NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.3079 7.8827 121.4507 61.1726 38.8301 173.8178 17 V 4.4487 8.5941 125.2692 61.6486 33.2677 174.3884 18 G 3.9013 8.4621 113.5706 46.3826 0.0000 173.3650 19 G 4.1833 7.7168 109.6556 44.1366 0.0000 172.3536 20 Y 4.9634 7.7500 116.7146 55.2469 42.3136 174.6999 21 T 4.3108 8.5900 116.8290 63.8090 68.3288 175.5178 22 C 4.3040 8.6914 125.5316 59.4845 35.6085 175.4727 23 G 4.0434 8.6269 105.9889 44.6512 0.0000 172.6862 24 A 4.1572 8.6219 125.5080 54.0258 18.5942 176.8056 25 N 4.2507 8.8502 119.2950 54.4142 36.3312 175.4775 26 T 4.1846 7.5851 108.2031 62.8576 69.9881 175.1222 27 V 4.0483 7.0779 122.3920 60.0623 31.3211 173.6153 28 P 4.5824 0.0000 0.0000 63.6617 32.0362 178.1044 29 Y 4.9283 6.7601 115.8162 56.3735 38.8270 174.7504 30 Q 4.5769 7.2113 123.0789 56.3944 29.5361 175.4212 31 V 4.8782 8.9880 118.4605 59.6571 36.4778 174.1342 32 S 4.9455 8.7014 116.5380 56.5831 65.2050 172.5269 33 L 4.6387 8.4467 127.1488 53.0147 43.6411 174.9462 34 N 5.9100 8.8694 122.2301 50.0041 42.2660 174.9103 *37 S 4.5432 8.4847 120.0292 58.5427 64.2213 174.4926 38 G 4.0484 9.3849 108.8443 46.2369 0.0000 173.0857 39 Y 4.4910 6.7313 115.3786 56.3449 39.9818 172.4279 40 H 4.6319 8.8248 121.4099 55.8263 30.4311 174.6616 41 F 5.0079 7.6908 120.2108 57.1177 39.9153 173.9344 42 C 4.7826 6.8998 114.9420 56.1341 44.9427 173.0321 43 G 4.3387 8.4797 108.8837 45.1940 0.0000 172.2748 44 G 4.4553 7.7267 103.0510 46.3581 0.0000 172.6324 45 S 5.4574 8.8059 115.6771 56.4077 66.8164 173.5952 46 L 4.6980 9.1118 127.3067 54.7180 42.3210 177.0282 47 I 4.5017 8.6012 119.8707 61.1495 39.0653 174.5991 48 N 4.8438 7.6409 117.4405 51.7955 39.6980 175.1028 49 S 4.2911 8.6844 112.3268 60.4265 63.1867 174.7318 50 Q 4.5427 9.3368 121.3693 55.2823 30.9400 174.2061 51 W 5.5875 8.4759 117.4614 55.4008 33.5644 174.3549 52 V 5.2020 9.0723 122.7224 61.0509 34.9065 174.3716 53 V 4.9380 8.8358 125.1548 60.4715 33.8175 174.8190 54 S 4.9160 9.0022 116.9080 57.8202 65.9826 171.9997 55 A 4.7553 8.5087 120.0321 50.3977 20.9711 178.2143 56 A 3.8206 8.2969 124.1766 55.3574 18.4317 179.3075 57 H 4.5172 8.3642 109.2308 57.3276 28.5856 175.3172 58 C 4.6963 7.7545 117.1502 57.2475 40.6926 173.4270 59 Y 4.0931 7.6906 121.9134 57.6290 38.7710 175.1016 60 K 3.6538 6.3279 123.1947 56.5023 34.4129 173.9732 61 S 4.3612 8.2362 114.3247 57.8657 65.0095 173.1664 62 G 3.6019 8.3994 105.8456 46.7517 0.0000 173.6053 63 I 4.6234 7.3838 118.7914 59.2866 40.1547 175.6222 64 Q 4.7790 8.6943 127.5208 54.1923 31.8485 174.0795 65 V 4.3967 8.8443 126.8554 61.6958 33.6511 174.5727 65A R 5.0367 8.8825 127.1714 54.6910 32.4979 175.1626 66 L 4.6817 9.0350 124.8149 52.8087 44.6730 177.2697 *69 G 4.1181 8.2154 105.7458 46.3369 0.0000 172.8598 70 E 4.6369 8.4241 118.7522 55.3139 30.3786 174.2438 71 D 4.7331 7.7820 117.1385 54.9854 44.1937 174.0681 72 N 5.0976 8.5163 119.8923 52.7101 39.2658 176.2000 73 I 3.8756 8.4674 119.9205 62.1815 37.8832 176.2321 74 N 4.7765 8.6266 118.0400 53.0206 39.3266 174.7367 75 V 4.3343 7.3259 116.8114 60.7071 34.2086 174.8037 76 V 4.1696 8.4247 126.7863 62.3567 31.5232 175.1494 77 E 4.4682 9.1758 126.3273 55.2279 30.9735 176.6240 78 G 3.9698 8.5467 106.5303 46.0551 0.0000 174.1631 79 N 4.5892 9.0021 116.7170 52.6726 36.4683 174.2502 80 E 4.8092 7.5933 117.2244 56.1265 30.8951 176.1628 81 Q 4.4160 8.9640 121.0022 54.2943 32.8996 174.0143 82 F 5.5138 8.8976 122.9620 55.9903 41.0021 175.1014 83 I 4.6900 8.7510 124.8255 59.3954 40.8312 175.6574 84 S 4.6403 8.6293 121.6054 58.1505 64.3905 173.1432 85 A 4.4101 8.1757 124.7286 52.0923 18.4933 177.7021 86 S 4.4316 9.0675 117.9330 60.4956 63.3726 174.3730 87 K 4.6969 7.5194 116.0139 55.9033 35.5979 174.7316 88 S 5.2315 8.7849 117.1052 56.9800 66.2839 173.8125 89 I 4.4846 9.2431 125.5704 59.4807 38.8487 174.9597 90 V 4.2153 8.2892 127.0632 62.0824 32.7052 175.3102 91 H 3.8652 8.5609 126.3121 55.7191 30.1096 174.6080 92 P 4.3233 0.0000 