NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2804 7.8827 121.4442 61.2209 38.7438 173.8140 17 V 4.3187 8.6367 125.9665 61.8353 32.7332 174.3742 18 G 3.7957 8.4423 113.9681 46.7477 0.0000 173.3171 19 G 4.3798 7.8686 110.4107 44.0683 0.0000 172.6051 20 Y 4.9508 7.9109 117.2543 55.2782 42.2642 175.0912 21 T 4.3674 8.5858 117.0776 63.6920 68.3674 175.1007 22 C 4.0986 8.4792 125.7439 60.0768 35.1506 175.8348 23 G 4.0218 8.4923 105.0287 44.6843 0.0000 172.6243 24 A 4.2024 8.4681 124.6443 53.6683 18.5828 177.0427 25 N 4.2631 8.8965 119.2306 54.4967 36.1892 175.5101 26 T 4.1281 7.6163 108.4059 63.0132 69.8493 175.0789 27 V 4.0417 7.0700 122.2821 60.1331 31.2751 173.7707 28 P 4.4976 0.0000 0.0000 64.1192 31.9669 178.1997 29 Y 4.9523 6.8197 115.4888 56.5009 38.7826 174.5789 30 Q 4.5127 7.3999 123.7693 56.2229 29.5353 175.2269 31 V 4.7406 8.9028 126.3903 61.3011 34.7930 173.8939 32 S 4.9102 8.9418 120.9815 56.5640 64.9135 172.5901 33 L 4.6222 8.6857 127.6152 53.3764 43.1169 174.9045 34 N 6.0149 9.0180 123.3103 50.2358 41.7635 175.1773 *37 S 4.2749 8.5040 120.9552 58.4721 64.2544 174.5879 38 G 4.0078 9.7607 110.3736 46.6820 0.0000 173.5005 39 Y 4.6147 6.6885 115.2250 55.9750 40.1725 172.9567 40 H 4.6120 8.9106 121.8163 56.2910 30.2455 174.6333 41 F 5.0606 8.1607 121.3427 57.6560 40.2457 174.4122 42 C 4.8059 6.8337 114.4868 55.7655 45.0143 173.7947 43 G 4.2378 8.7448 109.3017 45.9601 0.0000 172.2842 44 G 4.4591 7.6497 103.7652 46.4952 0.0000 172.6293 45 S 5.4187 8.7269 115.4417 56.4302 66.7681 173.7427 46 L 4.8896 9.2632 127.7824 54.8357 42.2439 176.9870 47 I 4.4572 8.4603 120.1533 60.8456 38.5546 174.4849 48 N 4.5657 7.5614 117.5667 52.3078 39.4381 175.0526 49 S 4.2442 8.5511 111.9669 60.8217 63.1285 175.0623 50 Q 4.6359 8.2145 117.4024 55.0401 31.0763 174.8173 51 W 5.4287 8.2812 119.2532 54.7207 33.2161 174.3862 52 V 5.0914 9.1621 124.0953 61.0362 34.2118 174.2952 53 V 4.9377 8.9919 127.5382 60.4369 33.5614 174.8867 54 S 5.2644 9.2040 118.9126 56.9252 66.5761 171.5048 55 A 4.7533 8.6928 120.0524 50.0945 19.7341 179.0116 56 A 3.7186 8.5545 124.9874 55.2508 18.4940 178.9775 57 H 4.5492 8.5072 109.7956 57.4451 28.6145 175.3514 58 C 4.6862 7.8786 117.2276 57.1480 40.4725 173.2161 59 Y 4.2620 7.8775 122.3676 57.9194 38.6445 175.4715 60 K 4.1049 7.4989 124.6312 54.5508 36.3999 175.4986 61 S 4.2548 7.9635 114.8993 58.3281 63.6189 173.3747 62 G 3.6825 8.3661 110.7388 46.6051 0.0000 174.0457 63 I 4.1903 7.4515 119.6040 60.7251 39.0474 175.7068 64 Q 4.7534 9.0928 128.6600 54.2829 31.1781 174.2832 65 V 4.2743 8.7908 127.6225 62.2758 33.2084 174.6887 66 R 5.0986 9.1563 127.8000 54.8350 31.9991 175.5347 67 L 4.6503 9.1988 125.0860 52.9596 44.4041 177.7944 *69 G 4.1118 8.2400 107.1841 45.4006 0.0000 172.9718 70 E 4.3566 8.1860 118.3864 55.7947 29.6490 174.2603 71 D 4.8219 7.9397 117.3693 55.3615 43.8844 174.4917 72 N 5.0870 9.2374 122.8186 52.8267 38.8210 176.1983 73 I 3.9100 8.3648 120.0122 62.2830 37.7904 176.3446 74 N 4.7884 8.6497 117.9771 53.2325 39.6150 175.1703 75 V 4.3562 7.3775 110.6151 59.1183 34.8609 175.6729 76 V 4.0590 8.4484 124.0091 62.8948 30.6840 175.2578 77 E 4.4020 9.4932 127.5437 55.3969 30.2996 176.8961 78 G 3.9575 8.1029 106.4315 45.4271 0.0000 174.3578 79 N 4.8976 8.1600 115.7522 52.9395 40.0541 174.5539 80 E 4.5572 7.9784 118.7435 56.4497 30.7714 176.3352 81 Q 4.3246 8.9118 121.1694 54.2295 32.4348 174.3255 82 F 5.5938 8.7082 123.4611 56.0759 40.6340 175.3078 83 I 4.6511 8.7812 125.2391 59.2703 40.5562 175.8697 84 S 4.7439 8.7091 122.4334 58.2633 64.2808 173.2342 85 A 4.4168 8.4060 125.0801 52.2080 18.3270 177.7797 86 S 4.2908 9.1043 118.0723 60.5935 63.3466 174.4820 87 K 4.6716 7.5697 118.9052 55.0584 35.6030 174.4405 88 S 5.2282 8.7816 120.5934 56.5959 65.4588 173.0373 89 I 4.5967 9.3326 127.4062 59.5311 39.8019 174.7749 90 V 4.1995 8.4265 127.5515 62.0566 32.7196 175.1629 91 H 3.4011 8.6236 126.9013 56.1794 