NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 R 3.9952 8.2393 120.8564 55.3869 30.7267 175.2733 13 P 4.2514 0.0000 0.0000 59.6853 32.6602 174.3302 14 D 4.4944 8.9003 119.8892 53.1921 42.0462 178.7636 15 V 3.4381 7.9833 112.8202 64.3836 31.3934 178.6018 16 E 3.7464 7.9351 117.9270 59.7708 29.2534 179.4218 17 T 3.9749 8.1392 115.6538 66.5548 68.5439 177.0629 18 Q 3.8870 7.9751 120.1420 58.5765 28.5786 178.6828 19 K 4.2713 8.3330 121.0662 59.7863 32.2327 179.0846 20 T 4.1407 7.9664 115.9738 66.9200 68.2384 176.6120 21 E 4.2040 8.4476 119.1753 59.5980 29.8532 179.1980 22 L 4.5320 8.5964 118.7009 57.5514 41.5491 179.6706 23 G 4.0880 8.8929 105.4046 47.8084 0.0000 175.3491 24 A 4.3949 8.3458 121.7656 53.3278 19.7692 178.1024 25 L 4.3276 7.8355 119.4477 53.3264 40.3155 176.9714 *27 G 3.8620 8.0177 108.1120 44.9721 0.0000 170.6155 28 T 4.0525 7.9567 116.9497 63.6032 68.8103 174.4687 29 T 4.5748 8.3492 115.9397 60.0800 70.7849 174.0399 30 L 4.2421 8.3439 124.9907 54.8911 42.5868 177.3357 31 Q 4.7003 8.4701 120.9941 52.5053 31.7403 171.9299 32 R 4.2970 8.5837 120.6131 57.6772 30.4560 177.2703 33 G 3.9519 9.1563 111.1673 45.2088 0.0000 173.7695 34 A 4.3160 7.9144 121.7713 52.1415 19.7847 176.3198 35 Q 4.9691 8.5928 119.0377 54.2886 30.5481 175.2868 36 W 4.9912 9.1025 123.0354 55.0244 33.5774 173.8768 37 Y 4.8185 8.9544 119.2373 56.1543 40.8317 174.7086 38 L 4.9018 8.2018 122.8319 53.6321 43.3588 176.2518 39 I 4.7876 8.4511 123.4137 59.0622 40.5986 174.4468 40 D 4.9572 9.4073 127.1311 55.2573 41.7000 177.7075 41 S 4.5112 9.0695 120.1185 60.6204 63.1743 176.6978 42 R 3.8941 8.3808 123.2319 59.3223 29.8375 178.1130 43 W 3.9681 8.2743 127.4998 60.4988 30.8530 177.5600 44 F 4.3273 8.6951 120.7045 61.2799 38.8817 177.2599 45 K 3.9990 8.7304 118.7084 59.4061 31.8190 179.1121 46 Q 3.7630 7.7752 119.5748 58.7194 28.9678 177.7971 47 W 3.6857 7.4804 129.3901 60.4384 30.5287 177.9609 48 K 3.3533 7.7425 118.0095 59.3456 31.4277 179.5336 49 K 4.0153 7.8306 118.6297 59.3195 31.8945 178.9013 50 Y 4.2090 7.7618 120.0678 60.2753 38.5613 177.3755 51 V 3.5231 7.0287 110.1325 59.8773 32.5344 175.8268 52 G 3.6557 7.5575 106.9221 46.3357 0.0000 175.8855 53 F 3.6219 8.3743 123.3663 60.5340 40.1933 175.3257 54 D 4.7822 7.0298 118.3785 52.3717 40.0219 177.5103 55 S 4.6331 6.8405 107.9348 58.1338 65.2484 176.5495 56 W 4.6336 8.9630 130.0806 55.1128 29.5055 175.6713 57 D 4.6982 7.6532 122.8453 54.2348 39.6889 179.7194 *59 Y 4.3056 8.6707 123.7911 58.1401 38.8515 174.1200 60 N 4.1847 8.8121 122.9845 54.3656 39.3944 174.2821 61 V 4.1850 8.0089 122.6388 62.2546 32.5887 175.7522 62 G 4.2137 8.3065 109.4342 47.5543 0.0000 173.6766 63 E 4.6354 8.6830 120.3372 54.6558 31.3188 176.7810 64 H 4.3258 9.0948 126.4628 58.3675 30.1389 176.2858 65 N 4.7208 8.2148 113.2478 53.7597 37.3138 174.9895 66 L 4.3997 8.0434 118.5845 54.3921 41.9909 175.8019 67 F 2.4608 7.5117 121.3330 57.4684 39.0082 173.7531 68 P 3.7699 0.0000 0.0000 62.7331 31.7922 177.4204 69 G 3.6868 5.4553 107.2768 43.6605 0.0000 170.8608 70 P 4.9414 0.0000 0.0000 62.1660 32.1629 176.8148 71 I 2.0000 8.2429 124.3245 61.2570 38.0304 174.5731 72 D 4.9914 8.0111 125.8939 52.6621 43.4292 174.3909 73 N 4.7871 9.9737 123.8554 52.8544 39.2294 177.4420 74 S 4.7725 8.5583 116.5386 61.1653 63.1836 176.8868 75 G 3.7402 7.9310 108.5171 47.5399 0.0000 174.0754 76 L 4.1800 7.9588 118.9009 55.2325 42.0706 176.1188 77 F 5.5851 7.3739 118.4179 55.8202 40.4454 176.3495 78 S 4.3903 9.1394 120.3901 60.2296 63.7410 174.1850 79 D 4.9584 7.8051 119.1008 51.5648 43.9385 174.3978 80 P 4.3074 0.0000 0.0000 66.0528 31.9543 178.5813 81 E 4.0760 8.5132 113.6277 58.7209 29.9113 180.8860 82 S 4.3928 8.1578 113.2659 57.6392 63.8875 174.6453 83 Q 2.9544 7.5817 118.1993 56.5438 26.6562 173.8166 84 T 4.1004 7.1378 113.2741 63.6303 69.6438 174.1144 85 L 4.7509 8.5357 125.6190 54.3902 42.3565 177.1986 86 K 4.1320 9.0370 123.3505 57.0637 