NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3449 8.3049 120.3573 55.2236 34.0668 175.6240 2 I 4.2286 7.6217 122.7408 58.5506 37.1278 173.4245 3 D 4.9009 9.4149 126.4715 52.5349 44.2316 175.0062 4 L 4.6904 8.9048 125.8246 54.6300 42.1604 176.2413 5 T 4.3545 7.3121 116.2104 64.7003 68.5473 174.7118 6 G 3.9837 9.0821 114.8651 44.8620 0.0000 173.4573 7 K 4.7193 7.8705 119.0779 55.8859 34.3794 175.7951 8 T 5.0831 8.9107 118.9435 62.0606 71.2070 173.5122 9 S 5.3292 9.1581 122.5988 56.5765 66.4981 172.7510 10 L 5.1141 9.0330 125.4313 53.3690 44.6263 174.9286 11 I 5.0016 8.7314 127.5302 59.7694 39.5887 175.5363 12 T 4.4576 9.0158 118.4740 60.2722 70.8087 174.2425 13 G 3.9934 8.6233 107.2798 46.5587 0.0000 175.0860 14 A 4.1515 8.3281 122.4912 53.6998 18.6652 179.3344 15 S 4.4797 7.8580 108.9754 58.4620 63.9855 175.0919 16 S 4.4773 7.8121 117.3839 58.1785 64.9145 175.2663 17 G 3.5666 8.4931 108.6667 47.7297 0.0000 176.2182 18 I 3.8406 7.7412 121.7327 64.1907 37.2688 178.1323 19 G 3.8262 8.1997 107.0367 48.2331 0.0000 175.7621 20 S 4.1623 8.4694 116.9397 60.6527 63.1587 176.3792 21 A 4.0143 7.9716 124.3316 54.8928 18.0203 179.6115 22 I 3.6285 8.0634 118.3248 64.5151 37.2524 178.3917 23 A 4.0021 8.2039 121.7172 55.4298 18.2201 179.9455 24 R 3.9028 8.1234 116.4877 59.1241 30.0898 179.1782 25 L 3.9613 7.9346 120.0424 58.2892 42.1329 179.0352 26 L 4.0451 8.2052 119.1623 57.9197 41.3858 179.1457 27 H 4.6522 8.3152 119.6919 58.7169 29.6768 177.2900 28 K 3.9566 8.5311 120.4166 59.0414 32.2313 177.1316 29 L 4.2960 7.9320 117.7806 54.8292 41.3168 177.9778 30 G 3.9441 8.4880 108.6988 44.7826 0.0000 173.4878 31 S 4.6887 8.2576 115.6438 57.6884 63.8365 173.5061 32 K 4.6302 9.1286 126.4722 56.5335 33.3181 176.3631 33 V 4.9406 8.7348 116.8700 59.6664 35.4896 174.6556 34 I 4.8483 9.2204 126.4728 59.7580 39.2406 174.5998 35 I 4.5984 8.8895 122.7253 59.3579 39.2656 174.7948 36 S 5.2665 9.8707 121.9103 55.6539 66.1438 173.3433 37 G 4.3114 7.6974 111.2665 46.7165 0.0000 172.7932 38 S 4.6217 8.5029 113.0051 58.9067 63.9609 174.6625 39 N 4.6562 7.7241 120.1892 51.6342 38.0089 174.0435 40 E 3.8993 8.4520 127.3749 59.0140 29.9255 177.6204 41 E 3.9136 8.2298 118.5711 59.4758 29.7169 178.8930 42 K 4.0317 8.4743 118.3573 59.3142 32.0514 179.3366 43 L 3.9968 8.2131 119.6025 57.8322 41.4948 179.8018 44 K 4.0321 8.3485 118.8257 59.3331 31.8838 179.6318 45 S 4.1860 7.9824 114.3191 61.0076 62.9791 176.2450 46 L 3.8853 8.0636 124.1344 57.8845 41.7734 178.8745 47 G 2.9807 8.2880 105.9389 47.8603 0.0000 175.0229 48 N 4.2790 8.1917 117.8655 56.0233 38.6584 177.0261 49 A 4.0833 7.4537 120.4845 55.1502 18.4863 179.4105 50 L 3.7797 7.3982 116.7035 55.6622 41.6382 178.1409 51 K 4.4805 9.1178 121.9220 56.4878 31.0994 175.2739 52 D 4.6759 7.7921 113.1505 53.6662 44.6297 173.2924 53 N 4.2691 8.8206 115.0987 53.8426 35.7244 172.9324 54 Y 5.4490 7.3315 112.9599 56.6485 41.8943 174.8828 55 T 4.5736 9.0836 115.4866 62.1663 73.3646 173.2123 56 I 4.8391 8.4127 125.9066 60.4350 39.0347 