0.0000 65.2998 31.3313 177.1528 93 S 4.7309 7.8997 112.1371 58.1978 63.0400 173.3375 94 Y 4.3317 8.0471 122.9112 57.5198 39.0826 174.3129 95 N 4.5918 8.0030 125.0175 51.3320 40.0567 175.1304 96 S 3.9407 7.7770 120.3186 59.7237 63.4777 175.0910 97 N 4.4259 8.4763 119.1703 54.9296 38.6793 175.9697 98 T 4.0856 7.7116 105.6358 60.4883 70.3013 174.4826 99 L 3.7759 7.8607 121.0307 55.6565 39.7694 173.9277 100 N 4.5370 7.6684 117.2090 54.4282 39.7072 174.3832 101 N 5.0360 8.6586 119.6071 54.2279 35.9096 175.5395 102 D 4.7260 7.9076 117.5042 52.9955 39.6666 174.9507 103 I 4.8130 7.1069 120.8128 59.3268 42.4313 173.1720 104 M 5.4227 9.2089 126.6147 54.1516 36.3102 173.3573 105 L 5.4118 9.0937 124.1002 53.1446 45.2758 175.4298 106 I 5.0296 8.9359 122.7844 59.4738 40.8638 174.3189 107 K 3.7228 8.7832 128.3548 54.5113 33.9108 175.3253 108 L 4.4991 7.9872 126.9009 53.5294 42.4890 176.8482 109 K 4.0485 8.7699 124.2160 59.2544 32.5592 176.9800 110 S 4.6551 7.7042 112.2994 56.2564 67.0081 173.1289 111 A 4.5207 8.2879 123.0171 51.8852 19.0327 177.2712 112 A 4.4815 8.7430 122.3235 51.4885 20.3008 177.1779 113 S 4.6207 9.0320 116.2111 57.3588 63.8060 174.4966 114 L 4.8469 8.4392 125.0035 53.7416 43.9053 176.2813 115 N 4.5364 8.8372 120.1451 53.1057 40.1782 175.4602 116 S 4.4727 8.7549 109.6247 59.6360 64.0261 175.5111 117 R 4.2310 9.0583 120.4924 56.9669 30.7591 176.2134 118 V 4.6390 7.8475 117.0597 60.8721 33.9885 173.6400 119 A 5.0441 8.5153 127.4553 50.8801 23.0921 175.2413 120 S 5.0177 8.6144 114.3645 57.5597 65.1505 172.9826 121 I 4.5236 8.0537 120.1436 59.1723 39.8821 175.3203 122 S 4.4774 8.3563 122.9115 57.8882 63.8427 173.9669 123 L 4.3247 8.0753 122.9253 53.4071 42.4893 175.1760 124 P 4.6037 0.0000 0.0000 62.7446 32.6230 176.0214 125 T 4.2335 8.1852 107.8904 62.1076 70.3236 174.4184 *127 S 4.9500 7.5808 114.6305 58.1886 63.9949 173.8260 128 C 4.4724 8.3850 117.9385 56.3989 40.8938 173.3200 129 A 4.4968 7.9498 123.9455 51.3342 20.1194 176.8854 130 S 4.5073 7.9920 114.5761 56.6915 65.4837 173.6772 *132 A 4.3117 8.1725 124.0773 53.2981 19.2795 176.4971 133 G 4.0841 9.0656 109.1146 45.6040 0.0000 174.8095 134 T 3.9284 7.5866 116.7492 63.8205 69.4951 173.2886 135 Q 4.7219 8.5518 127.0876 55.3303 30.3918 175.1056 136 C 5.2986 9.3208 122.8122 55.0782 46.4822 172.2403 137 L 5.2875 8.9641 122.1696 53.4848 44.2526 175.0400 138 I 5.3105 9.1195 126.9235 58.7546 40.3457 174.7519 139 S 4.9592 9.0730 119.2246 56.0630 66.7515 173.1761 140 G 3.9803 7.1231 110.4665 45.5493 0.0000 172.3642 141 W 4.7345 8.3145 117.0024 56.4273 29.7317 177.0808 142 G 4.2399 8.3424 108.0550 44.8285 0.0000 173.6040 143 N 4.0781 8.8696 119.0696 54.3653 39.0138 174.6944 144 T 5.1347 8.4633 113.2555 60.4809 69.6414 174.2195 145 K 4.6480 7.8491 121.3054 54.8033 34.8589 176.2017 146 S 4.4307 8.5999 116.3786 59.7828 63.8276 174.5733 147 S 4.4892 8.1007 116.6966 53.9246 62.5720 172.0178 148 G 4.0575 7.6943 109.5996 43.2246 0.0000 170.3414 149 T 4.5321 8.1485 110.0357 59.7457 70.6684 174.0087 150 S 4.4224 9.4505 121.4481 56.9405 65.4267 171.7816 151 Y 4.9783 8.6804 125.3173 55.6584 39.6071 174.4648 152 P 4.7379 0.0000 0.0000 62.2634 33.2115 175.5359 153 D 4.6331 8.7080 117.2694 55.9508 41.5781 177.3205 154 V 5.6676 7.4012 109.8040 58.5576 34.5338 175.6719 155 L 3.2116 8.2820 124.3205 54.9809 42.8964 175.9249 156 K 4.9177 8.1289 125.0213 54.8810 35.1603 174.5871 157 C 5.3403 8.4419 119.5541 55.1836 43.3422 172.9452 158 L 4.9896 8.6679 122.5470 53.7830 45.6310 174.4869 159 K 5.1351 8.9770 125.2298 55.0692 33.6439 175.6847 160 A 4.9190 9.3790 126.1947 48.9582 23.1629 173.3749 161 P 5.0259 0.0000 0.0000 61.9807 33.8838 175.1518 162 I 4.4218 8.2718 122.5004 61.3225 38.2316 175.7991 163 L 4.8621 8.7271 127.2430 53.1276 43.6497 176.7200 164 S 4.4103 8.3849 114.6240 58.0573 64.0244 175.1430 165 D 4.4499 8.6738 121.6308 57.3930 40.4324 179.1902 166 S 4.1273 8.0155 114.4421 61.6992 63.1904 176.6321 167 S 4.1035 7.8932 