NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15A A 4.3244 8.1233 122.4627 51.7257 20.6142 175.5599 15B D 4.5892 8.5324 122.2831 53.5191 41.7128 174.8182 16 I 3.8811 9.6328 127.2658 60.5521 37.4353 174.9000 17 I 4.6021 7.8287 127.3402 58.6378 40.2802 176.1059 18 G 3.5893 8.2817 114.0335 47.3818 0.0000 174.5523 19 G 4.6900 9.2295 112.4151 46.4209 0.0000 173.0884 *33 L 4.3704 7.7780 117.9739 54.4303 43.3082 176.3745 34 A 4.7996 8.5831 123.4769 52.3213 19.5988 176.3712 35 Y 5.1669 8.3919 117.2220 55.8003 42.0285 174.0238 36 T 5.2328 8.5093 110.4672 60.3063 72.8399 174.3658 37 M 4.6929 8.5435 116.0268 55.9667 32.1965 174.4624 38 G 3.8252 8.1428 110.9600 45.9718 0.0000 176.3339 39 G 3.9097 7.5619 110.7742 43.3154 0.0000 171.5223 *41 R 4.4320 8.1687 118.0687 56.6932 31.7496 176.3473 42 C 5.0444 8.0171 121.3355 55.5536 45.2448 172.5574 43 S 5.2974 8.6641 115.1687 56.5795 65.7972 174.9987 44 V 2.9238 8.8655 123.6864 63.5834 31.8031 175.5121 44A G 4.1146 8.9608 115.4292 47.3420 0.0000 173.0413 45 F 5.1660 8.0585 114.9471 54.7134 44.5108 173.8787 46 A 4.8930 8.9666 124.4705 52.6232 19.6925 176.1210 47 A 5.2150 9.4073 122.0462 51.3944 23.6739 175.1825 48 T 5.2533 8.9183 109.6526 59.9928 72.1687 174.2917 48A N 4.5934 8.7884 121.5656 51.4028 39.1301 175.6445 48B A 3.9542 7.6346 120.9836 55.0366 18.2944 178.6752 48C S 4.3599 8.2262 109.7608 58.6205 63.2444 174.9805 48D G 3.9184 8.3227 108.9186 45.7011 0.0000 173.4870 49 Q 4.3364 8.4239 119.7493 53.9912 29.7652 174.1755 50 P 4.9048 0.0000 0.0000 62.5954 32.7877 176.5128 51 G 3.8248 8.3051 105.5970 46.7291 0.0000 171.7190 52 F 5.5234 6.8229 113.2651 55.9674 41.6925 174.2591 53 V 4.7789 9.0360 114.1938 61.9475 33.7047 175.6734 54 T 5.1780 8.7283 115.9691 62.0484 71.1644 171.9537 55 A 4.9470 8.8702 123.3338 51.4944 20.0117 179.1550 56 G 3.8549 8.8716 110.4827 48.6568 0.0000 175.3144 57 H 3.9404 8.2229 114.4294 57.1467 28.4214 175.8805 58 C 4.3600 7.7355 117.8766 58.7267 34.7502 174.0780 59 G 3.5459 7.2550 106.2902 44.6633 0.0000 173.3120 59A S 4.5896 7.4234 116.7385 56.1568 64.2378 173.7147 59B V 3.9488 8.0758 121.0803 64.9008 31.6809 176.2509 60 G 4.0266 9.3950 115.9234 45.2963 0.0000 173.3496 61 T 4.2561 7.9212 117.7714 63.8792 69.2881 173.7271 62 Q 5.0507 8.5455 125.1613 54.6753 30.3057 175.7662 59 V 3.7059 6.9550 116.6902 61.7633 35.4927 174.7121 59A S 4.5896 7.4234 116.7385 56.1568 64.2378 173.7147 59B I 3.9988 8.0458 121.7803 63.8008 37.5809 176.3509 60 G 4.0266 9.3950 115.9234 45.2963 0.0000 173.3496 *83 N 5.2741 8.8307 122.6460 52.1507 38.6830 174.2666 84 G 4.3984 7.7125 105.1908 45.5219 0.0000 173.7012 85 R 5.6674 9.2227 119.6481 54.5327 34.5182 174.8685 86 G 4.2248 8.4531 108.4649 45.0040 0.0000 171.1353 87 V 4.8059 8.1897 118.0634 59.6807 35.0975 174.7240 88 F 4.1405 9.3530 123.2505 57.9445 38.3316 174.6716 88A E 4.2429 8.7141 126.4641 57.7772 30.5595 176.8674 89 R 4.4594 7.3906 117.0237 54.3494 34.4631 174.4549 90 S 5.2091 8.2816 115.2302 57.5756 65.7925 173.9713 91 V 4.4510 9.5051 126.9908 61.2737 34.6609 173.9819 *94 F 5.5466 8.9463 128.7675 57.6092 41.0970 173.4884 95 P 3.7337 0.0000 0.0000 62.3980 31.9748 176.2195 *100 G 4.1494 8.2432 101.7452 45.1711 0.0000 172.7705 101 N 5.3345 7.5522 115.2750 51.0535 42.8237 173.6463 102 D 5.6119 8.9208 114.9797 53.6624 41.6535 173.8246 103 A 5.4452 9.1057 122.9457 50.4144 23.6978 175.4831 104 A 5.0169 8.8277 118.4834 51.4379 23.7295 