175.2247 57 E 4.5484 8.9765 125.2017 54.5059 32.7743 175.0287 58 V 4.3853 8.4360 125.6790 62.4055 32.3334 174.9076 59 C 4.7867 9.2432 128.0104 58.2710 35.3920 172.5405 60 N 4.7263 9.0535 125.4760 51.9280 39.1760 175.3519 61 L 3.9758 8.7809 127.4324 57.5413 42.0844 178.6095 62 A 3.9578 8.0656 120.5234 55.0206 18.6694 177.4375 63 N 4.7244 8.2243 117.1075 53.0843 40.0823 176.4070 64 K 4.0611 8.7977 135.0000 60.7545 31.8787 176.0219 65 E 4.2518 8.2585 119.2355 60.7584 29.6401 180.5111 66 E 4.1481 8.7452 119.3732 59.3502 29.4182 178.5494 67 C 4.0814 7.9594 116.5986 63.0244 27.2677 176.1174 68 S 4.1518 8.1144 114.5181 61.4570 61.9271 175.9341 69 N 4.6515 8.5609 119.6453 55.7255 38.0428 177.0020 70 L 3.9136 7.7708 121.2655 58.3802 42.3432 178.9989 71 I 3.8617 7.2634 119.6629 64.2074 36.8405 178.2876 72 S 4.0929 7.2465 114.2322 61.7648 62.7692 176.7584 73 K 3.8755 7.5651 120.8521 56.9557 32.3743 176.4778 74 T 4.6213 7.4923 109.5051 59.9585 70.9162 173.8000 75 S 4.4388 8.7011 121.4476 60.5564 63.8828 174.1616 76 N 4.6336 7.8189 116.4076 52.3975 39.2828 175.2405 77 L 4.2777 8.1735 124.3588 54.7452 43.3422 173.9176 78 D 4.8853 9.3011 127.8123 55.3247 43.1352 176.9736 79 I 4.9721 7.6101 118.6562 59.3259 41.2968 174.0309 80 L 5.0827 9.2408 129.5099 53.1598 44.6657 175.0629 81 V 4.7484 9.1434 126.1731 61.5086 34.2840 174.3268 82 C 4.7625 8.9772 128.0102 58.4724 28.5426 173.3104 83 N 4.9081 8.5938 121.4661 52.4096 39.2721 175.3777 84 A 3.9577 7.8764 123.5996 53.4599 19.0676 177.7653 85 G 4.2096 8.7166 109.9629 46.2248 0.0000 173.2386 *99 D 4.3953 8.3736 119.4726 54.7339 41.2359 171.3296 100 F 4.1983 8.8432 127.5825 60.9257 39.3462 176.7110 101 D 4.4357 8.3543 117.6080 57.2627 40.4909 178.8284 102 K 3.8653 7.8498 119.6207 59.4493 32.3688 178.9995 103 V 3.3017 7.1266 117.2234 65.8117 31.3396 178.0525 104 I 3.4550 7.2565 119.5217 64.5079 37.0234 178.2383 105 D 4.3535 8.1576 119.7556 57.0850 40.3438 178.9608 106 I 3.7545 7.6222 119.5918 64.3949 37.7796 177.8763 107 N 4.5661 8.6272 116.2842 54.5455 38.4242 176.1379 108 L 4.3996 7.4683 119.7708 56.0335 44.4942 178.4167 109 K 4.0802 8.1973 117.8071 59.1897 31.8610 179.2014 110 A 4.0333 7.9329 120.9100 55.4164 18.3080 179.4683 111 N 4.2735 8.1498 114.4264 56.2054 38.6671 176.9042 112 F 4.1856 8.3351 122.1841 61.6853 39.2958 177.4415 113 I 3.3916 7.5333 118.9964 64.2229 36.9470 178.3364 114 L 3.9165 7.9146 119.7808 57.8910 41.4162 179.4838 115 N 4.2337 8.3826 116.5602 56.2348 38.5406 177.3837 116 R 3.6578 7.8918 120.3253 59.5701 29.9565 178.4199 117 E 3.9044 8.2868 118.3408 59.2507 29.4099 179.2797 118 A 3.9689 8.0313 120.9138 55.0139 18.4124 179.6401 119 I 3.5912 8.0597 118.7959 64.5473 36.9670 178.5929 120 K 3.9192 7.7479 117.9449 59.5181 32.0280 179.2682 121 K 4.2837 7.7350 118.5185 59.8726 31.9252 179.5107 122 M 4.1565 8.6066 119.0870 58.0899 31.7989 178.7305 123 I 3.6985 8.2234 120.8156 64.5571 37.0060 178.3706 124 Q 4.0281 7.7895 117.7331 58.3791 28.6381 177.2999 125 K 4.3022 8.0579 114.2829 55.7134 