NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2594 7.8827 121.4511 61.2398 38.6264 173.8025 17 V 4.3229 8.7977 126.3197 61.8971 32.6347 174.6081 18 G 3.9389 8.4757 113.8850 46.5542 0.0000 173.6969 19 G 4.1747 7.7261 110.2617 44.6848 0.0000 172.6639 20 Y 4.9509 8.0362 118.0118 55.4205 42.2236 174.9824 21 T 4.2047 8.6012 117.3583 64.1102 68.4058 175.0375 22 C 4.2804 8.5750 125.5247 60.8521 35.4367 174.8860 23 G 4.1007 8.7364 106.2446 43.8687 0.0000 172.6564 24 A 4.2673 8.6895 125.0964 53.6867 18.3613 176.8962 25 N 4.2793 8.8985 119.5243 54.7854 36.1207 175.6120 26 T 4.1656 7.7193 108.0213 62.9908 69.8383 175.0337 27 V 4.1202 7.0714 121.9493 59.7644 31.3196 173.6312 28 P 4.5327 0.0000 0.0000 64.1968 31.7440 178.2793 29 Y 5.0837 6.9987 115.2897 56.8297 38.8393 174.5825 30 Q 4.5889 7.3296 123.6155 56.1974 29.4911 175.4299 31 V 4.8837 8.9917 118.9191 59.6535 36.3596 174.1323 32 S 4.8365 8.7678 116.4804 56.5876 65.1278 172.6158 33 L 4.6370 8.6163 127.4244 53.3337 43.0926 174.8988 34 N 5.7553 8.7955 123.1530 50.2157 41.7509 174.8905 *37 S 4.1674 8.3866 120.4527 58.4585 63.3517 174.0686 38 G 4.0440 9.3334 108.6720 45.2343 0.0000 172.9250 39 Y 4.4730 6.7366 115.5230 56.3570 39.8506 172.3781 40 H 4.6325 8.9651 121.4301 56.2148 30.2558 174.6589 41 F 5.0494 7.9080 119.9519 56.7644 39.6286 173.7504 42 C 4.6008 6.8054 115.1130 56.2918 44.7849 172.8871 43 G 4.2669 8.7199 108.8949 45.4740 0.0000 172.2671 44 G 4.6217 7.9758 105.1441 46.3744 0.0000 172.7775 45 S 5.4379 8.8920 116.1935 56.3375 66.4707 173.5788 46 L 4.7866 9.2743 128.2789 54.9925 42.2815 177.1775 47 I 4.3701 8.5897 119.9983 61.3140 39.2346 174.7016 48 N 4.6970 7.7593 117.1565 51.8079 39.5099 175.1637 49 S 4.2477 8.6708 112.9541 60.9868 63.0143 175.2817 50 Q 4.6032 8.9240 117.9110 55.0988 30.7917 175.0583 51 W 5.5404 8.5965 119.0305 54.8069 33.5904 174.3934 52 V 4.9625 9.1594 123.1409 61.1731 34.6454 174.0982 53 V 4.8404 9.0784 127.2944 61.7868 33.5514 174.7465 54 S 4.7120 9.0206 121.2098 57.5309 66.3114 172.2408 55 A 4.5761 8.4709 121.0102 50.8510 20.1246 178.5303 56 A 3.8068 8.2813 123.6888 55.2086 18.4632 179.2676 57 H 4.5885 8.0943 109.2811 57.2260 28.7889 175.2850 58 C 4.7393 7.8075 117.2736 57.2021 40.3797 173.2239 59 Y 4.2524 7.6786 122.3547 57.6306 38.8534 175.0565 60 K 4.0262 6.9188 125.5341 54.7882 35.1176 175.4052 61 S 4.0290 8.0676 120.0881 59.3411 63.3737 174.0293 62 G 3.8879 8.4768 109.4360 46.5431 0.0000 174.0311 63 I 4.0396 7.5394 119.6769 61.0049 38.6985 175.3374 64 Q 4.7432 8.9819 127.8299 54.1672 31.8431 174.1570 65 V 4.3064 8.8682 127.5586 62.2411 33.3003 174.6891 66 R 4.9916 9.0988 127.6838 54.7937 31.9798 175.2888 67 L 4.7453 9.0973 124.9431 52.6889 44.7511 177.7044 *69 G 3.9169 8.2577 107.7350 45.4076 0.0000 172.7204 70 E 4.4533 8.1873 118.3676 55.3810 30.1845 174.1852 71 D 4.8006 7.8846 117.9615 55.1190 43.7418 174.2901 72 N 4.8205 9.1407 122.9228 52.7075 38.8988 176.2152 73 I 3.7415 8.4134 120.1263 62.2788 37.8395 176.3954 74 N 4.7337 8.3434 117.6942 53.2677 39.3384 175.0218 75 V 4.3463 7.3466 116.7356 60.5859 34.5230 175.0303 76 V 3.9936 8.4338 126.3647 62.9678 30.9744 175.3285 77 E 4.3180 9.7357 127.5972 56.1787 30.1313 177.3758 78 G 4.0573 8.7434 106.8824 45.3542 0.0000 173.7260 79 N 4.9641 7.9820 114.7397 52.5797 40.1009 173.8112 80 E 4.6383 7.8974 117.7212 56.4087 30.9362 176.4734 81 Q 4.3253 9.0049 120.5006 54.6085 32.9343 174.0944 82 F 5.5379 8.8752 123.7510 56.0681 40.6708 175.4802 83 I 4.6483 8.7565 125.1622 59.2608 40.6211 175.7943 84 S 4.6971 8.7132 122.5160 58.2880 64.3035 173.1865 85 A 4.6214 8.4807 125.5661 52.0762 18.1674 177.8142 86 S 4.5173 8.9143 117.7558 59.3899 64.5189 174.6413 87 K 4.6651 7.5253 118.3598 55.3581 36.7046 175.5361 88 S 4.9103 8.6780 118.4719 57.3637 65.9138 173.5718 89 I 4.3855 9.2227 127.7367 59.5113 38.2235 175.6422 90 V 4.1598 8.3184 127.5381 62.2381 32.6774 175.2246 91 H 3.9991 