118.9734 61.1051 62.5286 175.8472 168 C 4.3200 8.2870 121.1261 59.8828 38.9060 175.9554 169 K 3.9929 8.3923 120.1573 59.5113 31.3578 179.5797 170 S 4.1708 8.3511 114.9383 61.0322 62.7749 175.9826 171 A 4.0557 7.5842 122.4883 53.4153 19.9284 177.2593 172 Y 4.9134 7.8077 113.7686 55.7127 38.3095 173.8240 173 P 4.7538 0.0000 0.0000 63.6715 32.1460 177.8040 174 G 3.9817 9.0525 109.6940 45.9415 0.0000 173.5565 175 Q 4.5527 8.2558 116.6785 55.4339 29.9297 175.2381 176 I 4.4662 7.8318 119.9046 59.8659 38.3294 175.4148 177 T 4.5592 8.2117 115.6712 59.7828 70.9601 174.9722 178 S 4.4393 8.5453 114.0551 59.7616 63.2436 174.1535 179 N 5.0443 8.1905 118.3660 53.3971 38.6710 173.7285 180 M 6.0176 7.9726 116.3243 52.9213 36.2910 174.5114 181 F 5.0644 8.1848 113.8840 56.1428 41.6860 173.5504 182 C 5.5879 9.0536 116.6692 55.7559 39.6105 172.6346 183 A 5.0292 9.1058 122.2868 51.0350 22.5184 176.6584 184 G 3.7257 6.8963 107.4448 44.8014 0.0000 172.0450 184A Y 4.6444 8.2813 119.1093 56.0007 40.8337 176.5012 185 L 4.1937 8.6428 125.4864 57.2482 41.9967 178.6296 186 E 4.0981 8.2255 114.9442 56.8026 29.9672 177.3644 187 G 3.8639 7.6639 106.9097 45.3741 0.0000 171.8851 188 G 4.1478 9.4706 105.4984 44.6356 0.0000 173.7700 188A K 5.0982 7.2172 117.2562 54.7704 35.4504 175.3852 189 D 4.6327 8.8282 123.2696 54.0341 45.7082 174.6393 190 S 4.9563 8.7395 116.4004 57.8436 65.5132 173.0225 191 C 4.7868 9.1568 118.7689 55.4401 44.4266 172.4197 192 Q 4.5308 8.5533 117.9623 57.7866 28.5098 176.7848 193 G 4.3945 9.2241 108.8418 45.9300 0.0000 174.2144 194 D 4.6788 8.3782 118.6547 55.4644 41.6877 176.7331 195 S 4.4547 8.0898 114.9576 60.4646 63.3187 175.0911 196 G 3.9490 8.9344 112.7626 46.4929 0.0000 173.8095 197 G 4.3921 7.9356 107.1975 44.9293 0.0000 171.0177 198 P 5.2269 0.0000 0.0000 62.0240 33.7681 175.6391 199 V 4.5953 8.4200 120.6289 61.4640 34.3195 174.0011 200 V 4.8428 8.7322 128.7425 61.2623 33.9884 173.7492 201 C 5.1350 8.8562 124.3749 55.9348 44.3145 174.4841 202 S 3.6306 9.8759 118.4689 59.6770 60.2391 173.1323 203 G 3.9161 8.4365 103.9856 45.8092 0.0000 174.0368 204 K 4.6773 7.7862 117.8524 52.9088 35.3484 175.5737 *209 L 4.2205 8.2702 122.5223 55.4606 42.2588 175.8479 210 Q 4.5304 8.8799 125.9684 56.5853 30.9334 175.8036 211 G 5.3871 8.0070 104.4946 45.7564 0.0000 171.3963 212 I 5.1584 8.1699 119.3750 58.9078 41.2277 175.3746 213 V 3.7016 8.9741 127.4832 63.7936 31.7936 174.1061 214 S 4.8429 8.4718 120.8790 58.6314 64.4142 174.4739 215 W 5.0042 7.3669 114.3659 56.3639 31.8628 172.3917 216 G 3.9600 8.3605 106.4998 46.8974 0.0000 172.8707 217 S 4.7365 8.1757 116.6305 56.8551 63.5940 173.9314 *219 G 4.2912 8.0599 115.4031 45.5796 0.0000 171.2291 220 C 5.0055 8.1502 114.9496 56.4927 44.2494 173.7754 221 A 4.0516 9.0082 125.2623 53.1343 16.6174 177.0747 221A Q 4.5538 7.3295 117.0694 56.2496 29.8882 176.0263 222 K 4.1704 8.3906 121.6194 57.7869 32.7566 176.4597 223 N 4.2386 9.2487 121.1864 53.9262 37.0245 175.2669 224 K 4.3026 7.4461 118.2470 53.2515 32.0669 173.6270 225 P 4.5896 0.0000 0.0000 62.3545 32.9072 176.6341 226 G 3.7957 8.5224 107.1378 45.6324 0.0000 172.9125 227 V 4.4450 7.4955 121.5963 60.6832 34.1766 174.1055 228 Y 4.8972 8.1828 124.3118 56.0641 42.1626 174.8879 229 T 4.4856 8.5729 119.2176 63.4685 70.2857 174.5256 230 K 5.1143 9.1936 127.9851 55.2768 31.5105 177.1881 231 V 3.9363 8.7132 126.1765 65.9231 31.3856 174.8664 232 C 4.4344 8.3987 112.6318 58.4129 41.3571 174.8762 233 N 4.2746 7.9958 116.5399 54.3812 38.5954 175.5560 234 Y 4.8072 8.1282 117.6695 57.3711 38.9052 177.2667 235 V 3.6952 7.9434 121.3480 66.2371 31.5759 177.9293 236 S 4.1342 8.1090 113.4259 61.0545 62.8923 176.0837 237 W 4.1168 8.2632 131.4719 60.2417 30.5175 177.6759 238 I 3.0774 8.2698 119.9974 64.2136 36.6110 178.4031 239 K 3.7247 7.9805 119.0362 59.7128 31.7029 179.4749 240 Q 3.8965 8.0370 117.0613 59.0895 28.9897 178.6907 241 T 3.7075 7.6956 117.0843 66.5038 68.4451 176.8148 242 I 2.6518 