32.7574 176.7635 87 E 4.1198 8.7221 121.8890 56.9830 30.4956 175.7571 88 H 4.1429 8.0795 114.5652 56.8927 26.0383 175.2520 89 L 4.4939 8.2569 119.3280 54.6999 42.3342 176.6540 90 I 4.3210 9.7855 125.2460 59.1770 38.5966 175.0335 91 D 3.3700 8.2842 124.7687 55.4425 41.4171 177.5993 92 E 3.9203 8.1953 123.3626 56.8019 29.3488 175.2176 93 L 4.3748 7.4501 118.5737 56.7198 43.3340 177.1365 94 D 4.6530 8.3625 118.3572 56.1749 41.6819 175.6608 95 Y 5.5017 6.9615 115.3866 55.9091 41.5047 173.9343 96 V 4.8298 9.0482 119.7866 59.9436 34.9447 174.2679 97 L 5.3464 8.5495 121.7978 53.5019 43.1552 176.2446 98 V 4.6848 8.7405 117.5432 58.4874 35.2036 174.1138 99 P 3.0333 0.0000 0.0000 61.5909 32.1400 176.9617 100 A 4.1681 8.4483 123.4798 56.4013 18.0568 180.5539 101 E 3.8074 7.9645 115.7074 61.1907 29.7605 180.9552 102 A 4.0419 7.6905 121.3595 54.4083 18.4646 179.2856 103 W 3.8316 8.0399 126.9222 60.6469 30.6126 177.7091 104 N 3.8421 7.9816 116.3766 56.1786 37.8867 177.4734 105 K 3.0295 7.2272 118.9214 59.1261 31.9681 179.4433 106 L 3.9122 7.1603 119.1354 57.4559 41.3683 179.4690 107 L 3.3475 7.1886 120.5078 57.9710 41.7097 178.5394 108 N 4.1476 7.5700 115.3522 56.3641 38.5311 177.1272 109 W 4.4597 7.8862 119.1452 59.0696 29.3574 177.3228 110 Y 4.7075 8.3976 115.1432 56.5471 39.4350 177.0682 111 G 3.9924 8.4818 109.6354 44.5773 0.0000 171.5157 112 C 5.2352 7.9707 111.7525 55.7139 33.2733 174.2117 113 V 3.6456 8.4706 120.2656 63.2771 32.0198 174.8016 114 E 3.9922 8.9386 128.1074 58.4648 29.2222 176.3990 115 G 4.0292 9.1889 114.4256 45.5943 0.0000 173.3885 116 Q 4.2741 7.8572 121.0969 55.8169 28.5309 176.6880 117 Q 4.2647 8.6043 122.6490 53.6917 28.8625 171.0681 118 P 4.2267 0.0000 0.0000 63.1799 31.9377 176.9222 119 I 4.2059 7.6803 123.4715 59.7865 36.9712 173.8567 120 V 4.0334 7.5567 125.1553 59.7435 33.3803 175.5744 121 R 4.5709 8.3410 120.8951 54.8036 35.0826 174.0730 122 K 4.9866 8.2896 119.7214 54.7464 35.2888 175.7523 123 V 4.1442 8.5430 123.6988 62.8775 32.5447 175.4291 124 V 4.7693 8.9550 123.4724 60.1200 35.5299 174.9080 125 E 4.9773 8.6250 121.0924 55.9556 31.1340 175.9295 126 H 4.7395 9.3070 119.3498 53.5345 32.5701 170.5353 127 G 3.8994 8.5152 101.9585 44.6945 0.0000 174.2170 128 L 4.2820 8.3971 124.8598 56.4880 43.7710 177.6689 129 F 4.8618 8.3325 114.8174 57.8057 38.9625 177.5016 130 V 3.2697 8.8984 116.7431 63.3093 32.1473 173.6264 131 K 4.7356 8.3207 126.3897 56.4251 33.0624 175.7785 132 H 4.9398 8.8910 118.3964 54.6249 32.2703 172.2330 133 C 5.0839 8.5856 117.5068 59.1562 29.4442 172.9884 134 K 4.5396 8.6935 120.3669 55.2831 36.4438 175.0539 135 V 4.1130 7.9774 121.2518 62.0291 32.2089 175.3496 136 E 4.0874 8.8264 130.2496 55.6617 28.6493 175.9030 137 V 3.5288 8.1311 126.8337 63.8458 32.1504 175.4377 138 Y 4.5999 7.6501 116.9563 56.0003 39.3274 175.1969 139 L 4.5454 8.3173 124.8140 53.6264 43.8472 176.1234 140 L 4.3368 8.8653 123.8510 54.6724 43.3755 175.1505 141 E 4.5966 9.4507 128.5326 55.4985 31.0405 175.0376 142 L 5.1648 9.4111 126.3028 52.9250 46.3128 175.4498 143 K 5.0434 9.0355 121.6733 55.0778 34.0780 175.3478 144 L 5.4937 9.4403 126.0934 53.2990 44.6845 175.5052 145 C 4.8182 8.9501 116.7369 57.2402 34.0751 171.8220 146 E 4.6751 7.8193 119.2412 54.0030 31.1472 175.8028 147 N 4.1732 8.9473 126.1146 56.9752 38.9840 175.6704 148 S 4.4395 8.4650 109.3498 58.7165 63.9508 174.3661 149 D 4.6657 7.7369 118.0713 53.6900 42.7676 174.1650 150 P 4.4169 0.0000 0.0000 64.5684 32.1668 178.2066 151 T 4.0839 7.7336 107.8542 63.8501 69.2241 174.8662 152 N 4.5984 7.8624 121.0291 52.6390 37.0230 172.0412 153 V 4.7382 7.9841 121.6064 60.5762 33.8106 174.0468 154 L 4.8771 9.1705 128.1402 52.8995 44.3988 175.7621 155 S 4.8533 8.6894 118.3725 58.4141 63.4921 172.6939 156 C 4.7069 9.4259 126.0960 58.3134 35.3393 171.9197 157 H 5.3243 8.4359 121.9464 54.2486 30.2758 174.0921 158 F 4.9440 9.3170 120.8977 55.3417 43.2034 174.6008 159 S 4.7447 