8.7436 127.1429 55.8060 29.9924 174.4682 92 P 4.2871 0.0000 0.0000 65.4445 31.1123 177.0398 93 S 4.6620 7.9757 112.6530 58.0353 63.1262 173.2702 94 Y 4.3542 7.9649 122.9042 57.7840 38.9431 174.9339 95 N 4.4984 8.2940 125.7738 51.4220 40.0371 175.0524 96 S 3.8432 7.9432 120.4405 59.8449 63.6536 174.8916 97 N 4.4437 8.4182 119.2670 55.3562 38.8329 176.2247 98 T 3.9814 7.7930 105.0191 60.9576 69.8146 175.2284 99 L 3.7757 7.9344 120.8939 55.1942 39.8655 173.9295 100 N 4.4559 7.6697 118.3954 54.6884 39.5124 174.5688 101 N 4.9417 8.7085 119.8783 54.2762 35.9863 175.4649 102 D 4.7326 7.9753 117.0275 53.2400 39.3222 174.9371 103 I 4.8234 7.0900 120.6859 59.2964 42.4532 173.4071 104 M 5.4410 9.2748 127.3385 54.0385 36.3553 173.2769 105 L 5.3647 9.2522 125.2078 53.1511 44.7158 175.2786 106 I 4.9834 9.1248 124.8450 59.4100 39.9939 174.5313 107 K 3.5344 8.4314 128.8633 54.7539 33.6485 175.3428 108 L 4.4228 8.0706 127.5937 53.7640 41.9184 176.9519 109 K 4.0802 8.9169 126.0174 58.9659 32.6257 177.1284 110 S 4.6213 7.7282 111.4995 55.6635 66.0388 173.2567 111 A 4.3277 8.4925 124.1915 52.1070 18.6177 177.3346 112 A 4.2362 9.0753 124.8239 51.8711 19.5720 177.3453 113 S 4.4421 9.2772 116.6336 57.3965 62.6960 173.6797 114 L 4.9382 8.6988 127.1722 52.6789 44.6927 174.5374 115 D 4.6163 8.8943 123.4672 54.1420 37.5944 178.0377 116 S 4.6737 9.2187 112.9427 58.4304 64.9611 175.6593 117 R 4.0899 7.9041 119.2121 57.3020 30.2246 175.7517 118 V 4.5331 7.8276 115.6197 60.9757 33.3647 173.6597 119 A 4.8718 8.5705 128.4741 50.3192 22.9960 175.0118 120 S 5.0661 8.7051 113.8050 57.7561 64.8942 173.1270 121 I 4.3862 8.1838 121.6492 59.1165 39.4785 175.5939 122 S 4.3840 8.4255 124.5559 58.4922 64.0035 173.8823 123 L 4.2778 8.3297 122.9409 53.2642 42.5732 175.2113 124 P 4.4897 0.0000 0.0000 63.0072 32.1400 176.4109 125 T 4.1190 8.2520 109.4320 62.7627 69.8804 174.7026 *127 S 4.4159 7.5620 114.5542 57.8644 64.0406 174.0800 128 C 4.3659 8.4045 118.0609 56.7781 40.6255 173.4680 129 A 4.3848 8.0046 125.5515 51.3271 19.5260 177.7733 130 S 4.1964 8.1772 115.7513 57.5545 64.4284 173.1749 *132 A 4.2488 8.2183 123.5987 53.5628 19.2352 177.2377 133 G 3.9719 9.1286 111.0059 45.2614 0.0000 174.1991 134 T 3.9613 7.5745 117.6486 63.6534 69.3991 173.4086 135 Q 4.5129 8.6442 128.1443 55.9682 30.1554 175.3019 136 C 5.2711 9.3514 122.9886 55.0858 44.9997 172.2283 137 L 5.2376 9.0546 122.1103 53.6247 43.7939 174.9136 138 I 5.2955 9.2026 127.5807 58.8484 39.8246 174.9468 139 S 4.9250 8.8627 119.5980 56.2105 66.6999 173.0662 140 G 3.8183 7.2513 108.7004 46.0872 0.0000 172.7460 141 W 4.6706 8.4485 117.0024 56.2783 29.3370 177.1023 142 G 4.1279 8.4491 109.2971 44.3175 0.0000 173.5124 143 N 3.7588 8.8186 118.4768 54.3596 38.9247 174.5420 144 T 5.0728 8.2086 113.4582 60.5502 69.4980 174.3730 145 K 4.6191 7.7123 121.6748 54.6305 34.7080 176.4288 146 S 4.1918 8.7085 117.9262 60.2957 63.4516 174.0711 147 S 4.3840 8.0454 114.4788 59.1720 64.0827 171.0762 148 G 3.8713 8.8727 114.7935 44.2319 0.0000 171.3800 149 T 4.6266 8.0656 114.6681 62.0763 72.5581 174.2539 150 S 4.2560 8.8927 120.6500 58.1009 65.2030 172.4094 151 Y 4.9132 8.4967 125.9292 55.6916 38.9778 174.4751 152 P 4.6245 0.0000 0.0000 62.6167 32.8295 176.1963 153 D 4.5426 8.8369 119.4246 57.0540 41.2743 177.2180 154 V 5.4301 7.4003 109.6589 58.6989 34.1171 175.7800 155 L 3.1265 8.2900 124.2575 55.1703 42.9328 175.9621 156 K 4.8046 8.0978 125.0782 54.9699 34.8730 174.7071 157 C 5.2466 8.7301 119.9276 55.1546 41.3190 172.9552 158 L 4.9753 8.5968 122.6457 53.8611 45.5692 174.4927 159 K 5.1508 8.9991 125.6627 55.3859 33.3694 175.8575 160 A 4.8364 8.8824 125.9137 49.9403 23.1960 173.3642 161 P 5.0700 0.0000 0.0000 61.7450 33.8490 175.3290 162 I 4.2601 8.4096 122.8586 61.6016 38.0437 175.3053 163 L 5.0779 8.7278 126.8018 52.5721 44.1941 176.8406 164 S 4.2863 8.4693 115.4335 58.2052 63.8488 174.9079 165 D 4.4135 