814 8.4398 119.7752 59.3999 28.9327 178.5088 44 R 3.9009 8.3538 119.9142 59.3995 30.1083 177.9169 45 Y 4.0221 8.0777 119.3896 60.6907 38.8143 177.9275 46 V 3.1842 7.8187 119.0962 66.0307 31.5399 177.3142 47 D 4.2700 8.0484 118.6016 57.4333 40.6094 179.1679 48 K 3.7857 7.6300 119.4439 59.5104 32.3117 179.0182 49 V 3.5130 7.2041 118.5540 65.7266 31.3296 178.1306 50 G 2.4005 7.5329 105.6084 47.2976 0.0000 175.4139 51 K 3.8844 7.9189 122.9609 59.1137 31.9178 178.7283 52 R 3.8500 7.8319 117.9406 59.4484 30.3244 178.2237 53 L 4.1629 7.9547 118.7871 57.7759 41.5932 179.4906 54 L 3.9385 8.1067 119.2378 57.5391 41.2502 179.6299 55 S 4.2783 7.8716 113.2826 60.7466 62.9659 175.9207 56 G 3.8134 7.8385 106.9922 44.3911 0.0000 173.7458 57 A 4.4070 6.9520 123.8184 51.4027 19.4571 177.9973 58 R 4.0772 8.4631 118.4149 58.7068 30.5214 177.7227 59 A 4.4242 7.6882 119.4857 50.8647 21.8554 175.5673 60 V 4.2830 8.3788 123.3873 61.5341 31.6568 174.5343 61 E 4.4511 8.7565 124.2039 55.6810 30.1759 175.8999 62 F 4.8813 7.7086 116.3461 55.6151 42.8742 174.8403 63 D 4.7351 8.5544 122.6402 53.5057 39.4654 175.6705 64 Y 4.6533 8.5006 121.5536 57.3715 38.8614 175.6483 65 V 4.3202 7.8518 122.4335 60.9909 34.9806 173.7378 66 F 5.0321 8.8014 125.9871 55.6526 40.9936 174.9840 67 K 4.5261 8.7498 123.5975 54.4534 35.1609 175.1932 68 V 4.7560 8.3788 124.7328 61.6450 33.4410 174.7110 69 V 4.7228 8.6422 120.8023 59.4081 35.0730 175.4506 70 K 4.5326 9.2709 124.9285 56.4853 31.9749 176.1532 71 D 4.4948 8.7198 124.4772 53.4816 44.2018 175.9088 72 D 4.5371 9.0507 126.1898 55.9430 41.4158 176.6253 73 S 4.2215 8.3810 114.9076 57.9263 63.5620 174.7453 74 V 4.0114 8.2831 123.1126 62.8258 30.5662 174.2765 75 N 5.1766 8.2841 124.0724 52.6727 42.4102 172.6050 76 A 5.3586 8.5610 123.7450 50.7094 22.7515 175.5536 77 F 5.3684 8.9124 114.6951 55.6939 41.6888 173.1920 78 A 4.9966 9.7136 125.2349 51.1795 19.7789 176.7167 79 I 4.0087 8.3793 115.4216 57.8831 40.9203 173.4001 80 P 4.2981 0.0000 0.0000 64.2589 31.5381 177.3637 81 G 2.8092 8.3537 109.4965 45.4803 0.0000 173.9915 82 G 2.6609 6.7378 106.2632 45.3606 0.0000 173.2167 83 R 4.6183 7.3269 118.4198 53.8025 32.5707 175.2058 84 V 4.5494 8.1089 124.2745 61.1670 34.0569 173.6255 85 Y 4.7692 8.5385 126.0034 56.3527 40.2089 174.8720 86 V 4.6343 8.9185 123.4085 61.2411 34.6947 174.4048 87 H 5.0224 9.2415 126.3327 55.7647 29.4962 176.9444 88 T 4.0001 9.0885 113.9954 65.1328 68.5220 176.8577 89 G 3.8543 8.4422 109.9164 46.8819 0.0000 175.4086 90 L 4.1220 7.9568 122.2645 58.0610 41.9423 179.0167 91 L 4.1136 7.9006 117.2944 57.9064 41.6882 179.2710 92 K 4.1352 8.1632 117.2556 59.0772 32.0447 178.9615 93 A 4.2624 7.8976 120.0680 53.6039 18.8521 178.1924 94 A 4.4599 7.7719 120.1973 52.8283 18.8862 177.5240 95 D 4.6791 9.9287 123.3695 56.5484 41.6685 176.5896 96 N 4.0254 7.1829 115.0685 50.3169 41.0226 174.7418 97 E 3.5533 8.4970 121.7495 59.3792 29.4459 179.2235 98 T 3.4863 7.4893 115.4387 66.3645 68.7003 176.1140 99 E 3.9653 7.8419 119.9222 59.2809 29.5533 178.8786 100 L 3.5648 7.3161 119.3805 58.1799 42.1524 178.9361 101 A 3.7468 7.9999 121.0074 54.7063 18.2217 179.5790 102 G 3.5101 7.8811 104.4864 48.0227 0.0000 175.9501 103 V 3.4823 7.2150 120.4280 65.6319 31.5445 178.1066 104 L 4.0076 7.8369 118.4079 57.7114 41.4095 179.4502 105 A 4.0527 8.5107 121.2063 55.1118 18.2647 179.1581 106 H 4.0046 8.0943 116.3769 59.5463 30.1283 177.4479 107 E 4.0982 8.1320 119.9200 59.5154 29.2634 179.2228 108 I 3.8641 8.2984 120.2811 64.7738 37.1675 178.2036 109 N 4.4690 8.2182 116.8629 56.1661 38.2494 177.1139 110 H 4.0282 8.1350 117.8532 58.8005 28.7269 177.5982 111 A 3.9841 7.9375 122.0626 55.0448 18.0496 179.7386 112 V 3.6955 8.0866 115.8763 66.1599 31.7693 177.4559 113 A 4.1812 7.8715 116.7077 51.4672 18.9428 177.0501 114 R 3.9016 8.0314 116.0703 57.6243 28.5413 178.6721 115 H 4.1201 8.4404 117.4838 58.6391 28.4478 177.4501 116 