7.3082 121.7325 64.0061 36.7747 178.3158 243 A 4.0116 7.6208 120.5081 54.3504 18.1366 178.7836 244 S 4.6586 7.3254 109.5253 58.2380 63.5097 174.1150 245 N 4.6730 8.0478 125.4271 53.9271 39.3506 174.0512 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 4.31 1.80 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 0.90 0.94 0.00 0.00 17 V 8.59 4.45 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 1.04 0.00 0.00 0.91 0.00 0.00 18 G 8.46 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 19 G 7.72 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 20 Y 7.75 4.96 0.00 2.93 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 21 T 8.59 4.31 4.31 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 1.25 0.00 0.00 22 C 8.69 4.30 0.00 2.75 3.06 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 23 G 8.63 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.62 4.16 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.85 4.25 0.00 2.84 2.89 0.00 0.00 7.29 7.56 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 26 T 7.59 4.18 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 1.34 0.00 0.00 27 V 7.08 4.05 1.75 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 0.31 0.00 0.00 0.77 0.00 0.00 28 P 0.00 4.58 0.00 2.38 2.44 0.00 3.81 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 2.19 1.96 0.00 29 Y 6.76 4.93 0.00 3.17 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 30 Q 7.21 4.58 0.00 1.81 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.53 0.00 0.00 0.00 0.00 0.00 1.93 2.50 0.00 31 V 8.99 4.88 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 0.76 0.00 0.00 0.98 0.00 0.00 32 S 8.70 4.95 0.00 3.10 3.31 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 33 L 8.45 4.64 0.00 0.48 0.93 0.79 0.14 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 34 N 8.87 5.91 0.00 2.39 2.42 0.00 0.00 6.52 8.14 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 *37 S 8.48 4.54 0.00 3.82 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 38 G 9.38 4.05 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 0.00 0.00 0.00 39 Y 6.73 4.49 0.00 3.04 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 40 H 8.82 4.63 0.00 2.85 3.16 0.00 5.86 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.69 5.01 0.00 3.03 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 42 C 6.90 4.78 0.00 2.37 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 43 G 8.48 4.34 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 44 G 7.73 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 8.81 5.46 0.00 3.82 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 46 L 9.11 4.70 0.00 1.87 1.68 1.08 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.60 4.50 1.90 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 1.55 0.91 0.95 0.00 0.00 48 N 7.64 4.84 0.00 3.01 3.00 0.00 0.00 6.17 7.92 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 49 S 8.68 4.29 0.00 4.05 4.20 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 50 Q 9.34 4.54 0.00 2.04 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.96 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 51 W 8.48 5.59 0.00 3.24 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 9.07 5.20 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 1.13 0.00 0.00 0.98 0.00 0.00 53 V 8.84 4.94 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 1.02 0.00 0.00 54 S 9.00 4.92 0.00 3.88 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.51 4.76 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 56 A 8.30 3.82 0.22 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 57 H 8.36 4.52 0.00 3.35 3.54 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 7.75 4.70 0.00 3.23 3.33 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 0.00 59 Y 7.69 4.09 0.00 3.00 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 6.33 3.65 0.00 1.51 1.35 0.00 0.78 0.00 0.00 1.30 0.00 0.00 2.43 