8.7816 121.5213 57.4880 40.9097 178.8615 166 S 4.1409 8.0325 114.7031 61.5510 63.1293 176.5756 167 S 4.1611 8.1669 118.2423 60.9492 62.7621 175.6647 168 C 4.3425 8.3836 122.1623 59.5918 41.7007 175.7831 169 K 4.0237 8.3923 120.2266 59.4919 31.3538 179.6397 170 S 4.2400 7.9760 114.7987 61.4395 62.7991 176.2172 171 A 4.0393 7.9126 122.7534 53.7726 19.7547 177.3316 172 Y 4.7723 7.8529 114.5116 54.7758 38.3424 171.9216 173 P 4.5510 0.0000 0.0000 63.2370 32.1524 176.6979 174 G 4.0356 9.0676 110.3710 46.4664 0.0000 173.8558 175 Q 4.5258 8.1416 117.6615 55.2094 31.0557 175.8031 176 I 4.2889 7.9595 119.1632 60.3609 37.9884 175.6381 177 T 4.5092 8.2769 116.1953 59.8490 70.6645 175.3665 178 S 4.3822 8.5409 114.8074 60.1498 63.2656 174.3790 179 N 4.9790 8.2037 118.2120 53.2895 38.6586 173.7071 180 M 5.6279 7.9241 117.0522 53.7520 36.0106 174.8186 181 F 5.1062 8.8018 114.9317 55.9100 41.9525 172.7887 182 C 5.3670 9.0173 117.2838 56.2589 41.0171 172.4003 183 A 5.0168 8.9123 121.8885 51.3109 22.4504 175.9636 184A G 3.7171 6.9768 107.6747 44.6440 0.0000 172.3141 184 Y 4.6736 8.3986 118.8503 55.9365 41.0695 176.5664 185 L 4.1259 8.6892 125.0487 57.4095 41.9801 178.7007 186 E 4.0297 8.2092 114.9836 56.9535 29.9690 177.6350 187 G 3.9324 7.6490 105.4686 45.6121 0.0000 173.2038 188A G 4.0352 9.4305 106.6573 44.5743 0.0000 173.4956 188 K 4.9400 7.3559 117.6116 55.0943 35.4521 175.1004 189 D 4.6208 8.8141 123.4785 53.9018 45.5647 174.6514 190 S 4.9488 8.7884 115.8928 57.8332 65.1185 173.6478 191 C 4.8146 9.5381 119.9350 55.1101 45.7532 172.6217 192 Q 4.2590 8.7518 118.7233 58.0642 28.3486 178.1030 193 G 4.2587 9.2755 110.7991 45.6463 0.0000 173.7990 194 D 4.7120 8.5587 118.9724 55.1713 41.8722 176.7996 195 S 4.5192 8.0662 115.2299 60.4625 63.5541 175.4389 196 G 4.0483 8.8309 112.3813 46.5017 0.0000 173.7972 197 G 4.3936 7.8906 107.3300 45.2223 0.0000 171.1863 198 P 5.1736 0.0000 0.0000 62.2810 33.6848 175.7566 199 V 4.5571 8.4169 120.7250 61.4749 34.3245 173.9010 200 V 4.8767 8.8557 129.0791 61.2504 33.9272 173.6770 201 C 5.0577 8.8131 124.9228 55.4099 43.4677 174.6220 202 S 3.3111 9.6870 121.2745 59.7572 59.9925 173.2824 203 G 3.9083 8.4015 103.9876 45.7165 0.0000 173.6729 204 K 4.7043 7.4988 118.0829 53.0727 34.9436 175.4749 *209 L 4.2314 8.2729 123.3093 55.4072 41.9988 175.7175 210 Q 4.4541 8.7511 125.9248 56.7338 30.5318 175.8704 211 G 5.3266 8.0183 104.5428 45.7672 0.0000 171.4679 212 I 5.0798 8.2768 120.0016 58.8370 40.8156 175.3772 213 V 3.6804 8.9192 127.6479 64.0558 31.7950 174.0889 214 S 4.8823 8.3883 120.7518 58.3309 64.5045 174.4179 215 W 4.8834 7.2131 113.7777 55.9627 32.0078 172.3818 216 G 3.7707 8.3632 106.9962 46.4936 0.0000 173.3482 217 S 4.6188 8.4921 115.3494 56.9693 61.7884 172.8042 *219 G 4.4829 7.9283 118.4339 45.4493 0.0000 170.6715 220 C 4.9452 8.1467 116.5977 56.4689 44.6330 173.7811 221A A 4.0381 9.3011 125.8258 53.1521 16.8411 176.9171 221 Q 4.5046 7.3467 117.3654 56.2301 29.7530 175.9769 222 K 4.2234 8.4213 122.1195 57.9905 32.6896 176.3987 223 N 4.2711 9.3479 121.3868 53.9337 37.0558 175.2939 224 K 4.3419 7.5868 116.9332 53.6493 32.3406 174.0520 225 P 4.5704 0.0000 0.0000 62.0988 32.9733 177.6223 226 G 3.5588 8.4231 106.9286 46.3790 0.0000 172.5484 227 V 4.3551 7.7524 122.3811 60.8409 33.8085 174.2387 228 Y 4.9021 8.2301 123.7513 56.0882 42.6246 174.7187 229 T 4.4339 8.6482 119.1716 63.5293 70.0860 174.5279 230 K 5.0157 9.5059 128.2475 55.5004 31.4421 177.2926 231 V 3.9378 8.8291 126.7053 65.8195 31.4139 174.8309 232 C 4.3911 8.2788 112.3767 57.8066 41.5596 174.5906 233 N 4.2806 8.0128 117.5684 54.1450 38.6775 174.9739 234 Y 4.8235 7.8762 117.2613 57.3982 39.4719 177.3376 235 V 3.6871 8.2186 121.3360 66.5462 31.4418 178.0703 236 S 4.1530 8.1146 114.0466 61.3553 62.6610 176.3638 237 W 4.1610 8.3126 130.5983 60.3654 30.5455 177.9078 238 I 3.1972 8.5174 120.1590 64.2004 36.6200 178.4689 