175.2969 105 F 5.0904 8.7819 121.7516 56.4270 42.8085 173.5963 106 V 3.6911 7.4315 126.5423 60.8130 33.1274 174.1730 107 R 4.1372 8.0758 129.1466 54.4874 31.7224 175.4565 108 G 2.3895 8.5085 115.0623 45.8702 0.0000 173.3988 109 T 4.5567 8.0029 114.6697 61.7144 70.6891 174.8061 110 S 4.3993 7.9272 114.2170 58.0523 65.8305 175.2264 111 N 4.2351 8.7299 119.9611 54.8484 35.7916 174.8351 112 F 4.8202 8.1702 114.9777 56.2555 41.5195 177.0015 113 T 4.5878 8.7146 121.9054 61.5954 70.7593 174.2666 114 L 4.5017 8.4595 126.9335 54.7315 43.3087 176.3630 *119 T 4.8840 8.4860 111.2316 61.3702 70.5287 172.8078 120 N 5.2563 8.2739 116.9660 53.0340 37.7103 173.8910 120A L 5.3499 7.8990 117.4455 54.1452 46.1948 176.4773 120B V 4.8476 8.5011 119.9638 61.1196 34.7151 174.6302 120C S 3.9896 9.0629 123.8912 58.1354 62.8795 173.9146 120D R 3.6818 7.6923 124.5619 55.1225 31.2761 178.0749 120E Y 3.4116 6.9825 119.6938 58.5783 38.5365 175.1393 120F N 4.4007 9.3002 130.1392 56.6821 38.8540 174.7353 120G S 4.2791 8.2301 112.9375 58.6344 63.4757 173.9581 120H G 3.8366 7.9683 109.8891 46.4336 0.0000 175.7182 120I G 3.6817 8.1074 109.1613 44.7729 0.0000 171.6988 120J Y 4.9223 8.0234 114.7098 56.1891 42.2150 175.0553 120K A 4.6325 8.9881 124.4985 51.4010 20.8824 176.3538 120L T 5.0363 8.4399 109.8004 60.0527 71.4557 173.8781 121 V 4.6532 9.0221 124.6450 61.6961 33.1610 175.8559 122 S 4.6657 9.4642 122.0084 57.6747 65.3105 174.1669 123 G 4.4775 7.3440 106.5624 46.2806 0.0000 172.3677 124 S 5.0818 7.4445 110.0270 56.5453 63.4365 174.1623 125 S 4.0723 8.8140 118.1180 59.8678 63.3187 174.2092 120I T 4.0717 7.9274 113.9613 61.4729 67.2133 171.4988 120J A 4.6923 8.1434 118.2098 50.7891 23.5150 176.9553 120K P 4.7325 0.0000 0.0000 62.2010 33.8824 175.8538 120L I 4.8563 8.2899 116.1004 59.3527 40.4557 175.5781 121 G 4.4932 9.3221 114.2450 44.5961 0.0000 174.4558 122 S 4.6657 9.4642 122.0084 57.6747 65.3105 174.1669 123 Q 4.8575 7.3340 117.5624 56.8806 32.6861 173.4677 124 V 4.7318 7.1645 113.5270 60.4454 32.5365 175.8623 125 C 4.1523 8.8240 121.0181 59.7678 27.5187 174.2092 138 R 4.4279 8.4880 122.2621 54.2424 32.6830 174.3734 139 S 5.3236 8.8444 120.1680 56.6000 65.0143 172.9517 140 G 4.3947 8.7645 113.8761 44.4007 0.0000 172.7270 141 S 4.4676 8.9386 114.9806 58.9660 63.9877 175.1910 142 T 4.2280 8.5010 118.8310 65.5386 69.4339 176.6478 143 T 4.2095 7.8733 109.8171 62.5192 71.0458 174.3940 *156 G 3.7167 7.4219 108.5120 45.8831 0.0000 173.8078 157 W 5.4052 9.0096 135.0000 56.0572 31.7990 174.6405 158 Y 4.5882 8.5355 124.8890 56.2542 41.2463 174.2887 159 C 5.5791 8.3622 118.9075 55.1812 43.8414 174.1983 160 G 3.9103 8.1556 109.4855 46.5340 0.0000 173.0522 161 T 5.7418 8.8266 114.6682 59.9211 73.0670 173.4439 162 I 4.2109 8.3644 123.3207 61.5358 37.1113 175.7530 163 Q 4.4092 9.0358 126.7957 57.7221 30.1001 175.9827 164 A 4.5340 7.3851 117.2094 51.3241 22.6680 175.6489 165 R 4.6613 8.2170 117.8890 54.6834 33.7214 174.8309 166 N 4.1742 8.4351 112.5098 54.8116 36.0878 174.4837 167 Q 4.5840 8.1578 116.2060 55.0159 31.2437 175.7395 168 T 4.9256 8.3117 119.3644 61.9114 70.5489 174.2615 169 V 4.0759 8.2385 119.0801 59.3648 35.6460 174.7099 170 S 4.6609 8.2346 120.1164 57.2389 64.1507 173.4044 171 Y 4.8103 8.8167 122.5522 55.8713 40.4937 174.8194 *173 P 4.5188 0.0000 0.0000 62.8341 33.1464 178.1814 174 Q 4.1661 8.4908 114.6096 56.5873 29.5220 176.1119 175 G 3.7823 6.7854 104.8407 