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.67 0.93 7.81 61 S 8.24 4.36 0.00 3.94 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 62 G 8.40 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.38 4.62 1.84 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 1.42 1.15 0.88 0.00 0.00 64 Q 8.69 4.78 0.00 1.99 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.87 0.00 0.00 0.00 0.00 0.00 2.08 2.20 0.00 65 V 8.84 4.40 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 0.93 0.00 0.00 0.88 0.00 0.00 65A R 8.88 5.04 0.00 1.62 1.74 0.00 2.66 0.00 0.00 2.39 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 1.16 0.00 66 L 9.04 4.68 0.00 1.62 1.62 0.95 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 *69 G 8.22 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 70 E 8.42 4.64 0.00 2.09 1.87 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 2.51 2.09 0.00 71 D 7.78 4.73 0.00 2.72 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 72 N 8.52 5.10 0.00 2.77 2.83 0.00 0.00 7.21 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 73 I 8.47 3.88 1.44 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.55 -0.50 0.00 0.00 74 N 8.63 4.78 0.00 2.81 2.88 0.00 0.00 6.64 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 75 V 7.33 4.33 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 0.73 0.00 0.00 0.98 0.00 0.00 76 V 8.42 4.17 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 0.75 0.00 0.00 0.95 0.00 0.00 77 E 9.18 4.47 0.00 1.98 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 2.25 2.41 0.00 78 G 8.55 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 0.00 0.00 0.00 79 N 9.00 4.59 0.00 2.92 3.13 0.00 0.00 6.96 7.67 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 80 E 7.59 4.81 0.00 1.56 1.75 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 2.70 2.60 0.00 81 Q 8.96 4.42 0.00 1.99 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.76 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 82 F 8.90 5.51 0.00 2.77 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 83 I 8.75 4.69 1.87 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 1.25 0.70 0.94 0.00 0.00 84 S 8.63 4.64 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 8.18 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 86 S 9.07 4.43 0.00 3.72 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 87 K 7.52 4.70 0.00 1.87 1.85 0.00 1.59 0.00 0.00 1.94 0.00 0.00 2.85 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.31 1.37 7.81 88 S 8.78 5.23 0.00 4.10 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 89 I 9.24 4.48 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 1.16 1.11 0.00 0.00 90 V 8.29 4.22 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 0.59 0.00 0.00 0.80 0.00 0.00 91 H 8.56 3.87 0.00 2.84 3.09 0.00 5.65 0.00 0.00 0.00 0.00 6.75 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 4.32 0.00 2.05 2.13 0.00 3.11 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.20 0.00 93 S 7.90 4.73 0.00 3.91 3.87 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 94 Y 8.05 4.33 0.00 2.99 2.91 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 95 N 8.00 4.59 0.00 2.59 2.44 0.00 0.00 6.63 6.82 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 96 S 7.78 3.94 0.00 3.94 3.87 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 97 N 8.48 4.43 0.00 2.71 2.79 0.00 0.00 6.75 7.33 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 98 T 7.71 4.09 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 99 L 7.86 3.78 0.00 1.57 1.93 0.75 1.10 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 0.00 100 N 7.67 4.54 0.00 2.75 2.64 0.00 0.00 7.28 6.58 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 0.00 101 N 8.66 5.04 0.00 3.06 2.63 0.00 0.00 7.22 8.27 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 0.00 102 D 7.91 4.73 0.00 3.07 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 0.00 103 I 7.11 4.81 1.45 