239 K 3.7382 7.9471 119.1275 59.5450 32.0227 179.2733 240 Q 3.8144 7.9457 119.6396 59.3125 28.7289 178.2909 241 T 3.4876 7.2979 116.0452 66.4325 68.3985 176.3975 242 I 2.1390 6.7592 120.1216 63.7993 37.0581 178.2422 243 A 4.0960 7.4680 120.2282 53.9580 18.1021 178.6814 244 S 4.7166 7.2176 111.0873 58.1222 63.8090 174.0729 245 N 4.6288 7.8576 125.0816 54.3594 39.5630 174.2346 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 4.26 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 1.36 0.57 0.91 0.00 0.00 17 V 8.80 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 1.04 0.00 0.00 0.91 0.00 0.00 18 G 8.48 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 19 G 7.73 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 20 Y 8.04 4.95 0.00 3.01 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 21 T 8.60 4.20 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 1.23 0.00 0.00 22 C 8.58 4.28 0.00 2.76 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 23 G 8.74 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 24 A 8.69 4.27 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.90 4.28 0.00 2.88 2.92 0.00 0.00 7.20 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 7.72 4.17 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 1.24 0.00 0.00 27 V 7.07 4.12 1.74 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 0.21 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.53 0.00 2.40 2.48 0.00 3.87 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.99 0.00 29 Y 7.00 5.08 0.00 3.28 3.42 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 0.00 30 Q 7.33 4.59 0.00 1.76 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.73 0.00 0.00 0.00 0.00 0.00 1.85 2.46 0.00 31 V 8.99 4.88 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 0.80 0.00 0.00 1.01 0.00 0.00 32 S 8.77 4.84 0.00 3.17 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.62 4.64 0.00 0.59 1.06 0.73 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.80 5.76 0.00 2.44 2.49 0.00 0.00 6.65 7.29 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 *37 S 8.39 4.17 0.00 3.50 3.20 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 38 G 9.33 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 39 Y 6.74 4.47 0.00 3.05 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 40 H 8.97 4.63 0.00 2.92 3.22 0.00 5.86 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.91 5.05 0.00 3.02 2.82 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 42 C 6.81 4.60 0.00 1.83 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 43 G 8.72 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 0.00 0.00 0.00 0.00 44 G 7.98 4.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.89 5.44 0.00 3.81 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 46 L 9.27 4.79 0.00 1.86 1.68 1.10 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.59 4.37 1.90 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 1.58 0.91 0.95 0.00 0.00 48 N 7.76 4.70 0.00 2.99 2.98 0.00 0.00 6.00 7.14 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 49 S 8.67 4.25 0.00 4.21 4.23 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 50 Q 8.92 4.60 0.00 2.05 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.79 0.00 0.00 0.00 0.00 0.00 2.20 2.31 0.00 51 W 8.60 5.54 0.00 3.38 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 52 V 9.16 4.96 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 9.08 4.84 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 1.01 0.00 0.00 1.02 0.00 0.00 54 S 9.02 4.71 0.00 3.89 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.47 4.58 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 8.28 3.81 0.25 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 57 H 8.09 4.59 0.00 3.41 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 7.81 4.74 0.00 3.18 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 