9.2134 116.4372 57.9353 62.8536 175.4969 160 K 3.9581 9.9406 124.8286 59.5853 32.4905 178.6924 161 A 4.0148 7.7058 120.6702 53.3179 19.2515 177.4557 162 D 4.5093 7.7186 116.8051 54.5738 41.4382 176.1836 163 T 4.8954 7.9912 111.7695 60.2139 71.2271 175.7408 164 I 3.5889 8.1485 121.4930 64.1604 36.8055 178.3977 165 A 3.9637 7.8130 121.3580 55.6792 18.1610 179.5881 166 T 3.8716 7.5104 113.9249 66.9761 68.3149 176.7998 167 I 3.5781 7.5098 122.1526 64.9619 37.2861 178.3813 168 E 4.1712 7.8118 117.6874 61.0490 29.8210 180.5074 169 K 4.3438 8.1514 120.8419 59.2041 32.2071 179.3754 170 E 3.8310 8.1137 116.6549 57.0023 29.4173 178.4476 *172 R 4.3439 7.9628 118.3243 55.6917 32.2817 177.8267 173 K 3.8934 8.0551 117.7932 59.4911 32.1991 178.0919 174 L 3.9287 7.7292 117.0339 56.5668 41.5075 177.7014 175 F 4.8776 7.6002 113.7153 56.1175 40.7844 174.0605 176 N 4.1125 8.0709 117.6996 54.4922 36.5399 174.2941 177 I 4.3112 7.8037 118.7859 59.0489 38.7200 174.9291 178 P 4.1766 0.0000 0.0000 63.0448 31.5323 177.2339 179 A 4.1116 8.7625 127.4668 54.7696 18.5008 178.4890 180 E 4.2831 7.9445 110.3545 56.5816 30.4456 182.2687 181 R 4.2283 7.7098 117.1477 56.6800 30.9909 174.5562 182 E 4.9168 8.3774 122.0302 54.7862 31.7023 174.5808 183 T 5.3778 8.6363 115.1397 60.1882 72.5537 173.0385 184 R 4.5286 9.3448 121.2968 54.2816 34.1017 174.0667 185 L 4.9695 8.0285 124.7856 53.0791 44.6739 174.6857 186 W 5.2800 9.2482 126.2727 54.8708 32.4177 174.2043 187 N 4.9483 9.4368 124.9418 52.8654 39.2806 174.2318 188 K 3.9516 8.7023 129.7535 55.3804 31.5702 175.4305 189 Y 4.4451 7.4672 124.3492 56.7499 37.7864 177.5678 *191 S 4.2513 7.6284 116.3702 58.5060 64.2933 174.3347 192 N 5.1422 7.7392 116.0578 52.0650 38.8435 175.9711 193 T 4.6364 7.4032 115.6787 62.7915 70.5759 173.1105 194 Y 4.9706 8.3117 122.1527 56.1750 41.9944 174.1474 195 E 5.0535 9.5624 123.7794 54.4652 32.8008 174.5329 196 Q 4.0296 8.8718 127.7383 55.5987 30.0513 174.9816 197 L 4.4641 8.6426 127.7621 53.8728 41.4704 176.4229 198 S 4.4780 8.5054 117.8690 58.2260 65.1772 175.2798 199 K 4.2685 7.6064 121.6481 55.3527 30.2926 177.1261 200 L 4.1281 7.9556 123.6486 56.8750 42.2971 179.8100 201 D 4.3845 7.9974 117.7582 55.1881 40.3715 181.8641 202 N 4.8336 7.6681 116.3120 51.4321 38.9642 174.6124 203 T 4.5617 8.1691 109.9918 61.6250 70.7585 175.1020 204 I 3.8338 8.2053 121.8416 64.0511 36.9181 179.0464 205 Q 3.9216 7.6192 118.9958 59.2014 28.4634 178.1546 206 D 4.5317 7.7454 118.0446 57.0253 40.9360 178.2395 207 A 4.4046 7.5031 118.3547 50.9156 19.9698 176.8188 208 G 3.7961 8.3388 105.6084 46.3568 0.0000 174.1205 209 L 4.3915 7.7214 117.2331 54.2747 43.1977 176.8822 210 Y 4.5581 8.5471 119.3995 56.1508 39.8340 175.1626 211 Q 4.3458 8.5447 120.6821 57.6393 29.0916 177.5346 212 G 4.1751 9.2397 110.5508 45.2513 0.0000 173.3860 213 Q 4.0542 7.7252 121.0665 56.8206 30.5314 175.5989 214 V 4.7031 8.4071 125.0474 61.5952 33.5830 174.1820 215 L 5.4838 9.1534 128.3022 52.8411 44.9569 175.6717 216 V 4.9555 9.1735 123.1373 59.9664 34.1785 174.2796 217 I 4.8446 8.5644 125.2525 59.5965 40.2141 173.8887 218 E 4.9424 9.2833 129.4743 53.9342 32.0405 173.0524 219 P 5.0078 0.0000 0.0000 61.9446 32.5745 176.2611 220 Q 2.8968 9.0449 126.5256 55.4230 29.4646 175.9741 221 N 4.2798 8.0401 125.1954 53.9772 39.2405 176.6633 222 E 3.9938 8.6411 117.2082 58.7473 29.9474 178.3904 223 D 4.4628 7.8369 116.0042 54.9516 40.0159 176.1860 224 G 3.5010 7.5728 109.8143 45.9569 0.0000 173.9951 225 T 4.0587 8.6218 115.4439 61.7275 67.8549 172.2023 226 W 4.8852 8.3150 121.0257 54.2402 32.2282 173.7109 227 P 4.4608 0.0000 0.0000 63.0369 30.7330 176.2306 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 12 R 8.24 4.00 0.00 1.85 1.82 0.00 2.84 0.00 0.00 2.58 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.11 0.00 13 P 0.00 4.25 0.00 2.11 1.94 0.00 2.47 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.80 0.00 14 D 8.90 4.49 0.00 2.87 