G 3.8690 8.1989 106.6397 48.3001 0.0000 175.4570 117 T 4.2021 7.9262 110.9562 64.1508 69.1908 176.5653 118 R 4.2741 8.2898 120.9996 59.0831 30.1641 180.0534 119 Q 4.3385 8.6073 117.4777 57.0066 28.9784 177.9555 *121 T 4.2493 7.9037 116.8972 63.0871 70.4671 176.2066 122 Q 3.6747 7.6467 121.4633 58.7659 29.3479 177.1219 123 E 3.7909 7.9364 118.1508 58.8815 29.6628 176.9535 124 Y 4.4417 7.6361 113.4649 57.6520 39.4887 177.0956 125 G 4.1251 8.1761 105.5349 45.5224 0.0000 173.8306 126 Y 4.0945 8.7551 120.5794 60.6024 38.8071 178.4227 127 S 4.0887 8.2893 113.6293 61.2989 62.5185 175.7903 128 L 3.8952 7.8541 122.4918 58.1058 41.9594 178.9881 129 V 3.5557 7.6030 117.7401 65.8705 31.4972 177.6552 130 L 3.7578 7.9483 120.4474 58.2914 41.8156 179.1659 131 S 4.2333 8.1468 115.0596 61.4083 62.5589 176.6391 132 L 3.8564 7.9643 121.7941 57.7192 41.1368 179.5382 133 V 3.5562 7.4819 116.8994 65.9674 31.5441 177.5028 134 L 4.3214 7.8339 116.2409 54.4448 41.9315 176.9611 135 G 3.7532 7.5971 106.7667 46.5370 0.0000 174.4584 136 D 4.3497 7.9013 119.1869 56.2556 41.3042 176.9971 *139 N 4.3856 7.8139 116.8131 52.9778 40.2433 176.0243 *141 L 3.9126 7.9034 120.7371 54.9581 43.8682 178.2455 142 A 4.0116 7.7354 119.8280 54.9925 18.3627 179.2227 143 Q 3.8949 7.9103 117.7356 59.3768 29.0793 178.5351 144 L 4.0170 7.8393 119.3511 57.3534 41.7806 178.7980 145 A 4.5981 8.3639 121.1083 55.5071 18.4185 179.8313 146 G 3.5948 7.7938 103.2505 48.1366 0.0000 175.6454 147 Q 3.9075 7.9401 121.8167 58.5836 28.8653 177.8729 148 L 3.7200 7.9162 119.1034 55.8948 41.8968 177.4324 149 F 4.5115 7.7652 113.4694 56.4636 40.9568 175.2174 150 G 3.9153 7.7685 111.3548 44.1796 0.0000 174.5930 151 K 4.0805 8.5192 117.0725 58.5689 32.6474 177.2907 152 A 4.5584 7.7607 119.8656 51.4533 20.1106 176.0144 153 G 3.6651 7.4359 105.4190 45.1094 0.0000 173.3193 *156 S 3.8754 8.1932 112.8133 58.0218 63.1177 172.3757 157 Y 5.0157 8.1178 124.8641 56.2451 39.6788 176.3028 158 S 4.2381 8.5324 118.6434 58.4367 64.8942 175.5128 159 R 3.9114 8.5532 122.3840 59.9606 29.6866 178.6036 160 E 4.0033 7.9916 117.6223 59.6821 29.4631 178.8241 161 Y 4.3088 7.9084 116.8158 61.0294 37.7915 178.1302 162 E 4.1451 8.5247 119.6139 59.7220 29.5414 179.2446 163 N 4.4180 8.4329 116.4159 56.2417 38.4963 177.2970 164 Q 4.0114 8.4153 120.7782 59.2698 29.2306 178.1713 165 A 3.9470 8.4429 122.1658 55.0991 18.3036 179.3993 166 D 4.3904 8.5405 117.6981 57.5020 40.8869 178.6180 167 F 4.0908 8.5898 121.3803 61.5543 39.4605 177.2421 168 L 4.1628 8.6478 119.0176 57.5636 41.1410 179.7595 169 G 3.6316 7.9867 105.2545 47.6322 0.0000 175.6138 170 V 3.7091 7.6046 119.7243 65.7113 31.7557 177.4167 171 E 4.1055 7.7385 118.7178 59.4871 29.3998 179.4373 172 T 4.2022 8.1357 112.3021 64.6350 68.2179 175.2994 *174 Y 4.6860 7.7808 123.8290 57.7169 40.4563 177.3957 175 K 3.8023 8.3921 117.7166 59.2967 32.1342 177.8910 176 A 4.0315 8.0812 119.1965 52.3392 18.4904 177.9188 177 G 3.7723 7.7955 103.9390 45.9890 0.0000 173.2255 178 Y 4.5493 7.4672 115.9026 55.5802 39.7535 175.0331 179 N 3.1400 8.2942 121.8148 52.7647 38.9573 173.6871 180 P 4.4297 0.0000 0.0000 64.1989 31.6026 176.6033 181 N 4.5732 8.5142 117.0535 53.6679 38.0675 176.9832 182 G 3.6793 8.0370 107.5289 48.1742 0.0000 175.4877 183 L 3.9317 7.8028 122.5982 58.0735 42.2463 179.0213 184 T 4.2187 7.9825 109.2685 64.8902 68.7401 176.4757 185 S 4.1243 8.4332 118.3265 61.3074 62.7755 176.2185 186 F 4.1746 8.2661 123.2826 61.4174 39.1072 177.0865 187 F 4.1314 8.1376 117.2108 60.5733 38.4955 177.3456 188 Q 3.9779 8.1364 117.9248 59.2101 29.1423 178.1176 189 K 4.0316 8.0645 119.3477 59.5973 31.8903 179.0664 190 L 3.8523 7.5330 117.9100 57.8238 41.5858 178.5786 191 N 4.7792 7.9035 112.7217 53.2792 38.6009 175.3147 192 A 4.4531 7.7393 120.9615 52.2374 20.4117 177.1582 *207 T 4.1511 7.6386 111.8321 63.7992 68.3720 172.4512 208 H 4.8989 8.2930 122.7226 52.4305 28.9796 170.6469 