29.8717 174.2082 92 P 4.2711 0.0000 0.0000 65.1962 31.3363 177.1633 93 S 4.6973 7.8181 111.7828 58.0244 63.0840 173.1779 94 Y 4.2474 8.1260 123.4115 57.9227 38.7951 174.5811 95 N 4.3767 8.3478 126.4029 51.3519 39.4288 175.1160 96 S 3.7886 7.6322 120.5373 59.9242 63.5309 175.4366 97 N 4.3761 8.1071 118.8740 55.4518 38.4807 176.0825 98 T 3.9622 7.7455 105.5329 60.7561 69.8568 175.0343 99 L 3.7013 7.8957 120.6545 55.3216 40.0370 173.8870 100 N 4.4486 7.7222 117.9326 54.7127 39.3514 174.7162 101 N 4.9741 8.7753 120.8287 54.3662 36.3679 175.2777 102 D 4.7487 7.8735 116.9631 53.3397 39.5711 174.1534 103 I 4.9140 7.0581 120.6585 59.4243 42.4467 173.2413 104 M 5.4308 9.3718 127.5275 54.0635 36.3422 173.2884 105 L 5.3936 9.2591 124.7726 53.1693 44.8269 175.4605 106 I 4.9437 9.1218 124.0919 59.4156 40.4954 174.3995 107 K 3.6955 8.5271 129.6909 54.9473 33.2351 175.9915 108 L 4.4472 8.2626 128.0457 54.3829 41.8263 177.5021 109 K 4.1020 8.8426 122.6417 59.0845 32.4844 177.6748 110 S 4.6256 7.7228 112.7908 56.0456 66.8369 173.2660 111 A 4.4275 8.4260 124.5473 51.7545 18.6845 177.5486 112 A 4.2129 9.1060 124.8463 52.1686 19.4946 177.8521 113 S 4.4627 9.1000 117.9586 57.3685 63.2511 174.2124 114 L 4.5339 8.4331 126.2510 53.8497 42.1690 176.1323 115 N 5.1972 8.4940 122.7313 51.1753 39.9728 173.8984 116 S 4.2610 8.7771 111.1400 61.5595 62.8733 175.2953 117 R 4.1393 8.0294 118.9434 56.7976 30.7159 175.5560 118 V 4.4352 8.5263 117.1650 60.8431 32.6874 173.6253 119 A 5.2735 8.3736 128.0110 49.8944 22.8835 174.8819 120 S 5.0098 8.6772 113.5349 57.7069 64.9485 173.1656 121 I 4.3885 8.3225 121.8490 59.2132 39.0743 175.5995 122 S 4.3883 8.4082 124.5603 58.3767 64.0576 173.7748 123 L 4.2256 8.3591 123.3915 53.5434 42.3178 175.4366 124 P 4.4949 0.0000 0.0000 63.0469 32.1698 176.1222 125 T 4.1356 8.2798 109.1055 62.9005 70.0383 174.9047 *127 S 4.5458 7.5402 113.7431 57.9358 64.0530 173.6917 128 C 4.4275 8.4420 118.6665 56.2990 40.8067 173.8064 129 A 4.1937 8.2124 126.9548 52.0900 19.0781 177.2216 130 S 4.3642 8.1535 116.6657 57.0522 64.8049 173.3110 *132 A 4.3298 8.2129 123.9134 53.5254 19.1858 177.0643 133 G 4.0246 9.1037 111.3818 45.3753 0.0000 174.2811 134 T 3.9851 7.6402 117.5510 63.5538 69.4327 173.4890 135 Q 4.5969 8.6178 128.0622 55.9156 29.9916 175.3701 136 C 5.2925 9.3201 123.0512 55.0375 46.2183 172.3546 137 L 5.1566 8.9468 122.6341 53.5392 44.0463 174.9721 138 I 5.1959 9.1324 127.5490 58.7918 39.8213 174.9171 139 S 4.8846 8.7272 119.7625 56.3564 66.5425 173.1797 140 G 3.6988 7.4696 108.0643 46.3425 0.0000 172.9712 141 W 4.5853 8.5623 116.8573 56.2707 29.1876 176.9263 142 G 3.9862 8.3928 109.1819 44.3607 0.0000 173.4706 143 N 3.6274 8.2403 118.5695 54.2337 38.8824 174.5544 144 T 5.0126 8.1135 113.5185 60.6313 69.5814 174.4756 145 K 4.6456 7.7709 121.6257 54.7361 34.7090 176.3581 146 S 4.3288 8.6206 116.9906 60.0016 63.6821 174.4300 147 S 4.3973 7.8320 116.2940 57.9626 65.3865 174.3716 148 G 3.8783 9.1417 113.1913 44.6824 0.0000 171.3536 149 T 4.7514 7.9924 114.0454 61.7908 71.5950 174.5532 150 S 4.4058 9.5604 122.2188 58.0111 65.1606 172.2345 151 Y 4.8944 8.7203 125.9981 55.7803 38.8366 174.4208 152 P 4.5929 0.0000 0.0000 62.7829 32.5763 175.9929 153 D 4.6608 8.7071 118.7306 55.5611 41.6199 176.6863 154 V 5.2883 7.4545 110.7235 58.1838 34.6707 175.5387 155 L 3.1857 8.3044 124.1565 55.1735 42.9860 175.9035 156 K 4.8515 8.2556 125.4348 54.8756 34.8877 174.6813 157 C 5.2952 8.7286 120.2954 55.1245 42.3760 172.9870 158 L 4.9340 8.5912 122.7580 53.8980 45.4599 174.5491 159 K 5.1626 9.0691 125.8770 55.3733 33.3370 175.9473 160 A 4.7910 9.0145 126.5275 49.4437 23.1149 173.5144 161 P 4.8245 0.0000 0.0000 62.4888 33.4444 175.5109 162 I 4.4206 8.4651 123.6150 61.3605 37.8917 175.9306 163 L 4.6834 8.7461 127.9902 53.6887 42.8601 177.2614 164 S 4.2785 8.1041 115.4293 58.0621 63.8944 174.7343 165 D 4.3861 8.9784 121.6256 58.0048 40.7201 179.1998 