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 15 V 7.98 3.44 1.65 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 0.17 0.00 0.00 0.65 0.00 0.00 16 E 7.94 3.75 0.00 1.95 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 2.29 2.30 0.00 17 T 8.14 3.97 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 18 Q 7.98 3.89 0.00 2.27 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 1.16 2.08 0.00 19 K 8.33 4.27 0.00 1.65 1.61 0.00 0.89 0.00 0.00 1.19 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.44 1.01 7.81 20 T 7.97 4.14 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 21 E 8.45 4.20 0.00 2.42 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.72 0.00 22 L 8.60 4.53 0.00 2.58 2.23 1.02 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.89 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.35 4.39 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 25 L 7.84 4.33 0.00 1.99 1.65 0.95 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 *27 G 8.02 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 0.00 0.00 0.00 28 T 7.96 4.05 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 1.30 0.00 0.00 29 T 8.35 4.57 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 30 L 8.34 4.24 0.00 1.54 1.46 0.65 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 31 Q 8.47 4.70 0.00 1.92 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 7.01 0.00 0.00 0.00 0.00 0.00 2.24 1.90 0.00 32 R 8.58 4.30 0.00 1.79 1.92 0.00 3.18 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 33 G 9.16 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.91 4.32 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.59 4.97 0.00 1.88 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.73 0.00 0.00 0.00 0.00 0.00 2.17 2.32 0.00 36 W 9.10 4.99 0.00 3.07 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 37 Y 8.95 4.82 0.00 2.52 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.20 4.90 0.00 1.17 1.27 0.58 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 39 I 8.45 4.79 1.93 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 1.34 0.95 1.12 0.00 0.00 40 D 9.41 4.96 0.00 2.71 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 41 S 9.07 4.51 0.00 4.25 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 42 R 8.38 3.89 0.00 1.99 2.07 0.00 3.16 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 43 W 8.27 3.97 0.00 3.49 3.41 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 44 F 8.70 4.33 0.00 3.46 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.73 4.00 0.00 1.92 1.86 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.69 7.81 46 Q 7.78 3.76 0.00 2.04 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.74 0.00 0.00 0.00 0.00 0.00 2.30 2.22 0.00 47 W 7.48 3.69 0.00 1.98 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 48 K 7.74 3.35 0.00 1.89 1.77 0.00 2.10 0.00 0.00 1.73 0.00 0.00 3.14 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.12 1.18 7.81 49 K 7.83 4.02 0.00 1.88 1.78 0.00 1.61 0.00 0.00 1.54 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.52 7.81 50 Y 7.76 4.21 0.00 2.89 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 51 V 7.03 3.52 1.77 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 0.16 0.00 0.00 -0.00 0.00 0.00 52 G 7.56 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 0.00 0.00 0.00 53 F 8.37 3.62 0.00 2.50 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 54 D 7.03 4.78 0.00 2.84 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 55 S 6.84 4.63 0.00 3.75 3.61 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 0.00 0.00 0.00 0.00 56 W 8.96 4.63 0.00 3.19 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 57 D 7.65 4.70 0.00 2.80 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 0.00 0.00 0.00 *59 Y 8.67 4.31 0.00 2.99 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 60 N 8.81 4.18 0.00 2.59 2.68 0.00 0.00 6.95 