32.4638 176.2585 126 R 4.0958 7.7236 117.2032 55.2579 28.3619 174.7570 127 Y 5.1573 6.5702 115.2540 56.0422 42.4287 174.0771 128 G 4.0787 6.3203 115.2786 46.1499 0.0000 171.1470 129 R 5.0485 8.1863 119.4273 54.2035 34.3609 174.4649 130 I 4.9113 8.7320 124.3946 59.4695 40.6327 174.4876 131 I 4.9847 8.9489 127.9818 59.6193 40.3062 174.1062 132 N 5.2095 9.1206 125.4275 51.7071 40.9133 173.9958 133 I 4.9801 8.7844 125.4783 59.5257 39.7225 175.5302 134 S 4.8276 8.6281 122.3852 57.2995 64.7439 174.3565 135 S 4.5571 8.5193 115.7998 58.0712 63.6082 173.9266 136 I 3.8125 7.8389 122.1876 60.9207 37.6750 176.2662 137 V 3.3311 7.3058 125.4177 62.5198 31.8002 176.0887 138 G 3.3075 8.4836 115.7573 46.5089 0.0000 173.8986 *141 G 3.8324 8.8124 115.7070 45.5339 0.0000 173.3621 142 N 3.9815 7.7004 118.1938 54.8933 38.5571 173.5412 143 P 4.5340 0.0000 0.0000 62.1107 32.8905 177.5084 144 G 3.8696 7.4835 106.8403 45.2040 0.0000 173.7072 145 Q 4.2089 8.4290 116.8980 55.5965 30.6726 176.8154 146 A 4.1004 8.9036 125.6673 55.6274 18.3509 180.0702 147 N 3.8276 8.2004 114.7503 56.3343 37.5232 177.0914 148 Y 4.0419 7.8489 120.2857 59.9702 38.0494 177.6777 149 C 4.1047 8.5346 119.6681 62.4680 31.6771 175.3566 150 A 4.0571 8.4921 123.0273 55.3279 17.4884 179.8133 151 S 3.9707 8.0607 112.7020 61.1529 63.2323 176.5392 152 K 3.8987 8.2618 123.1272 59.2016 31.9826 178.5090 153 A 4.0816 8.0645 121.0633 55.2615 18.3507 179.6716 154 G 3.6651 8.2578 104.3267 48.0862 0.0000 175.6061 155 L 4.1531 8.0213 122.5260 57.7662 42.0670 179.1578 156 I 3.8787 7.7447 120.0409 64.0419 37.1149 178.5306 157 G 3.5932 8.5294 107.1129 47.9118 0.0000 175.2956 158 M 4.0512 8.6081 121.1037 58.6903 32.2577 178.3864 159 T 3.8719 8.0055 115.7729 66.6647 68.6879 176.5854 160 K 3.9398 8.1091 120.2660 59.5763 32.1161 179.3249 161 S 4.0679 8.1054 113.1465 61.5526 62.2219 176.3024 162 L 4.1453 8.1488 121.4286 57.2923 41.0347 179.4603 163 S 4.0970 7.8640 112.8706 61.5529 62.5088 175.1090 164 Y 4.1040 7.9788 122.1351 60.8403 38.3235 177.8026 165 E 4.0561 8.1586 118.4081 58.3732 30.0388 178.0872 166 V 4.2633 7.3754 109.6988 60.6310 32.2181 177.2014 167 A 3.9229 7.4405 123.2454 55.4570 18.2306 179.2362 168 T 4.1262 7.7315 102.8126 63.1558 69.3479 175.0849 169 R 4.4472 7.9855 122.1462 56.1390 30.6034 177.4576 170 G 4.0935 8.1691 103.6434 46.1087 0.0000 173.1032 171 I 4.7336 7.5048 119.9081 59.4250 39.0433 175.0633 172 T 4.5357 8.3992 117.0630 59.9585 71.6058 173.7882 173 V 4.7289 8.5763 123.3875 61.4615 34.2974 174.0025 174 N 5.5756 9.4852 124.5240 51.5104 43.6361 173.1281 175 A 5.1652 9.0547 121.5726 50.2285 22.5540 175.2489 176 V 4.6039 8.6470 121.0257 61.1139 34.2674 174.4977 177 A 5.0642 8.8565 130.2352 48.7261 19.8835 173.6528 178 P 4.7810 0.0000 0.0000 62.0249 32.3193 177.0223 179 G 4.3724 8.9259 117.3716 46.3027 0.0000 176.0089 180 F 4.5459 9.1493 129.2309 56.3364 39.8258 173.4149 181 I 4.9525 8.2046 124.6770 58.7845 39.6101 175.7440 182 K 3.4998 9.1651 130.4719 57.4994 32.2320 176.8923 *189 L 