209 P 4.2070 0.0000 0.0000 62.4786 31.6521 177.0405 210 L 4.1014 7.9987 126.6377 54.0157 40.6804 176.5287 211 T 4.2782 7.7076 115.4282 60.2011 71.5988 175.3771 212 S 4.0721 8.5637 117.4548 61.9435 62.6907 176.6647 213 E 3.9317 8.1416 121.0160 59.5132 29.3459 178.9309 214 R 3.9497 7.8222 117.4424 59.2507 30.0160 179.1141 215 I 3.7009 7.7434 119.5534 64.5378 37.1532 178.4601 216 Q 4.0088 8.1442 118.7408 59.1543 28.5746 179.2817 217 R 3.9970 8.3454 119.3556 59.1323 30.0927 179.3568 218 V 3.6371 8.1376 118.3345 66.0902 31.5565 178.0324 219 Q 4.0008 8.4457 117.9371 58.9394 28.3237 178.8291 220 A 3.9969 7.8569 120.5753 55.1819 18.6134 179.1275 221 E 4.0574 8.2470 117.0444 59.8103 29.6519 179.7838 222 I 3.6667 7.9411 119.4845 64.2718 36.9104 178.3905 223 A 4.0866 7.9224 120.7233 54.6151 18.2686 179.0141 224 K 4.1269 7.5007 114.9443 56.6443 32.7156 177.0698 225 L 4.3056 6.8515 119.3574 52.3443 42.9746 174.7883 226 P 4.3486 0.0000 0.0000 61.5792 31.7570 174.8840 227 P 4.3834 0.0000 0.0000 63.2032 31.6283 175.4306 228 Q 4.4001 7.9851 117.3253 55.3004 30.7724 173.5109 229 R 4.1375 8.1707 118.7293 55.5086 30.7853 175.8319 230 Y 4.3750 8.4555 121.4057 56.7684 38.5383 175.0213 231 L 4.4910 8.4136 125.8145 53.8885 42.8987 176.3836 232 T 4.5942 8.2751 112.2883 59.7406 71.6212 173.1404 233 D 4.7461 8.5524 122.9699 52.8599 41.6996 175.7167 234 E 4.4795 8.5852 125.2100 56.8329 29.7409 177.9483 235 T 3.8484 7.9366 116.9857 67.4294 68.4782 175.6457 236 E 3.8234 8.0768 119.8792 59.1268 29.8758 178.4883 237 F 3.4285 8.1366 120.1767 61.2862 39.4483 177.1595 238 K 3.8915 8.3295 118.0635 59.0331 31.7814 179.1682 239 K 3.7822 7.8258 119.8986 59.5977 32.1510 178.7796 240 I 3.4887 7.5755 120.1408 64.1868 37.0273 178.3219 241 K 3.7113 7.8026 120.8342 59.2138 31.6747 178.7927 242 G 3.6238 7.6963 104.8744 48.0275 0.0000 175.1958 243 R 3.9966 7.9376 121.4886 59.0148 30.1684 178.5944 244 L 4.0193 7.8320 118.8323 57.4607 41.4449 179.2691 245 K 4.1644 7.9275 117.0536 58.5110 32.0316 178.8423 246 L 4.1352 7.3318 118.5814 56.7509 41.6110 176.4597 247 E 4.1354 7.7495 123.6289 56.2470 29.5899 175.7395 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 9 K 8.30 4.34 0.00 1.75 1.93 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.56 7.81 10 G 7.87 3.58 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 0.00 0.00 0.00 11 F 7.28 4.92 0.00 3.22 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 12 N 8.49 4.48 0.00 2.49 2.50 0.00 0.00 6.98 7.94 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 *14 I 7.87 4.27 2.06 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.85 0.90 0.00 0.00 15 S 8.85 4.51 0.00 4.12 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 16 I 8.36 3.79 1.82 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.83 0.55 0.00 0.00 17 E 8.18 4.04 0.00 2.01 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 2.41 2.36 0.00 18 Q 8.44 4.05 0.00 2.39 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 19 E 8.59 4.05 0.00 2.17 2.35 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 2.18 2.35 0.00 20 K 8.41 3.87 0.00 2.15 1.94 0.00 1.96 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.86 2.04 7.81 21 E 7.97 3.93 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 22 L 8.15 4.05 0.00 1.99 1.87 1.14 0.85 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 23 G 8.34 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 0.00 0.00 0.00 24 N 8.26 4.31 0.00 2.94 2.89 0.00 0.00 7.05 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 25 K 7.93 3.93 0.00 1.83 1.70 0.00 1.60 0.00 0.00 1.54 0.00 0.00 3.15 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.40 1.56 7.81 26 F 8.43 4.20 0.00 3.15 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 27 A 8.31 4.20 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 28 V 7.41 3.60 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 1.00 0.00 0.00 29 E 