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 61 V 8.01 4.19 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 0.78 0.00 0.00 0.94 0.00 0.00 62 G 8.31 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 63 E 8.68 4.64 0.00 1.65 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 2.15 2.09 0.00 64 H 9.09 4.33 0.00 3.23 3.39 0.00 5.83 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 N 8.21 4.72 0.00 2.87 2.95 0.00 0.00 5.93 7.79 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 66 L 8.04 4.40 0.00 1.82 1.65 0.89 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 67 F 7.51 2.46 0.00 2.42 2.79 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 68 P 0.00 3.77 0.00 0.72 1.12 0.00 2.83 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 1.10 0.00 69 G 5.46 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 0.00 0.00 0.00 70 P 0.00 4.94 0.00 2.00 2.06 0.00 3.86 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 71 I 8.24 2.00 1.39 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.35 0.49 0.00 0.00 72 D 8.01 4.99 0.00 2.70 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 73 N 9.97 4.79 0.00 2.78 2.30 0.00 0.00 6.41 7.06 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 74 S 8.56 4.77 0.00 4.18 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 75 G 7.93 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 0.00 0.00 0.00 76 L 7.96 4.18 0.00 1.07 1.43 0.75 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 77 F 7.37 5.59 0.00 3.23 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 78 S 9.14 4.39 0.00 4.01 4.06 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 0.00 0.00 0.00 79 D 7.81 4.96 0.00 2.73 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 P 0.00 4.31 0.00 2.09 2.12 0.00 3.75 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 81 E 8.51 4.08 0.00 1.99 1.86 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 2.23 1.87 0.00 82 S 8.16 4.39 0.00 3.98 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 Q 7.58 2.95 0.00 1.79 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.86 0.00 0.00 0.00 0.00 0.00 1.31 1.88 0.00 84 T 7.14 4.10 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 1.27 0.00 0.00 85 L 8.54 4.75 0.00 1.57 1.67 0.52 0.83 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 86 K 9.04 4.13 0.00 1.67 1.85 0.00 1.85 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.55 1.69 7.81 87 E 8.72 4.12 0.00 1.78 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 2.06 2.29 0.00 88 H 8.08 4.14 0.00 3.34 3.40 0.00 5.70 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 L 8.26 4.49 0.00 2.04 1.98 0.97 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 90 I 9.79 4.32 1.82 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 1.33 0.88 0.86 0.00 0.00 91 D 8.28 3.37 0.00 2.68 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 92 E 8.20 3.92 0.00 2.12 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 0.00 2.13 2.34 0.00 93 L 7.45 4.37 0.00 1.56 1.71 0.92 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 94 D 8.36 4.65 0.00 2.79 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 95 Y 6.96 5.50 0.00 3.11 2.99 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 96 V 9.05 4.83 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 0.31 0.00 0.00 0.73 0.00 0.00 97 L 8.55 5.35 0.00 1.68 1.96 0.96 0.87 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 98 V 8.74 4.68 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 0.55 0.00 0.00 1.01 0.00 0.00 99 P 0.00 3.03 0.00 1.73 1.07 0.00 3.52 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.68 0.00 100 A 8.45 4.17 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 E 7.96 3.81 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 1.95 0.00 102 A 7.69 4.04 1.27 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 0.00 0.00 0.00 103 W 8.04 3.83 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 