7.68 4.25 0.00 2.97 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 60 K 6.92 4.03 0.00 1.16 1.01 0.00 0.87 0.00 0.00 0.61 0.00 0.00 2.41 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.77 1.01 7.81 61 S 8.07 4.03 0.00 3.76 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.48 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 0.00 0.00 0.00 63 I 7.54 4.04 1.84 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 1.39 0.74 0.90 0.00 0.00 64 Q 8.98 4.74 0.00 1.98 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.94 0.00 0.00 0.00 0.00 0.00 2.06 2.20 0.00 65 V 8.87 4.31 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 0.98 0.00 0.00 0.89 0.00 0.00 66 R 9.10 4.99 0.00 1.48 1.70 0.00 2.63 0.00 0.00 2.43 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 1.13 0.00 67 L 9.10 4.75 0.00 1.66 1.64 1.05 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.26 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 70 E 8.19 4.45 0.00 2.08 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.07 0.00 71 D 7.88 4.80 0.00 2.78 2.76 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 72 N 9.14 4.82 0.00 2.82 2.83 0.00 0.00 7.17 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 8.41 3.74 1.41 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.51 -0.64 0.00 0.00 74 N 8.34 4.73 0.00 2.88 2.89 0.00 0.00 6.62 7.27 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 75 V 7.35 4.35 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 0.77 0.00 0.00 0.95 0.00 0.00 76 V 8.43 3.99 2.07 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 0.78 0.00 0.00 0.94 0.00 0.00 77 E 9.74 4.32 0.00 1.96 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.47 0.00 78 G 8.74 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 79 N 7.98 4.96 0.00 2.73 2.78 0.00 0.00 7.11 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 7.90 4.64 0.00 1.52 1.70 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 2.54 2.47 0.00 81 Q 9.00 4.33 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.77 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 82 F 8.88 5.54 0.00 2.79 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 83 I 8.76 4.65 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 1.24 0.75 0.95 0.00 0.00 84 S 8.71 4.70 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 8.48 4.62 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 8.91 4.52 0.00 3.77 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 87 K 7.53 4.67 0.00 1.56 1.73 0.00 1.64 0.00 0.00 1.91 0.00 0.00 2.84 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.41 7.81 88 S 8.68 4.91 0.00 3.98 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 89 I 9.22 4.39 2.03 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.96 1.08 0.00 0.00 90 V 8.32 4.16 2.07 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 0.64 0.00 0.00 0.85 0.00 0.00 91 H 8.74 4.00 0.00 2.87 3.09 0.00 5.65 0.00 0.00 0.00 0.00 6.68 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 4.29 0.00 2.22 2.23 0.00 3.01 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 1.69 2.03 0.00 93 S 7.98 4.66 0.00 3.95 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 94 Y 7.96 4.35 0.00 2.97 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 95 N 8.29 4.50 0.00 2.59 2.45 0.00 0.00 6.63 7.05 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 96 S 7.94 3.84 0.00 3.95 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 97 N 8.42 4.44 0.00 2.76 2.79 0.00 0.00 6.89 7.89 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 98 T 7.79 3.98 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 1.11 0.00 0.00 99 L 7.93 3.78 0.00 1.48 1.85 0.55 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.67 4.46 0.00 2.69 2.65 0.00 0.00 7.24 6.95 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 0.00 101 N 8.71 4.94 0.00 2.96 2.66 