166 S 4.1381 8.0431 114.9436 61.7948 62.9921 176.8121 167 S 4.3611 8.0972 118.1146 60.7678 62.6728 175.7673 168 C 4.2842 8.3624 122.3509 59.7287 41.7325 175.8024 169 K 3.9843 8.5623 120.4813 59.0208 31.4561 179.3249 170 S 4.2630 8.2460 114.4544 60.7349 62.9513 176.3695 171 A 3.8874 7.7604 124.0478 53.7093 19.7285 177.2527 172 Y 4.8213 7.8304 113.9922 55.1333 38.2110 173.1077 173 P 4.5810 0.0000 0.0000 63.6490 31.9832 177.9348 174 G 4.0104 9.0697 110.2175 45.7721 0.0000 173.4664 175 Q 4.5342 8.1188 117.1796 55.8489 30.6943 175.7894 176 I 4.3194 7.8840 119.1508 60.3270 38.3588 175.4208 177 T 4.5921 8.2296 115.3179 59.4236 71.0176 175.3753 178 S 4.1838 8.6165 115.5168 61.1045 62.8889 174.8020 179 N 4.8775 8.2103 117.2350 53.1875 38.4423 173.8421 180 M 5.5620 7.8920 117.5060 53.6093 35.8150 174.7632 181 F 5.1304 8.8488 114.8787 55.7526 42.1603 172.5681 182 C 5.4731 8.9904 116.5105 55.7690 40.9594 172.6688 183 A 5.0332 9.4382 123.0603 51.2371 22.4330 174.7148 184A G 3.7629 7.4190 105.8158 44.4396 0.0000 173.1270 184 Y 4.6634 8.5013 119.4140 55.9944 40.7456 176.4913 185 L 4.0892 8.6151 125.2125 57.2217 42.0458 178.8116 186 E 4.0334 8.2504 118.3749 56.9332 30.1199 177.4422 187 G 3.7740 7.9577 106.5601 45.1486 0.0000 171.6900 188A G 4.1684 9.2154 106.3864 44.8013 0.0000 173.5186 188 K 4.7662 7.5010 117.3953 54.8209 35.3689 175.3055 189 D 4.7695 8.8927 123.7520 53.5987 45.4588 174.1893 190 S 5.0113 8.6765 115.4674 58.0194 65.0095 173.5954 191 C 4.8319 9.5291 119.7126 55.1023 45.6105 172.6569 192 Q 4.3668 8.6051 119.1454 57.7433 28.4171 177.6892 193 G 4.3235 9.2549 111.1600 45.8993 0.0000 174.1581 194 D 4.6241 8.4746 118.8258 55.8202 41.5272 176.7002 195 S 4.4859 8.1152 115.7394 60.5507 63.2719 175.5280 196 G 4.1194 8.9717 112.9146 46.3668 0.0000 173.6775 197 G 4.3644 7.8603 107.6298 44.8028 0.0000 171.4057 198 P 5.0196 0.0000 0.0000 62.5696 33.2674 175.8012 199 V 4.6028 8.8531 121.5681 61.4318 34.1465 174.1030 200 V 4.7449 8.7273 129.1826 61.2936 33.7454 173.6077 201 C 5.1288 8.8387 125.3390 55.6394 43.3044 174.6731 202 S 3.7185 9.7927 120.3285 59.7058 60.1406 173.3388 203 G 3.9216 8.4103 104.5366 45.6081 0.0000 173.8318 204 K 4.6837 7.6019 118.0679 53.1544 35.0174 175.4937 *209 L 4.2777 8.2226 122.5179 55.4170 42.1739 175.8098 210 Q 4.4498 8.9214 126.3355 56.8685 30.6472 175.9808 211 G 5.3447 8.0694 104.2482 45.4427 0.0000 171.5101 212 I 5.1795 8.1404 119.4872 58.8989 41.1357 174.6393 213 V 3.5484 9.0095 127.6673 64.3530 31.7999 174.5361 214 S 4.9943 8.4887 121.0283 58.5725 64.1062 174.7730 215 W 5.0281 7.7537 114.4839 56.1362 32.0163 172.4594 216 G 3.8626 8.4208 106.3301 46.8167 0.0000 173.7989 217 S 4.6681 8.4517 115.4045 56.5526 61.6672 173.2466 *219 G 4.4545 7.8116 116.0854 45.2282 0.0000 170.1344 220 C 4.9976 8.1316 115.7549 56.3572 41.9631 173.7918 221A A 3.8189 9.2342 124.7985 53.1295 16.8619 177.0045 221 Q 4.5234 7.4094 116.3766 56.0032 29.6865 175.8102 222 K 4.1609 8.5313 122.0949 58.2487 32.4976 176.1107 223 N 4.2729 9.3826 121.9599 54.0811 36.9794 175.2650 224 K 4.3617 7.6509 116.5642 53.8406 32.2300 173.7448 225 P 4.6178 0.0000 0.0000 61.9536 33.1851 177.6112 226 G 3.5459 8.4174 107.3625 46.2581 0.0000 172.6627 227 V 4.3590 7.9363 122.8191 60.6477 33.8351 174.0241 228 Y 4.8525 8.1936 124.9395 55.9347 41.8593 175.1062 229 T 4.3232 8.6964 120.3795 63.6756 69.9276 174.3853 230 K 5.1440 9.3676 128.5870 55.0448 30.7776 176.9464 231 V 3.9793 8.7527 124.7677 65.9199 31.4370 174.7512 232 C 4.3820 8.3180 112.4213 58.2336 41.5059 174.9335 233 N 4.1592 8.0721 117.5914 54.7353 38.4955 175.5673 234 Y 4.7985 7.9946 117.3555 57.5141 38.8885 177.3852 235 V 3.6853 7.8988 120.4636 66.3669 31.5692 177.8440 236 S 4.1518 8.1139 114.2218 61.2499 62.7332 176.3246 237 W 4.2082 8.2848 130.5753 60.4765 30.5369 177.7989 238 I 3.0757 8.2796 120.1022 64.2709 36.6052 178.5983 239 K 3.7672 8.2305 119.5046 59.3486 31.6326 179.2134 240 Q 