0.00 104 N 7.98 3.84 0.00 2.69 2.65 0.00 0.00 7.10 7.83 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 0.00 105 K 7.23 3.03 0.00 1.23 0.74 0.00 1.54 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.08 1.15 7.81 106 L 7.16 3.91 0.00 1.20 1.46 0.80 0.14 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 0.00 107 L 7.19 3.35 0.00 0.27 0.86 0.60 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 108 N 7.57 4.15 0.00 2.55 2.79 0.00 0.00 7.15 7.55 0.00 0.00 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 W 7.89 4.46 0.00 3.42 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 0.00 110 Y 8.40 4.71 0.00 3.21 3.32 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 0.00 111 G 8.48 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 0.00 112 C 7.97 5.24 0.00 2.92 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 0.00 113 V 8.47 3.65 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 0.93 0.00 0.00 1.06 0.00 0.00 114 E 8.94 3.99 0.00 2.01 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 2.31 2.43 0.00 115 G 9.19 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 0.00 116 Q 7.86 4.27 0.00 2.27 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.82 0.00 0.00 0.00 0.00 0.00 2.54 2.48 0.00 117 Q 8.60 4.26 0.00 2.09 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.77 0.00 0.00 0.00 0.00 0.00 2.31 2.20 0.00 118 P 0.00 4.23 0.00 2.06 1.92 0.00 3.68 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.47 0.00 119 I 7.68 4.21 1.61 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.65 0.65 0.00 0.00 120 V 7.56 4.03 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 0.48 0.00 0.00 0.22 0.00 0.00 121 R 8.34 4.57 0.00 1.51 1.76 0.00 3.27 0.00 0.00 2.96 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.46 0.00 122 K 8.29 4.99 0.00 1.63 1.65 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.75 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.31 7.81 123 V 8.54 4.14 2.25 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 0.93 0.00 0.00 0.81 0.00 0.00 124 V 8.96 4.77 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 0.62 0.00 0.00 0.83 0.00 0.00 125 E 8.63 4.98 0.00 1.75 1.73 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 2.17 1.86 0.00 126 H 9.31 4.74 0.00 3.10 3.33 0.00 5.22 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 0.00 127 G 8.52 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 0.00 0.00 0.00 128 L 8.40 4.28 0.00 1.70 1.78 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 129 F 8.33 4.86 0.00 2.85 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 V 8.90 3.27 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 0.86 0.00 0.00 0.69 0.00 0.00 131 K 8.32 4.74 0.00 1.63 1.67 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.35 1.33 7.81 132 H 8.89 4.94 0.00 3.13 3.29 0.00 5.25 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 C 8.59 5.08 0.00 2.81 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 0.00 134 K 8.69 4.54 0.00 1.68 1.82 0.00 1.22 0.00 0.00 1.46 0.00 0.00 2.44 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.91 1.18 7.81 135 V 7.98 4.11 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.51 0.00 0.00 136 E 8.83 4.09 0.00 1.88 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 2.28 2.22 0.00 137 V 8.13 3.53 1.69 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 0.07 0.00 0.00 0.77 0.00 0.00 138 Y 7.65 4.60 0.00 3.00 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 0.00 139 L 8.32 4.55 0.00 1.60 1.81 0.85 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 140 L 8.87 4.34 0.00 1.82 1.67 0.98 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 141 E 9.45 4.60 0.00 2.00 1.85 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 2.03 2.31 0.00 142 L 9.41 5.16 0.00 1.83 1.62 0.75 0.79 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 0.00 143 K 9.04 5.04 0.00 1.81 1.79 