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 1.35 1.22 0.15 0.00 0.00 104 M 9.21 5.42 0.00 2.23 1.83 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 2.64 0.00 105 L 9.09 5.41 0.00 1.82 1.88 0.22 0.77 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 0.00 106 I 8.94 5.03 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.84 0.88 0.00 0.00 107 K 8.78 3.72 0.00 0.79 1.11 0.00 1.29 0.00 0.00 1.36 0.00 0.00 2.63 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.63 0.21 7.81 108 L 7.99 4.50 0.00 1.49 1.54 0.96 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.77 4.05 0.00 1.78 1.80 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.39 7.81 110 S 7.70 4.66 0.00 3.81 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 0.00 111 A 8.29 4.52 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 0.00 112 A 8.74 4.48 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 0.00 113 S 9.03 4.62 0.00 3.75 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 0.00 114 L 8.44 4.85 0.00 1.65 1.61 0.96 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.84 4.54 0.00 2.72 2.65 0.00 0.00 6.92 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 0.00 116 S 8.75 4.47 0.00 4.01 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 9.06 4.23 0.00 2.05 2.02 0.00 3.12 0.00 0.00 3.10 7.38 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.58 4.95 0.00 4.00 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 0.00 128 C 8.39 4.47 0.00 2.94 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 0.00 129 A 7.95 4.50 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 7.99 4.51 0.00 3.82 3.71 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 *132 A 8.17 4.31 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 0.00 133 G 9.07 4.08 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 0.00 0.00 0.00 134 T 7.59 3.93 4.16 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 0.00 0.00 1.14 0.00 0.00 135 Q 8.55 4.72 0.00 2.02 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.88 0.00 0.00 0.00 0.00 0.00 2.31 2.46 0.00 136 C 9.32 5.30 0.00 2.77 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 0.00 137 L 8.96 5.29 0.00 1.76 1.55 1.02 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.12 5.31 1.89 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 1.56 1.03 0.00 0.00 139 S 9.07 4.96 0.00 3.49 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 0.00 140 G 7.12 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 0.00 0.00 0.00 141 W 8.31 4.73 0.00 3.04 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 0.00 142 G 8.34 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 0.00 143 N 8.87 4.08 0.00 2.32 2.66 0.00 0.00 7.00 7.59 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 0.00 144 T 8.46 5.13 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 1.27 0.00 0.00 145 K 7.85 4.65 0.00 1.86 1.69 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.29 1.32 7.81 146 S 8.60 4.43 0.00 3.97 4.08 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 0.00 147 S 8.10 4.49 0.00 3.83 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 0.00 148 G 7.69 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 0.00 0.00 0.00 149 T 8.15 4.53 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 150 S 9.45 4.42 0.00 3.75 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 0.00 151 Y 8.68 4.98 0.00 2.96 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 4.74 0.00 2.43 2.12 0.00 4.18 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.04 0.00 153 D 8.71 4.63 0.00 2.80 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 0.00 154 V 7.40 5.67 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.97 0.00 0.00 155 L 8.28 3.21 0.00 1.32 1.27 -0.79 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.13 4.92 0.00 1.67 1.50 0.00 1.61 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 1.41 1.47 7.81 157 C 8.44 5.34 0.00 1.47 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.67 