44.5193 0.0000 171.8497 176 T 4.7494 7.7452 116.5385 62.1380 70.3607 174.7827 177 V 4.4038 8.2884 124.5220 61.5062 34.5507 174.5116 178 H 5.1347 9.1442 124.6849 54.0550 31.5570 174.1681 179 S 3.7506 8.5739 111.4162 59.6995 60.3503 172.7570 180 L 4.5540 7.7489 119.9217 54.8312 43.2959 175.8465 181 T 4.6960 8.1237 117.2254 61.7229 71.0948 173.6387 182 R 4.0228 8.9599 127.8397 55.5888 31.8373 175.1945 183 T 5.0621 8.2184 115.1653 59.7645 72.7836 173.9532 184 S 4.4950 8.3550 115.5356 58.6133 63.7332 174.2719 185 V 4.0044 7.7124 121.3852 62.7165 32.6928 172.9298 *189 C 4.4220 8.8264 119.5048 55.7602 42.6715 172.4266 190 A 4.6100 7.6737 120.2481 51.6081 21.4427 175.4363 191 E 4.7243 9.1108 118.9044 53.4029 33.7054 173.7643 192 P 4.2502 0.0000 0.0000 64.4561 31.6957 175.9849 193 G 4.4421 8.8457 110.3249 46.4873 0.0000 174.5319 194 D 4.4237 8.4250 118.7728 55.5931 41.4700 176.6320 195 S 4.3391 7.9370 115.9221 60.4989 62.9092 175.5402 196 G 4.5035 9.0227 112.9583 46.3692 0.0000 173.6616 197 G 3.9367 7.7825 106.9799 45.4584 0.0000 173.2950 198 S 4.3632 8.3502 116.5714 58.1824 64.2561 173.3510 199 F 5.3687 9.1166 122.8376 55.7708 41.4067 174.2659 200 I 5.1878 8.4394 122.9820 59.4475 41.6341 174.2546 201 S 4.6295 8.9190 124.2170 56.4757 65.9356 174.8638 201A G 3.7684 8.9189 116.8105 47.2844 0.0000 174.3308 *207 T 4.9592 8.5897 113.6091 61.0578 70.8175 171.8740 208 Q 4.7679 8.2199 122.4597 54.3971 30.3644 175.0421 209 A 4.1017 8.8232 126.7918 52.4727 18.6374 176.2250 210 Q 4.3130 9.0057 120.9526 56.7832 31.6077 175.7428 211 G 4.4456 7.0248 102.4876 46.2892 0.0000 171.8023 212 V 5.3475 8.2903 112.5554 59.4097 35.3436 175.9473 213 T 4.4516 9.2337 121.9987 65.0514 68.7817 174.2264 214 S 4.6878 8.9052 121.2167 57.9780 64.5220 174.0256 215 G 4.1437 7.2053 104.2210 47.2572 0.0000 170.6974 216 G 4.1003 7.7868 105.7743 45.8661 0.0000 171.3477 217 S 4.7245 7.9321 113.2637 57.3700 66.3922 175.0542 218 G 3.9499 10.1398 108.4398 45.5251 0.0000 171.2233 219 N 4.8386 8.0087 115.3704 52.7046 40.1763 173.9052 219A C 4.2656 8.9417 116.5316 57.9168 40.1185 175.5670 220 R 4.3307 8.8319 120.2778 57.8352 29.7898 181.6449 222 T 4.3637 8.1909 105.2583 60.5993 70.0627 174.6296 223 G 3.9015 8.9468 109.3327 45.3051 0.0000 172.5279 224 G 4.2241 7.3593 104.1020 46.2419 0.0000 172.4302 225 T 4.9031 8.2832 115.5749 61.9465 72.0950 173.8960 226 T 5.1995 8.4038 120.9794 61.8985 72.7951 172.9540 227 F 5.2670 9.7189 124.2571 55.9197 42.2488 174.2610 228 Y 5.3897 8.3171 118.9422 55.2786 41.9297 173.8618 229 Q 4.8206 9.2830 122.8438 55.0828 30.4104 175.2341 230 E 4.7081 9.0932 126.5215 56.8739 30.4441 178.1117 231 V 3.9528 8.7603 123.1014 64.8219 31.6642 178.5962 232 N 4.3289 8.1757 116.6463 55.7250 38.2907 175.3516 233 P 4.1522 0.0000 0.0000 65.5573 31.3732 178.6290 234 M 3.3662 7.7744 117.0638 58.1994 31.9550 178.4727 235 L 3.9999 7.8293 119.1276 57.8046 41.8268 179.2579 236 N 4.2512 8.3356 116.9400 56.9890 38.8477 177.3463 237 S 4.1693 8.0148 115.3213 60.3567 62.8139 175.8038 238 W 4.9232 7.8289 119.1343 55.0247 29.9723 175.8551 239 N 4.1475 7.7605 115.3782 54.5900 36.0391 173.3144 240 L 4.9961 8.2359 118.7587 53.6468 45.0835 178.9030 241 R 4.6075 8.8252 122.3720 54.6389 32.1508 175.7531 242 L 4.3145 8.5871 127.3976 54.1569 42.9886 176.3954 243 R 4.3143 8.8382 127.6241 56.2048 30.5643 176.4010 244 T 4.7623 8.3924 115.9197 61.9404 68.9678 173.6491 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 