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.42 1.58 7.81 144 L 9.44 5.49 0.00 1.80 1.87 1.19 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 145 C 8.95 4.82 0.00 2.97 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 0.00 146 E 7.82 4.68 0.00 1.16 1.33 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 2.11 2.05 0.00 147 N 8.95 4.17 0.00 2.84 2.87 0.00 0.00 7.23 8.45 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 0.00 148 S 8.47 4.44 0.00 3.99 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 0.00 149 D 7.74 4.67 0.00 2.71 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 0.00 150 P 0.00 4.42 0.00 2.07 2.09 0.00 3.70 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.19 0.00 151 T 7.73 4.08 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 152 N 7.86 4.60 0.00 2.85 2.97 0.00 0.00 6.98 7.72 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 0.00 153 V 7.98 4.74 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 0.94 0.00 0.00 1.01 0.00 0.00 154 L 9.17 4.88 0.00 1.64 1.54 0.72 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 155 S 8.69 4.85 0.00 3.91 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 0.00 156 C 9.43 4.71 0.00 2.95 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 0.00 157 H 8.44 5.32 0.00 2.92 3.11 0.00 5.69 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 F 9.32 4.94 0.00 2.89 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 0.00 159 S 9.21 4.74 0.00 3.93 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 K 9.94 3.96 0.00 1.92 2.14 0.00 1.31 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.54 1.39 7.81 161 A 7.71 4.01 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 0.00 162 D 7.72 4.51 0.00 2.87 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 T 7.99 4.90 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 1.23 0.00 0.00 164 I 8.15 3.59 1.81 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 1.58 0.76 0.84 0.00 0.00 165 A 7.81 3.96 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 0.00 166 T 7.51 3.87 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 1.40 0.00 0.00 167 I 7.51 3.58 1.86 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.29 0.67 0.00 0.00 168 E 7.81 4.17 0.00 2.09 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 2.26 2.20 0.00 169 K 8.15 4.34 0.00 1.98 2.06 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.47 7.81 170 E 8.11 3.83 0.00 2.46 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 0.00 2.47 2.47 0.00 *172 R 7.96 4.34 0.00 2.14 2.17 0.00 3.22 0.00 0.00 3.30 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 173 K 8.06 3.89 0.00 1.73 2.06 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.39 7.81 174 L 7.73 3.93 0.00 0.68 0.88 0.72 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 175 F 7.60 4.88 0.00 3.07 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 0.00 176 N 8.07 4.11 0.00 2.85 2.88 0.00 0.00 7.03 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 0.00 177 I 7.80 4.31 1.96 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.83 0.96 0.00 0.00 178 P 0.00 4.18 0.00 2.17 2.01 0.00 3.61 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 2.12 0.00 179 A 8.76 4.11 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 0.00 180 E 7.94 4.28 0.00 2.00 1.86 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 2.19 1.85 0.00 181 R 7.71 4.23 0.00 1.73 2.02 0.00 3.36 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 1.60 1.56 0.00 182 E 8.38 4.92 0.00 2.16 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.61 0.00 183 T 8.64 5.38 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 184 R 9.34 4.53 0.00 1.74 1.35 0.00 2.30 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.21 0.00 185 L 8.03 4.97 0.00 1.68 1.36 1.02 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 186 W 9.25 5.28 0.00 3.51 3.30 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 0.00 187 N 