3.8700 7.7978 118.7133 59.4279 29.3789 178.2593 241 T 3.7544 7.4937 116.6145 66.6458 68.1894 176.8840 242 I 2.5844 7.1743 121.4306 63.8097 36.7167 178.3408 243 A 4.1359 7.7402 120.5582 53.9510 18.2412 178.6841 244 S 4.6985 7.4948 110.5462 58.2800 63.9929 173.9575 245 N 4.7125 7.9038 123.7267 53.5082 39.3279 174.0699 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 16 I 7.88 4.28 1.79 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.57 0.87 0.00 0.00 17 V 8.64 4.32 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 0.96 0.00 0.00 0.89 0.00 0.00 18 G 8.44 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 19 G 7.87 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 7.91 4.95 0.00 3.01 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 21 T 8.59 4.37 4.29 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 1.22 0.00 0.00 22 C 8.48 4.10 0.00 2.73 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 23 G 8.49 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.47 4.20 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.90 4.26 0.00 2.88 2.91 0.00 0.00 7.16 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 26 T 7.62 4.13 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 1.23 0.00 0.00 27 V 7.07 4.04 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 0.26 0.00 0.00 0.74 0.00 0.00 28 P 0.00 4.50 0.00 2.38 2.43 0.00 3.82 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 2.16 1.93 0.00 29 Y 6.82 4.95 0.00 3.25 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.40 4.51 0.00 1.78 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.70 0.00 0.00 0.00 0.00 0.00 1.85 2.41 0.00 31 V 8.90 4.74 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 0.91 0.00 0.00 1.07 0.00 0.00 32 S 8.94 4.91 0.00 3.26 3.40 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 33 L 8.69 4.62 0.00 0.60 0.92 0.82 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.02 6.01 0.00 2.49 2.51 0.00 0.00 6.77 8.12 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 *37 S 8.50 4.27 0.00 3.67 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 38 G 9.76 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Y 6.69 4.61 0.00 3.04 2.96 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 40 H 8.91 4.61 0.00 2.91 3.24 0.00 5.86 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.16 5.06 0.00 3.09 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 42 C 6.83 4.81 0.00 2.22 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 43 G 8.74 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 0.00 0.00 0.00 0.00 44 G 7.65 4.46 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 0.00 0.00 0.00 45 S 8.73 5.42 0.00 3.82 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 9.26 4.89 0.00 1.87 1.69 1.05 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.46 4.46 1.89 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 1.60 0.88 0.95 0.00 0.00 48 N 7.56 4.57 0.00 2.94 2.99 0.00 0.00 6.00 7.64 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 49 S 8.55 4.24 0.00 4.20 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 50 Q 8.21 4.64 0.00 2.03 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.90 0.00 0.00 0.00 0.00 0.00 2.23 2.32 0.00 51 W 8.28 5.43 0.00 3.18 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 9.16 5.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.98 0.00 0.00 53 V 8.99 4.94 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 0.74 0.00 0.00 1.07 0.00 0.00 54 S 9.20 5.26 0.00 3.85 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.69 4.75 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 56 A 8.55 3.72 0.40 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 57 H 8.51 4.55 0.00 3.37 3.58 0.00 5.55 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.88 4.69 0.00 3.23 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 59 Y 7.88 4.26 0.00 2.96 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 