8.14 4.09 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 2.32 2.44 0.00 30 I 8.28 3.76 1.89 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.99 0.64 0.00 0.00 31 E 8.30 4.46 0.00 2.15 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 2.72 2.49 0.00 32 K 7.78 4.11 0.00 1.80 1.89 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.75 7.81 33 Q 7.72 4.46 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.72 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 34 Q 7.66 4.58 0.00 2.16 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.77 0.00 0.00 0.00 0.00 0.00 2.34 2.47 0.00 35 Q 8.28 4.90 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.06 0.00 0.00 0.00 0.00 0.00 2.37 2.28 0.00 36 P 0.00 4.75 0.00 2.08 2.09 0.00 3.52 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 2.01 2.11 0.00 37 V 8.19 3.89 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 0.80 0.00 0.00 0.95 0.00 0.00 38 N 8.49 4.90 0.00 2.73 2.77 0.00 0.00 6.90 8.06 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 39 D 7.65 4.77 0.00 2.68 2.54 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 40 P 0.00 4.27 0.00 2.20 2.11 0.00 3.65 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 41 E 8.31 3.97 0.00 2.15 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 2.33 2.45 0.00 42 V 7.91 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 1.07 0.00 0.00 0.93 0.00 0.00 43 Q 8.44 3.98 0.00 2.30 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 44 R 8.35 3.90 0.00 2.02 2.16 0.00 3.18 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 45 Y 8.08 4.02 0.00 3.12 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 46 V 7.82 3.18 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 0.95 0.00 0.00 1.03 0.00 0.00 47 D 8.05 4.27 0.00 2.93 2.72 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 48 K 7.63 3.79 0.00 1.87 1.83 0.00 1.64 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.39 7.81 49 V 7.20 3.51 1.61 0.00 0.00 0.00 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 0.30 0.00 0.00 50 G 7.53 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 0.00 0.00 0.00 51 K 7.92 3.88 0.00 1.90 1.94 0.00 1.63 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.46 7.81 52 R 7.83 3.85 0.00 1.84 2.16 0.00 3.19 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00 53 L 7.95 4.16 0.00 1.82 1.66 0.80 0.41 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 54 L 8.11 3.94 0.00 1.80 1.59 0.90 -0.23 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 55 S 7.87 4.28 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 56 G 7.84 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 57 A 6.95 4.41 1.24 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 0.00 0.00 0.00 58 R 8.46 4.08 0.00 1.84 2.03 0.00 3.29 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 59 A 7.69 4.42 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 V 8.38 4.28 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.85 0.00 0.00 61 E 8.76 4.45 0.00 1.52 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 2.09 2.21 0.00 62 F 7.71 4.88 0.00 2.52 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 63 D 8.55 4.74 0.00 2.69 2.68 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 0.00 0.00 0.00 0.00 64 Y 8.50 4.65 0.00 2.79 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 0.00 0.00 0.00 0.00 65 V 7.85 4.32 1.82 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 0.99 0.00 0.00 0.85 0.00 0.00 66 F 8.80 5.03 0.00 3.08 2.88 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 67 K 8.75 4.53 0.00 1.15 1.60 0.00 1.62 0.00 0.00 1.47 0.00 0.00 2.61 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.89 0.76 7.81 68 V 8.38 4.76 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 1.10 0.00 0.00 0.97 0.00 0.00 69 V 8.64 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 0.92 0.00 0.00 1.05 0.00 0.00 70 K 9.27 4.53 