9.44 4.95 0.00 2.95 3.01 0.00 0.00 6.43 7.98 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 0.00 188 K 8.70 3.95 0.00 1.70 1.58 0.00 1.82 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.79 0.21 7.81 189 Y 7.47 4.45 0.00 3.02 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 *191 S 7.63 4.25 0.00 3.81 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 0.00 192 N 7.74 5.14 0.00 2.73 2.60 0.00 0.00 6.52 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 0.00 193 T 7.40 4.64 3.70 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 0.86 0.00 0.00 194 Y 8.31 4.97 0.00 2.65 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 0.00 195 E 9.56 5.05 0.00 2.30 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 2.30 0.00 196 Q 8.87 4.03 0.00 0.98 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.73 0.00 0.00 0.00 0.00 0.00 1.85 1.46 0.00 197 L 8.64 4.46 0.00 1.50 1.53 0.90 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 198 S 8.51 4.48 0.00 3.81 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 K 7.61 4.27 0.00 1.76 1.76 0.00 1.65 0.00 0.00 1.78 0.00 0.00 2.90 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.48 1.37 7.81 200 L 7.96 4.13 0.00 1.68 1.68 0.89 1.04 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 0.00 201 D 8.00 4.38 0.00 2.70 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 0.00 202 N 7.67 4.83 0.00 3.08 2.94 0.00 0.00 6.66 7.12 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 0.00 203 T 8.17 4.56 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 1.20 0.00 0.00 204 I 8.21 3.83 1.86 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 1.43 1.21 0.88 0.00 0.00 205 Q 7.62 3.92 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.69 0.00 0.00 0.00 0.00 0.00 2.36 2.58 0.00 206 D 7.75 4.53 0.00 2.83 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 0.00 207 A 7.50 4.40 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 0.00 208 G 8.34 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 L 7.72 4.39 0.00 1.66 1.67 0.88 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 210 Y 8.55 4.56 0.00 2.95 2.90 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 0.00 211 Q 8.54 4.35 0.00 2.10 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.03 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 212 G 9.24 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 0.00 0.00 0.00 0.00 213 Q 7.73 4.05 0.00 2.59 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.76 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 214 V 8.41 4.70 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.94 0.00 0.00 215 L 9.15 5.48 0.00 1.66 1.59 0.89 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 216 V 9.17 4.96 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 1.27 0.00 0.00 0.99 0.00 0.00 217 I 8.56 4.84 1.99 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 1.22 1.73 1.06 0.00 0.00 218 E 9.28 4.94 0.00 2.31 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 2.59 2.44 0.00 219 P 0.00 5.01 0.00 1.96 1.97 0.00 3.79 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 2.11 2.12 0.00 220 Q 9.04 2.90 0.00 0.93 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.83 0.00 0.00 0.00 0.00 0.00 1.84 1.31 0.00 221 N 8.04 4.28 0.00 2.84 2.72 0.00 0.00 6.75 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 0.00 222 E 8.64 3.99 0.00 1.98 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 2.23 1.88 0.00 223 D 7.84 4.46 0.00 2.72 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 0.00 224 G 7.57 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.62 4.06 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 226 W 8.32 4.89 0.00 3.29 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 0.00 227 P 0.00 4.46 0.00 2.09 2.00 0.00 4.24 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.11 0.00 * Residues marked with a * may have inaccurate shift predictions.