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 7.98 4.73 0.00 3.11 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.09 4.82 1.47 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 1.34 1.27 0.13 0.00 0.00 104 M 9.27 5.44 0.00 2.20 1.81 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.63 0.00 105 L 9.25 5.36 0.00 1.75 1.80 0.12 1.12 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 0.00 106 I 9.12 4.98 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 1.18 0.95 0.91 0.00 0.00 107 K 8.43 3.53 0.00 0.79 1.05 0.00 1.34 0.00 0.00 1.39 0.00 0.00 2.69 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.75 0.21 7.81 108 L 8.07 4.42 0.00 1.41 1.59 0.97 0.80 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 8.92 4.08 0.00 1.83 1.81 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.36 7.81 110 S 7.73 4.62 0.00 3.93 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 0.00 111 A 8.49 4.33 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 0.00 112 A 9.08 4.24 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 0.00 113 S 9.28 4.44 0.00 3.86 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 0.00 114 L 8.70 4.94 0.00 1.69 1.68 0.96 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 115 D 8.89 4.62 0.00 2.79 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 0.00 0.00 0.00 0.00 116 S 9.22 4.67 0.00 3.98 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 0.00 117 R 7.90 4.09 0.00 1.91 2.03 0.00 3.18 0.00 0.00 3.46 7.39 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.56 4.42 0.00 4.00 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 0.00 128 C 8.40 4.37 0.00 2.92 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 0.00 129 A 8.00 4.38 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 8.18 4.20 0.00 3.99 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 *132 A 8.22 4.25 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 9.13 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 0.00 134 T 7.57 3.96 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 135 Q 8.64 4.51 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 136 C 9.35 5.27 0.00 2.80 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 9.05 5.24 0.00 1.75 1.57 1.01 1.23 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 0.00 138 I 9.20 5.30 1.87 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 1.59 1.01 0.00 0.00 139 S 8.86 4.93 0.00 3.53 3.57 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 0.00 0.00 0.00 0.00 140 G 7.25 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 0.00 141 W 8.45 4.67 0.00 3.17 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 0.00 142 G 8.45 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.82 3.76 0.00 2.45 2.66 0.00 0.00 7.14 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 0.00 144 T 8.21 5.07 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 1.25 0.00 0.00 145 K 7.71 4.62 0.00 2.02 1.83 0.00 1.86 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 0.95 7.81 146 S 8.71 4.19 0.00 4.25 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 8.05 4.38 0.00 3.79 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 0.00 148 G 8.87 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 0.00 0.00 0.00 149 T 8.07 4.63 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 1.35 0.00 0.00 150 S 8.89 4.26 0.00 3.81 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 0.00 151 Y 8.50 4.91 0.00 2.98 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 4.62 0.00 2.47 2.09 0.00 4.14 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.04 0.00 153 D 8.84 4.54 0.00 2.80 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 7.40 5.43 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 0.99 0.00 0.00 0.97 0.00 0.00 155 L 8.29 3.13 0.00 1.46 1.26 -0.78 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.10 4.80 0.00 1.70 1.51 0.00 1.60 0.00 0.00 1.55 