60 K 7.50 4.10 0.00 1.33 1.18 0.00 1.11 0.00 0.00 1.19 0.00 0.00 2.13 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.88 0.24 7.81 61 S 7.96 4.25 0.00 3.72 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 62 G 8.37 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 63 I 7.45 4.19 1.87 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.66 0.94 0.00 0.00 64 Q 9.09 4.75 0.00 1.98 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.94 0.00 0.00 0.00 0.00 0.00 2.17 2.24 0.00 65 V 8.79 4.27 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 1.00 0.00 0.00 0.91 0.00 0.00 66 R 9.16 5.10 0.00 1.70 1.87 0.00 2.76 0.00 0.00 2.71 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.31 0.00 67 L 9.20 4.65 0.00 1.60 1.64 0.96 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.24 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.19 4.36 0.00 2.18 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.13 0.00 71 D 7.94 4.82 0.00 2.78 2.77 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 72 N 9.24 5.09 0.00 2.82 2.80 0.00 0.00 7.16 8.44 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 73 I 8.36 3.91 1.43 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.52 -0.51 0.00 0.00 74 N 8.65 4.79 0.00 2.81 2.88 0.00 0.00 6.71 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 V 7.38 4.36 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 0.74 0.00 0.00 0.95 0.00 0.00 76 V 8.45 4.06 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 0.81 0.00 0.00 1.02 0.00 0.00 77 E 9.49 4.40 0.00 1.96 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 2.29 2.49 0.00 78 G 8.10 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 0.00 0.00 0.00 79 N 8.16 4.90 0.00 2.75 2.81 0.00 0.00 7.17 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.98 4.56 0.00 1.38 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 2.48 2.46 0.00 81 Q 8.91 4.32 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.20 2.26 0.00 82 F 8.71 5.59 0.00 2.82 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 83 I 8.78 4.65 1.88 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 1.24 0.85 0.91 0.00 0.00 84 S 8.71 4.74 0.00 3.75 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 85 A 8.41 4.42 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 86 S 9.10 4.29 0.00 3.73 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.57 4.67 0.00 1.78 1.45 0.00 1.78 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.48 1.48 7.81 88 S 8.78 5.23 0.00 3.98 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 I 9.33 4.60 2.07 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.87 1.16 0.00 0.00 90 V 8.43 4.20 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 0.65 0.00 0.00 0.76 0.00 0.00 91 H 8.62 3.40 0.00 2.84 3.06 0.00 5.66 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.27 0.00 2.00 2.11 0.00 2.48 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.16 0.00 93 S 7.82 4.70 0.00 3.91 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 0.00 94 Y 8.13 4.25 0.00 2.93 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.35 4.38 0.00 2.58 2.47 0.00 0.00 6.54 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 S 7.63 3.79 0.00 3.96 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 97 N 8.11 4.38 0.00 2.78 2.79 0.00 0.00 6.91 6.88 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 98 T 7.75 3.96 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 99 L 7.90 3.70 0.00 1.36 1.82 0.62 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.72 4.45 0.00 2.78 2.65 0.00 0.00 7.25 6.08 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 0.00 101 N 8.78 4.97 0.00 2.93 2.62 0.00 0.00 7.24 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 0.00 102 D 7.87 4.75 0.00 3.23 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 0.00 103 I 7.06 4.91 1.45 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 