0.00 1.77 1.81 0.00 1.75 0.00 0.00 1.78 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.49 1.40 7.81 71 D 8.72 4.49 0.00 2.56 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 0.00 0.00 0.00 0.00 72 D 9.05 4.54 0.00 2.78 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 73 S 8.38 4.22 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 74 V 8.28 4.01 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 1.07 0.00 0.00 1.09 0.00 0.00 75 N 8.28 5.18 0.00 2.79 2.39 0.00 0.00 6.74 7.69 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 76 A 8.56 5.36 1.24 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 0.00 0.00 0.00 77 F 8.91 5.37 0.00 3.26 3.25 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 78 A 9.71 5.00 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 79 I 8.38 4.01 1.14 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 1.32 0.70 0.15 0.00 0.00 80 P 0.00 4.30 0.00 2.22 2.03 0.00 3.25 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.11 0.00 81 G 8.35 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 0.00 0.00 0.00 82 G 6.74 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 83 R 7.33 4.62 0.00 1.53 1.44 0.00 3.03 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.28 0.00 84 V 8.11 4.55 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 1.13 0.00 0.00 0.82 0.00 0.00 85 Y 8.54 4.77 0.00 1.43 2.41 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 86 V 8.92 4.63 2.12 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 2.42 2.41 0.00 *121 T 7.90 4.25 3.85 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 1.39 0.00 0.00 122 Q 7.65 3.67 0.00 1.67 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.98 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 123 E 7.94 3.79 0.00 1.65 1.16 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 1.47 1.47 0.00 124 Y 7.64 4.44 0.00 3.06 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 0.00 125 G 8.18 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 0.00 0.00 0.00 126 Y 8.76 4.09 0.00 3.21 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 0.00 127 S 8.29 4.09 0.00 4.04 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 0.00 128 L 7.85 3.90 0.00 1.77 1.84 0.74 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 129 V 7.60 3.56 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 0.97 0.00 0.00 1.04 0.00 0.00 130 L 7.95 3.76 0.00 0.92 1.32 0.85 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 131 S 8.15 4.23 0.00 4.05 3.84 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 0.00 132 L 7.96 3.86 0.00 1.82 1.56 0.92 0.50 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 0.00 133 V 7.48 3.56 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 0.89 0.00 0.00 0.98 0.00 0.00 134 L 7.83 4.32 0.00 1.64 1.68 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 135 G 7.60 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 0.00 0.00 0.00 136 D 7.90 4.35 0.00 2.65 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 *139 N 7.81 4.39 0.00 2.74 2.82 0.00 0.00 6.71 6.74 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 *141 L 7.90 3.91 0.00 1.48 1.50 0.57 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.74 4.01 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 0.00 143 Q 7.91 3.89 0.00 2.16 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.77 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 144 L 7.84 4.02 0.00 1.78 1.92 0.68 0.68 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 0.00 145 A 8.36 4.60 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 0.00 146 G 7.79 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 0.00 147 Q 7.94 3.91 0.00 2.25 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.70 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 148 L 7.92 3.72 0.00 0.45 0.35 0.79 0.50 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 