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.48 7.81 157 C 8.73 5.25 0.00 1.57 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 0.00 0.00 0.00 0.00 158 L 8.60 4.98 0.00 1.69 1.44 1.03 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.00 5.15 0.00 1.82 1.84 0.00 1.89 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.64 1.48 7.81 160 A 8.88 4.84 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 5.07 0.00 2.00 2.20 0.00 3.01 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.58 0.00 162 I 8.41 4.26 1.93 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.77 0.77 0.00 0.00 163 L 8.73 5.08 0.00 1.63 1.59 0.92 0.73 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 0.00 164 S 8.47 4.29 0.00 4.01 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 0.00 165 D 8.78 4.41 0.00 2.85 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 0.00 166 S 8.03 4.14 0.00 4.10 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 0.00 167 S 8.17 4.16 0.00 4.09 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 0.00 168 C 8.38 4.34 0.00 3.25 3.36 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 0.00 169 K 8.39 4.02 0.00 1.88 1.90 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.54 1.69 7.81 170 S 7.98 4.24 0.00 4.00 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 7.91 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.85 4.77 0.00 3.20 3.20 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 0.00 173 P 0.00 4.55 0.00 2.08 2.06 0.00 3.92 0.00 0.00 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.19 0.00 174 G 9.07 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 0.00 175 Q 8.14 4.53 0.00 2.52 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.15 6.71 0.00 0.00 0.00 0.00 0.00 2.27 2.57 0.00 176 I 7.96 4.29 1.99 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.95 1.00 0.00 0.00 177 T 8.28 4.51 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 8.54 4.38 0.00 4.00 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 8.20 4.98 0.00 2.91 3.09 0.00 0.00 6.64 7.60 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 0.00 180 M 7.92 5.63 0.00 1.91 2.02 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.62 0.00 181 F 8.80 5.11 0.00 3.10 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 C 9.02 5.37 0.00 2.99 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 8.91 5.02 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184A G 6.98 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 Y 8.40 4.67 0.00 3.06 2.86 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 0.00 185 L 8.69 4.13 0.00 1.74 1.73 0.92 0.88 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 8.21 4.03 0.00 2.09 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 0.00 2.34 2.32 0.00 187 G 7.65 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 0.00 0.00 0.00 188A G 9.43 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 0.00 188 K 7.36 4.94 0.00 1.77 1.83 0.00 1.04 0.00 0.00 1.50 0.00 0.00 2.62 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.46 1.30 7.81 189 D 8.81 4.62 0.00 2.78 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 8.79 4.95 0.00 3.99 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 C 9.54 4.81 0.00 2.90 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 0.00 192 Q 8.75 4.26 0.00 2.37 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.44 0.00 0.00 0.00 0.00 0.00 2.57 2.56 0.00 193 G 9.28 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.56 4.71 0.00 2.97 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 8.07 4.52 0.00 3.97 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 0.00 196 G 8.83 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 0.00 197 G 7.89 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 5.17 0.00 2.37 2.40 0.00 3.69 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.17 0.00 199 V 8.42 4.56 