1.38 1.20 0.04 0.00 0.00 104 M 9.37 5.43 0.00 2.10 1.81 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.64 0.00 105 L 9.26 5.39 0.00 1.75 1.89 0.96 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.12 4.94 1.92 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 1.19 0.97 0.89 0.00 0.00 107 K 8.53 3.70 0.00 0.79 1.04 0.00 1.25 0.00 0.00 1.34 0.00 0.00 2.68 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.78 0.21 7.81 108 L 8.26 4.45 0.00 1.45 1.58 0.96 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.84 4.10 0.00 1.63 1.84 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.52 7.81 110 S 7.72 4.63 0.00 3.77 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 0.00 111 A 8.43 4.43 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 0.00 112 A 9.11 4.21 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 0.00 113 S 9.10 4.46 0.00 3.74 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 0.00 114 L 8.43 4.53 0.00 1.65 1.64 0.96 1.09 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 0.00 115 N 8.49 5.20 0.00 2.78 2.80 0.00 0.00 7.07 7.26 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 0.00 116 S 8.78 4.26 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 0.00 117 R 8.03 4.14 0.00 1.90 2.01 0.00 3.07 0.00 0.00 3.27 7.39 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.54 4.55 0.00 4.00 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 0.00 128 C 8.44 4.43 0.00 2.94 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 0.00 129 A 8.21 4.19 1.06 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 0.00 0.00 130 S 8.15 4.36 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 *132 A 8.21 4.33 1.22 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 0.00 0.00 133 G 9.10 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.64 3.99 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 1.14 0.00 0.00 135 Q 8.62 4.60 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 136 C 9.32 5.29 0.00 2.79 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 0.00 137 L 8.95 5.16 0.00 1.76 1.56 0.97 1.07 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 0.00 138 I 9.13 5.20 1.86 0.00 0.00 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 0.70 1.37 0.96 0.00 0.00 139 S 8.73 4.88 0.00 3.50 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 0.00 140 G 7.47 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 0.00 0.00 0.00 0.00 141 W 8.56 4.59 0.00 3.19 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 0.00 142 G 8.39 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 0.00 143 N 8.24 3.63 0.00 1.92 2.53 0.00 0.00 7.14 7.28 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 0.00 144 T 8.11 5.01 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 1.26 0.00 0.00 145 K 7.77 4.65 0.00 1.84 1.87 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.30 1.31 7.81 146 S 8.62 4.33 0.00 4.28 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 0.00 147 S 7.83 4.40 0.00 3.83 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 0.00 148 G 9.14 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 0.00 149 T 7.99 4.75 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 1.50 0.00 0.00 150 S 9.56 4.41 0.00 3.85 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 0.00 151 Y 8.72 4.89 0.00 2.90 2.96 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 0.00 152 P 0.00 4.59 0.00 2.49 2.10 0.00 4.09 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.00 0.00 153 D 8.71 4.66 0.00 2.79 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 0.00 154 V 7.45 5.29 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 0.00 155 L 8.30 3.19 0.00 1.77 1.24 0.53 -0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.26 4.85 0.00 1.69 1.51 0.00 1.60 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.47 7.81 157 C 8.73 5.30 0.00 1.44 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 