4.99 0.00 1.70 1.46 1.02 1.05 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 0.00 159 K 8.98 5.14 0.00 1.81 1.82 0.00 1.84 0.00 0.00 1.77 0.00 0.00 2.77 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.64 7.81 160 A 9.38 4.92 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 0.00 161 P 0.00 5.03 0.00 2.02 2.28 0.00 3.13 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.76 0.00 162 I 8.27 4.42 1.73 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.45 0.72 0.00 0.00 163 L 8.73 4.86 0.00 1.54 1.61 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.38 4.41 0.00 4.00 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 8.67 4.45 0.00 2.77 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 0.00 166 S 8.02 4.13 0.00 4.05 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 0.00 167 S 7.89 4.10 0.00 3.85 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 0.00 168 C 8.29 4.32 0.00 3.22 3.33 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 0.00 169 K 8.39 3.99 0.00 1.98 1.89 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.65 7.81 170 S 8.35 4.17 0.00 3.97 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 0.00 171 A 7.58 4.06 1.08 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 0.00 0.00 172 Y 7.81 4.91 0.00 3.14 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 0.00 173 P 0.00 4.75 0.00 2.21 2.11 0.00 3.56 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.95 0.00 174 G 9.05 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 0.00 0.00 0.00 175 Q 8.26 4.55 0.00 2.44 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 7.01 0.00 0.00 0.00 0.00 0.00 2.28 2.52 0.00 176 I 7.83 4.47 1.99 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 1.89 0.99 1.00 0.00 0.00 177 T 8.21 4.56 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 1.28 0.00 0.00 178 S 8.55 4.44 0.00 4.01 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 N 8.19 5.04 0.00 3.06 3.11 0.00 0.00 6.67 7.86 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 0.00 180 M 7.97 6.02 0.00 1.83 1.98 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 2.43 0.00 181 F 8.18 5.06 0.00 2.97 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 9.05 5.59 0.00 2.99 3.10 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 0.00 183 A 9.11 5.03 1.18 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 0.00 184 G 6.90 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 0.00 0.00 0.00 184A Y 8.28 4.64 0.00 2.99 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 0.00 185 L 8.64 4.19 0.00 1.73 1.73 0.92 0.87 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 8.23 4.10 0.00 2.10 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 0.00 2.33 2.26 0.00 187 G 7.66 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 0.00 188 G 9.47 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188A K 7.22 5.10 0.00 1.47 1.66 0.00 0.82 0.00 0.00 1.38 0.00 0.00 2.43 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.19 1.13 7.81 189 D 8.83 4.63 0.00 2.80 2.55 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 0.00 190 S 8.74 4.96 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 9.16 4.79 0.00 2.94 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 0.00 192 Q 8.55 4.53 0.00 2.43 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.16 5.42 0.00 0.00 0.00 0.00 0.00 2.52 2.63 0.00 193 G 9.22 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.38 4.68 0.00 2.99 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 8.09 4.45 0.00 3.97 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 0.00 196 G 8.93 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 0.00 197 G 7.94 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.23 0.00 2.30 2.32 0.00 3.70 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.22 0.00 199 V 8.42 4.60 2.28 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 0.82 0.00 0.00 0.73 0.00 0.00 200 