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.52 0.00 0.00 200 V 8.86 4.88 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.73 0.00 0.00 201 C 8.81 5.06 0.00 2.80 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 0.00 202 S 9.69 3.31 0.00 3.96 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 0.00 203 G 8.40 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 0.00 204 K 7.50 4.70 0.00 1.81 1.64 0.00 1.89 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.39 7.81 *209 L 8.27 4.23 0.00 1.51 1.65 1.01 0.78 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 8.75 4.45 0.00 1.97 1.94 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 2.41 2.33 0.00 211 G 8.02 5.33 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 0.00 0.00 0.00 212 I 8.28 5.08 1.94 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 1.31 0.83 0.90 0.00 0.00 213 V 8.92 3.68 2.38 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 0.98 0.00 0.00 1.24 0.00 0.00 214 S 8.39 4.88 0.00 3.90 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 0.00 215 W 7.21 4.88 0.00 3.39 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 0.00 216 G 8.36 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 0.00 217 S 8.49 4.62 0.00 4.30 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 *219 G 7.93 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.15 4.95 0.00 2.95 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 221A A 9.30 4.04 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 Q 7.35 4.50 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.92 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 222 K 8.42 4.22 0.00 1.72 1.71 0.00 1.92 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.61 7.81 223 N 9.35 4.27 0.00 2.82 2.84 0.00 0.00 6.76 8.10 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 0.00 224 K 7.59 4.34 0.00 1.85 1.77 0.00 1.48 0.00 0.00 1.31 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.47 7.81 225 P 0.00 4.57 0.00 2.13 2.08 0.00 3.71 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 2.10 2.00 0.00 226 G 8.42 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.75 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 0.39 0.00 0.00 -0.77 0.00 0.00 228 Y 8.23 4.90 0.00 1.43 2.42 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 0.00 229 T 8.65 4.43 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 1.29 0.00 0.00 230 K 9.51 5.02 0.00 2.17 1.92 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.53 7.81 231 V 8.83 3.94 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 1.22 0.00 0.00 1.16 0.00 0.00 232 C 8.28 4.39 0.00 3.15 3.36 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 0.00 233 N 8.01 4.28 0.00 2.40 2.35 0.00 0.00 6.78 7.50 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 0.00 234 Y 7.88 4.82 0.00 3.14 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 0.00 235 V 8.22 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 1.09 0.00 0.00 1.10 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 8.31 4.16 0.00 3.51 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 0.00 238 I 8.52 3.20 2.05 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.17 0.80 0.00 0.00 239 K 7.95 3.74 0.00 1.73 1.77 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.52 7.81 240 Q 7.95 3.81 0.00 2.17 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 241 T 7.30 3.49 3.17 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 0.72 0.00 0.00 242 I 6.76 2.14 1.44 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.31 -0.04 0.00 0.00 243 A 7.47 4.10 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 0.00 244 S 7.22 4.72 0.00 4.03 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 0.00 245 N 7.86 4.63 0.00 3.01 3.02 0.00 0.00 6.94 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 * Residues marked with a * may have inaccurate shift predictions.