0.00 0.00 0.00 0.00 158 L 8.59 4.93 0.00 1.71 1.47 1.07 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.07 5.16 0.00 1.80 1.82 0.00 1.80 0.00 0.00 1.92 0.00 0.00 2.80 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.50 1.66 7.81 160 A 9.01 4.79 1.11 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 0.00 0.00 161 P 0.00 4.82 0.00 2.01 2.10 0.00 3.09 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.84 0.00 162 I 8.47 4.42 1.86 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.49 0.76 0.00 0.00 163 L 8.75 4.68 0.00 1.66 1.61 0.93 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.10 4.28 0.00 3.83 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 0.00 165 D 8.98 4.39 0.00 2.83 2.75 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 0.00 166 S 8.04 4.14 0.00 3.91 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 S 8.10 4.36 0.00 4.07 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 0.00 168 C 8.36 4.28 0.00 3.21 3.37 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 0.00 169 K 8.56 3.98 0.00 1.86 1.90 0.00 1.75 0.00 0.00 1.75 0.00 0.00 3.27 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.69 7.81 170 S 8.25 4.26 0.00 4.06 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 0.00 171 A 7.76 3.89 1.13 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 0.00 172 Y 7.83 4.82 0.00 3.16 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 0.00 173 P 0.00 4.58 0.00 2.21 2.12 0.00 3.48 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.95 0.00 174 G 9.07 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 8.12 4.53 0.00 2.54 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.67 0.00 0.00 0.00 0.00 0.00 2.31 2.53 0.00 176 I 7.88 4.32 1.97 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 1.84 1.02 0.98 0.00 0.00 177 T 8.23 4.59 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 0.00 178 S 8.62 4.18 0.00 4.00 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 0.00 179 N 8.21 4.88 0.00 2.93 3.09 0.00 0.00 6.60 7.07 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 0.00 180 M 7.89 5.56 0.00 1.86 2.09 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.59 0.00 181 F 8.85 5.13 0.00 3.05 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 0.00 182 C 8.99 5.47 0.00 2.98 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 9.44 5.03 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 184A G 7.42 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 Y 8.50 4.66 0.00 3.08 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 L 8.62 4.09 0.00 1.74 1.73 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.25 4.03 0.00 1.98 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 2.32 0.00 187 G 7.96 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 188A G 9.22 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 0.00 0.00 0.00 188 K 7.50 4.77 0.00 1.69 1.80 0.00 0.97 0.00 0.00 1.48 0.00 0.00 2.56 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.39 1.20 7.81 189 D 8.89 4.77 0.00 2.83 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.68 5.01 0.00 4.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 C 9.53 4.83 0.00 2.87 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 0.00 192 Q 8.61 4.37 0.00 2.30 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.33 0.00 0.00 0.00 0.00 0.00 2.55 2.44 0.00 193 G 9.25 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.47 4.62 0.00 3.01 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 0.00 195 S 8.12 4.49 0.00 3.99 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 G 8.97 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 7.86 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 0.00 0.00 0.00 0.00 198 P 0.00 5.02 0.00 2.33 2.35 0.00 3.69 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.24 0.00 199 V 8.85 4.60 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 0.91 0.00 