15A A 8.12 4.32 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 15B D 8.53 4.59 0.00 2.55 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 16 I 9.63 3.88 1.81 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.54 0.82 0.00 0.00 17 I 7.83 4.60 1.81 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.48 1.01 0.00 0.00 18 G 8.28 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 9.23 4.69 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 *33 L 7.78 4.37 0.00 1.60 1.59 0.88 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.58 4.80 1.21 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 35 Y 8.39 5.17 0.00 3.22 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 36 T 8.51 5.23 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 1.22 0.00 0.00 37 M 8.54 4.69 0.00 2.46 2.20 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.85 0.00 38 G 8.14 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 0.00 0.00 0.00 39 G 7.56 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 0.00 0.00 0.00 *41 R 8.17 4.43 0.00 1.87 1.77 0.00 3.07 0.00 0.00 3.30 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.54 0.00 42 C 8.02 5.04 0.00 2.05 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 43 S 8.66 5.30 0.00 3.72 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 V 8.87 2.92 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 0.46 0.00 0.00 0.24 0.00 0.00 44A G 8.96 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 0.00 0.00 0.00 0.00 45 F 8.06 5.17 0.00 3.15 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 46 A 8.97 4.89 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 47 A 9.41 5.22 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 T 8.92 5.25 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 1.29 0.00 0.00 48A N 8.79 4.59 0.00 2.81 2.68 0.00 0.00 6.80 6.37 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 48B A 7.63 3.95 1.35 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 0.00 0.00 0.00 0.00 0.00 48C S 8.23 4.36 0.00 4.13 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 48D G 8.32 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 49 Q 8.42 4.34 0.00 2.29 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.89 0.00 0.00 0.00 0.00 0.00 2.35 2.30 0.00 50 P 0.00 4.90 0.00 2.43 2.28 0.00 3.77 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 2.07 2.02 0.00 51 G 8.31 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 0.00 0.00 0.00 52 F 6.82 5.52 0.00 3.23 3.12 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 53 V 9.04 4.78 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 1.15 0.00 0.00 1.34 0.00 0.00 54 T 8.73 5.18 4.66 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 1.35 0.00 0.00 55 A 8.87 4.95 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 56 G 8.87 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 0.00 0.00 0.00 57 H 8.22 3.94 0.00 2.05 1.31 0.00 5.56 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.74 4.36 0.00 3.44 3.51 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.25 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 59A S 7.42 4.59 0.00 3.98 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 59B V 8.08 3.95 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 0.83 0.00 0.00 0.96 0.00 0.00 60 G 9.40 4.03 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.64 0.90 0.00 0.00 