V 8.73 4.84 2.11 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 0.85 0.00 0.00 0.61 0.00 0.00 201 C 8.86 5.13 0.00 2.78 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 0.00 202 S 9.88 3.63 0.00 3.92 3.87 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 0.00 203 G 8.44 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 7.79 4.68 0.00 1.69 1.63 0.00 1.89 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.40 7.81 *209 L 8.27 4.22 0.00 1.51 1.64 1.00 0.75 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 0.00 210 Q 8.88 4.53 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.36 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 211 G 8.01 5.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.17 5.16 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.77 1.01 0.00 0.00 213 V 8.97 3.70 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 0.94 0.00 0.00 1.20 0.00 0.00 214 S 8.47 4.84 0.00 3.88 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 0.00 215 W 7.37 5.00 0.00 3.35 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 0.00 216 G 8.36 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 0.00 217 S 8.18 4.74 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 *219 G 8.06 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 0.00 0.00 0.00 0.00 220 C 8.15 5.01 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 0.00 221 A 9.01 4.05 1.38 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 221A Q 7.33 4.55 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.14 6.95 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 222 K 8.39 4.17 0.00 1.73 1.71 0.00 1.94 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.55 7.81 223 N 9.25 4.24 0.00 2.82 2.83 0.00 0.00 6.76 7.49 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 0.00 224 K 7.45 4.30 0.00 1.69 1.84 0.00 1.72 0.00 0.00 1.40 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.50 7.81 225 P 0.00 4.59 0.00 2.15 2.12 0.00 3.66 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 2.17 2.00 0.00 226 G 8.52 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 0.00 227 V 7.50 4.45 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 0.37 0.00 0.00 -0.76 0.00 0.00 228 Y 8.18 4.90 0.00 1.43 2.34 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 0.00 229 T 8.57 4.49 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 0.00 230 K 9.19 5.11 0.00 2.13 1.92 0.00 1.81 0.00 0.00 1.79 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.65 7.81 231 V 8.71 3.94 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 1.11 0.00 0.00 1.11 0.00 0.00 232 C 8.40 4.43 0.00 3.17 3.24 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 0.00 233 N 8.00 4.27 0.00 2.43 2.42 0.00 0.00 6.95 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 0.00 234 Y 8.13 4.81 0.00 3.17 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 V 7.94 3.70 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 1.11 0.00 0.00 236 S 8.11 4.13 0.00 4.15 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 0.00 237 W 8.26 4.12 0.00 3.52 3.71 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 0.00 238 I 8.27 3.08 2.02 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.10 0.75 0.00 0.00 239 K 7.98 3.72 0.00 1.92 1.78 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.59 7.81 240 Q 8.04 3.90 0.00 1.91 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.96 0.00 0.00 0.00 0.00 0.00 2.36 2.56 0.00 241 T 7.70 3.71 3.48 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 0.78 0.00 0.00 242 I 7.31 2.65 1.35 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.22 0.38 0.00 0.00 243 A 7.62 4.01 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 7.33 4.66 0.00 4.04 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 0.00 245 N 8.05 4.67 0.00 3.05 3.00 0.00 0.00 6.75 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 * Residues marked with a * may have inaccurate shift predictions.