0.00 149 F 7.77 4.51 0.00 3.01 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 0.00 150 G 7.77 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 0.00 151 K 8.52 4.08 0.00 1.86 1.97 0.00 1.40 0.00 0.00 1.69 0.00 0.00 3.08 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.49 7.81 152 A 7.76 4.56 1.23 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 0.00 0.00 153 G 7.44 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 *156 S 8.19 3.88 0.00 3.72 3.69 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 0.00 157 Y 8.12 5.02 0.00 3.12 2.95 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 0.00 158 S 8.53 4.24 0.00 4.00 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 0.00 159 R 8.55 3.91 0.00 1.89 1.96 0.00 3.18 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.75 0.00 160 E 7.99 4.00 0.00 1.93 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 2.38 2.44 0.00 161 Y 7.91 4.31 0.00 3.07 2.46 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 0.00 162 E 8.52 4.15 0.00 2.26 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 0.00 2.67 2.66 0.00 163 N 8.43 4.42 0.00 2.95 2.92 0.00 0.00 6.70 7.35 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 0.00 164 Q 8.42 4.01 0.00 2.32 2.40 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 2.45 2.46 0.00 165 A 8.44 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 D 8.54 4.39 0.00 3.05 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 0.00 167 F 8.59 4.09 0.00 3.24 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 0.00 168 L 8.65 4.16 0.00 1.80 1.88 0.97 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 169 G 7.99 3.63 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 0.00 0.00 0.00 170 V 7.60 3.71 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 0.71 0.00 0.00 0.91 0.00 0.00 171 E 7.74 4.11 0.00 1.78 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 2.31 2.34 0.00 172 T 8.14 4.20 4.42 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 1.26 0.00 0.00 *174 Y 7.78 4.69 0.00 3.10 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 0.00 175 K 8.39 3.80 0.00 1.83 1.84 0.00 1.80 0.00 0.00 1.86 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.62 7.81 176 A 8.08 4.03 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 0.00 177 G 7.80 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 Y 7.47 4.55 0.00 2.90 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 N 8.29 3.14 0.00 2.32 2.49 0.00 0.00 6.87 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 0.00 180 P 0.00 4.43 0.00 2.18 2.15 0.00 3.37 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.98 0.00 181 N 8.51 4.57 0.00 2.92 3.09 0.00 0.00 6.74 6.24 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 0.00 182 G 8.04 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 L 7.80 3.93 0.00 1.77 1.74 0.78 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 184 T 7.98 4.22 4.33 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 0.00 0.00 1.32 0.00 0.00 185 S 8.43 4.12 0.00 4.09 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 0.00 186 F 8.27 4.17 0.00 3.05 3.04 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 0.00 187 F 8.14 4.13 0.00 3.31 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 0.00 188 Q 8.14 3.98 0.00 2.18 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.91 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 189 K 8.06 4.03 0.00 1.83 1.81 0.00 1.93 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.68 1.85 7.81 190 L 7.53 3.85 0.00 1.67 1.64 0.57 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 191 N 7.90 4.78 0.00 2.80 2.84 0.00 0.00 6.78 6.85 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 0.00 192 A 7.74 4.45 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 *207 T 7.64 4.15 4.18 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 1.20 0.00 0.00 208 H 8.29 4.90 0.00 3.30 