163 Q 9.04 4.41 0.00 1.89 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.65 0.00 0.00 0.00 0.00 0.00 2.29 2.40 0.00 164 A 7.39 4.53 1.17 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 0.00 165 R 8.22 4.66 0.00 1.74 1.81 0.00 3.36 0.00 0.00 3.21 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.56 0.00 166 N 8.44 4.17 0.00 2.84 2.87 0.00 0.00 6.79 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 Q 8.16 4.58 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.78 0.00 0.00 0.00 0.00 0.00 2.44 2.63 0.00 168 T 8.31 4.93 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 1.03 0.00 0.00 169 V 8.24 4.08 1.21 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 -0.56 0.00 0.00 0.03 0.00 0.00 170 S 8.23 4.66 0.00 3.61 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 0.00 171 Y 8.82 4.81 0.00 3.16 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 *173 P 0.00 4.52 0.00 2.13 2.19 0.00 3.86 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.18 0.00 174 Q 8.49 4.17 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 7.14 0.00 0.00 0.00 0.00 0.00 2.64 2.52 0.00 175 G 6.79 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 0.00 0.00 0.00 176 T 7.75 4.75 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 177 V 8.29 4.40 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 1.28 0.00 0.00 178 H 9.14 5.13 0.00 3.00 3.16 0.00 5.86 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 S 8.57 3.75 0.00 4.03 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 0.00 180 L 7.75 4.55 0.00 1.59 1.66 0.89 0.59 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 0.00 181 T 8.12 4.70 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 0.80 0.00 0.00 182 R 8.96 4.02 0.00 1.69 1.63 0.00 2.96 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.91 0.00 183 T 8.22 5.06 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 1.02 0.00 0.00 184 S 8.35 4.49 0.00 3.87 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 V 7.71 4.00 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 1.03 0.00 0.00 1.02 0.00 0.00 *189 C 8.83 4.42 0.00 3.02 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 0.00 190 A 7.67 4.61 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 0.00 191 E 9.11 4.72 0.00 1.86 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.15 0.00 192 P 0.00 4.25 0.00 2.00 1.99 0.00 3.61 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 193 G 8.85 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 0.00 0.00 0.00 0.00 194 D 8.43 4.42 0.00 2.75 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 0.00 195 S 7.94 4.34 0.00 3.87 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 G 9.02 4.50 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 0.00 197 G 7.78 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 0.00 0.00 0.00 198 S 8.35 4.36 0.00 3.60 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 0.00 199 F 9.12 5.37 0.00 2.83 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 0.00 200 I 8.44 5.19 2.26 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.12 1.24 0.00 0.00 201 S 8.92 4.63 0.00 3.84 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 201A G 8.92 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 *207 T 8.59 4.96 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 1.26 0.00 0.00 208 Q 8.22 4.77 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 7.03 