0.00 0.52 0.00 0.00 200 V 8.73 4.74 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.69 0.00 0.00 201 C 8.84 5.13 0.00 2.81 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 0.00 202 S 9.79 3.72 0.00 3.93 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 0.00 203 G 8.41 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 0.00 204 K 7.60 4.68 0.00 1.72 1.64 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.40 7.81 *209 L 8.22 4.28 0.00 1.50 1.64 0.99 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 8.92 4.45 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.41 0.00 0.00 0.00 0.00 0.00 2.42 2.35 0.00 211 G 8.07 5.34 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 0.00 212 I 8.14 5.18 1.93 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.84 0.99 0.00 0.00 213 V 9.01 3.55 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.22 0.00 0.00 214 S 8.49 4.99 0.00 4.01 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 W 7.75 5.03 0.00 3.30 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 G 8.42 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 0.00 217 S 8.45 4.67 0.00 4.27 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 *219 G 7.81 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.13 5.00 0.00 2.95 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 221A A 9.23 3.82 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 0.00 221 Q 7.41 4.52 0.00 2.34 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.90 0.00 0.00 0.00 0.00 0.00 2.39 2.35 0.00 222 K 8.53 4.16 0.00 1.72 1.73 0.00 1.92 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.48 7.81 223 N 9.38 4.27 0.00 2.82 2.80 0.00 0.00 6.82 7.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 K 7.65 4.36 0.00 1.87 1.78 0.00 1.63 0.00 0.00 1.29 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.48 7.81 225 P 0.00 4.62 0.00 2.13 2.11 0.00 3.74 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.00 0.00 226 G 8.42 3.55 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.94 4.36 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 0.25 0.00 0.00 -0.73 0.00 0.00 228 Y 8.19 4.85 0.00 1.43 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.70 4.32 4.29 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 1.26 0.00 0.00 230 K 9.37 5.14 0.00 2.09 1.88 0.00 1.82 0.00 0.00 1.73 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.68 7.81 231 V 8.75 3.98 2.44 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 1.20 0.00 0.00 1.16 0.00 0.00 232 C 8.32 4.38 0.00 3.17 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 0.00 233 N 8.07 4.16 0.00 2.24 2.37 0.00 0.00 6.84 7.57 0.00 0.00 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 Y 7.99 4.80 0.00 3.23 3.27 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 0.00 235 V 7.90 3.69 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 1.16 0.00 0.00 1.08 0.00 0.00 236 S 8.11 4.15 0.00 3.98 3.94 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 0.00 237 W 8.28 4.21 0.00 3.46 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 0.00 238 I 8.28 3.08 2.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.92 0.72 0.00 0.00 239 K 8.23 3.77 0.00 1.70 1.77 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.68 7.81 240 Q 7.80 3.87 0.00 2.02 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.96 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 241 T 7.49 3.75 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 0.82 0.00 0.00 242 I 7.17 2.58 1.44 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 -0.36 0.58 0.00 0.00 243 A 7.74 4.14 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 0.00 244 S 7.49 4.70 0.00 3.82 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 0.00 245 N 7.90 4.71 0.00 3.09 2.99 0.00 0.00 6.76 7.44 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 * Residues marked with a * may have inaccurate shift predictions.