3.61 0.00 5.71 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 P 0.00 4.21 0.00 2.04 2.00 0.00 3.74 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 2.04 2.08 0.00 210 L 8.00 4.10 0.00 0.66 1.05 0.78 0.49 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 0.00 211 T 7.71 4.28 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 1.19 0.00 0.00 212 S 8.56 4.07 0.00 3.87 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 0.00 213 E 8.14 3.93 0.00 2.03 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 0.00 214 R 7.82 3.95 0.00 2.03 1.98 0.00 3.25 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.70 0.00 215 I 7.74 3.70 1.99 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 1.65 0.95 0.92 0.00 0.00 216 Q 8.14 4.01 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 217 R 8.35 4.00 0.00 2.07 2.05 0.00 3.26 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.79 0.00 218 V 8.14 3.64 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 1.07 0.00 0.00 1.01 0.00 0.00 219 Q 8.45 4.00 0.00 2.31 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.62 0.00 220 A 7.86 4.00 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 0.00 221 E 8.25 4.06 0.00 2.15 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 2.63 2.55 0.00 222 I 7.94 3.67 2.00 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 1.43 1.17 0.93 0.00 0.00 223 A 7.92 4.09 1.37 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 0.00 224 K 7.50 4.13 0.00 1.78 1.83 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.74 7.81 225 L 6.85 4.31 0.00 1.65 1.23 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 226 P 0.00 4.35 0.00 2.11 2.02 0.00 3.64 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.08 0.00 227 P 0.00 4.38 0.00 2.17 2.08 0.00 3.81 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 1.99 1.97 0.00 228 Q 7.99 4.40 0.00 1.87 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.91 0.00 0.00 0.00 0.00 0.00 2.15 1.25 0.00 229 R 8.17 4.14 0.00 1.73 1.87 0.00 3.16 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 230 Y 8.46 4.38 0.00 3.01 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 0.00 231 L 8.41 4.49 0.00 1.61 1.59 0.89 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 232 T 8.28 4.59 4.48 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 1.29 0.00 0.00 233 D 8.55 4.75 0.00 2.63 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 0.00 234 E 8.59 4.48 0.00 2.07 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 2.40 2.35 0.00 235 T 7.94 3.85 4.27 0.00 0.00 0.00 0.00 0.00 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 0.00 236 E 8.08 3.82 0.00 2.11 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 2.29 2.38 0.00 237 F 8.14 3.43 0.00 3.23 3.19 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 0.00 238 K 8.33 3.89 0.00 1.91 1.83 0.00 1.77 0.00 0.00 1.65 0.00 0.00 3.11 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.62 1.78 7.81 239 K 7.83 3.78 0.00 1.88 1.84 0.00 1.58 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.43 7.81 240 I 7.58 3.49 1.20 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.17 0.78 0.00 0.00 241 K 7.80 3.71 0.00 0.93 1.39 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.97 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.30 1.29 7.81 242 G 7.70 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 243 R 7.94 4.00 0.00 1.83 2.01 0.00 3.06 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 244 L 7.83 4.02 0.00 1.82 1.66 0.89 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 245 K 7.93 4.16 0.00 1.71 1.85 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.58 7.81 246 L 7.33 4.14 0.00 1.79 1.71 0.90 0.78 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 0.00 247 E 7.75 4.14 0.00 1.94 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.29 0.00 * Residues marked with a * may have inaccurate shift predictions.