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 209 A 8.82 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 9.01 4.31 0.00 1.83 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.58 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 211 G 7.02 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 0.00 212 V 8.29 5.35 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 1.04 0.00 0.00 1.23 0.00 0.00 213 T 9.23 4.45 4.59 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 1.43 0.00 0.00 214 S 8.91 4.69 0.00 4.11 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 0.00 215 G 7.21 4.14 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 0.00 0.00 0.00 216 G 7.79 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 S 7.93 4.72 0.00 4.02 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 0.00 218 G 10.14 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 0.00 219 N 8.01 4.84 0.00 3.05 2.88 0.00 0.00 7.42 7.84 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 219A C 8.94 4.27 0.00 2.89 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 0.00 220 R 8.83 4.33 0.00 1.77 1.82 0.00 3.23 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.42 0.00 222 T 8.19 4.36 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 223 G 8.95 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 0.00 224 G 7.36 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 T 8.28 4.90 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 0.77 0.00 0.00 226 T 8.40 5.20 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 1.56 0.00 0.00 227 F 9.72 5.27 0.00 3.02 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 0.00 228 Y 8.32 5.39 0.00 3.04 2.60 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 0.00 229 Q 9.28 4.82 0.00 2.42 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.00 0.00 0.00 0.00 0.00 0.00 2.64 2.54 0.00 230 E 9.09 4.71 0.00 2.07 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 2.40 2.30 0.00 231 V 8.76 3.95 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 0.78 0.00 0.00 0.97 0.00 0.00 232 N 8.18 4.33 0.00 2.75 2.90 0.00 0.00 7.16 8.03 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 0.00 233 P 0.00 4.15 0.00 2.06 2.00 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 2.10 2.15 0.00 234 M 7.77 3.37 0.00 2.22 2.32 0.00 0.00 0.00 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.36 0.00 235 L 7.83 4.00 0.00 1.83 1.72 0.95 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 236 N 8.34 4.25 0.00 2.78 2.73 0.00 0.00 7.25 7.95 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 0.00 237 S 8.01 4.17 0.00 3.44 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 0.00 238 W 7.83 4.92 0.00 3.49 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 239 N 7.76 4.15 0.00 2.87 2.81 0.00 0.00 6.88 7.03 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 0.00 240 L 8.24 5.00 0.00 1.47 1.43 0.96 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 241 R 8.83 4.61 0.00 1.41 1.78 0.00 3.27 0.00 0.00 3.09 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.40 0.00 242 L 8.59 4.31 0.00 1.63 1.60 0.94 0.86 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 0.00 243 R 8.84 4.31 0.00 1.94 2.03 0.00 3.34 0.00 0.00 3.33 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.66 0.00 244 T 8.39 4.76 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 1.25 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.