4.3172 8.4303 126.6021 54.1169 42.7561 172.2424 190 N 5.0993 8.6941 117.6053 51.8817 39.9176 176.3039 191 E 4.0912 8.8830 120.5914 61.9921 29.4158 180.9378 192 K 4.1849 8.1625 122.0171 60.2353 32.0153 183.3831 193 Q 4.2470 8.2332 120.9917 59.6713 28.7602 180.6458 194 R 3.7983 7.8709 120.6872 61.3430 29.6562 179.9319 195 E 4.0000 7.8540 119.9546 59.2373 29.2912 178.6455 196 A 3.9531 7.7210 118.8056 55.6234 18.6090 179.4310 197 I 3.4699 7.3753 117.4516 64.4598 37.1903 178.8601 198 V 3.1194 8.1436 119.2860 66.1040 31.0333 177.7873 199 Q 4.0303 8.0337 121.0370 59.5947 28.9153 178.6188 200 K 4.4753 8.6550 123.3131 56.8845 32.1944 179.6387 201 I 4.5135 7.4294 119.7967 59.8168 37.5731 174.3519 202 P 4.2258 0.0000 0.0000 65.6930 31.2784 178.0192 203 L 3.9098 7.5087 116.0894 56.3143 41.5394 178.7867 204 G 3.9041 8.9616 105.1287 45.2575 0.0000 172.3601 205 T 4.4767 7.0015 112.1644 59.6575 70.7627 172.4378 206 Y 4.5297 7.5229 122.4997 56.8510 39.3612 175.4713 207 G 4.2491 9.6716 109.4855 45.6822 0.0000 172.2265 208 I 4.9955 8.9212 113.0723 58.0399 40.5853 175.1736 209 P 4.3008 0.0000 0.0000 65.9392 31.0733 178.7630 210 E 4.1067 8.2160 116.5767 59.0586 29.3870 178.8563 211 D 4.4685 8.2044 119.6260 57.1258 40.8608 178.8676 212 V 3.7205 7.8038 118.1722 65.8785 31.6456 177.5293 213 A 4.0431 8.1584 120.6342 55.5231 18.1890 178.9445 214 Y 4.1686 8.1979 117.5197 60.8942 38.9370 178.1789 215 A 3.8213 7.6968 120.2459 55.0304 18.4578 179.7731 216 V 3.4829 7.9532 116.4193 66.1031 31.4503 177.8929 217 A 3.9707 8.0149 119.3975 55.1954 18.4793 178.9814 218 F 4.2545 7.9464 118.7723 61.6900 39.2786 177.4677 219 L 3.6525 7.7734 116.6775 57.3887 41.4707 178.9310 220 A 4.1206 8.4552 119.7145 52.8751 18.6626 177.4468 221 S 4.6050 7.2741 112.8551 56.5661 64.8704 175.0744 222 N 4.4861 8.4972 117.2311 56.0742 38.1263 176.2592 223 N 4.6260 8.0794 114.1843 54.2475 38.8534 175.4378 224 A 4.4156 7.4866 122.1104 51.5493 19.5374 178.6564 225 S 4.1507 8.2873 116.4646 62.4134 63.2720 174.1672 226 Y 4.5331 7.9822 119.7257 57.1076 38.6365 174.4901 227 I 4.2900 7.3969 119.9361 60.2029 37.9265 174.8840 228 T 4.6029 7.7678 118.8479 61.4958 70.3195 173.5629 229 G 3.9108 8.9412 114.2453 46.1470 0.0000 173.3907 230 Q 4.6956 8.0982 118.4479 54.4530 31.4526 174.5829 231 T 5.0030 8.3649 117.6350 61.7117 71.2425 173.4340 232 L 4.7014 8.7862 127.9249 53.6046 44.7542 174.5361 233 H 5.0965 8.9102 123.6083 54.7379 30.3099 175.5573 234 V 4.4791 8.9382 124.3757 60.7270 31.5978 175.2425 235 N 5.0328 8.2267 117.7053 51.6573 39.7777 176.3206 236 G 3.7712 8.6776 106.8762 46.5359 0.0000 175.1788 237 G 3.9455 8.4971 106.3530 45.1405 0.0000 174.8932 238 M 4.2607 7.9530 122.3800 58.1234 32.3871 177.2330 239 L 4.6333 7.7233 117.3376 52.5018 44.0183 177.3647 240 M 4.4775 8.4841 124.2861 53.2554 32.1593 176.3298 241 V 3.9715 7.9742 122.6483 63.2803 31.5282 173.4171 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 1 M 8.30 4.34 0.00 2.08 2.21 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.67 0.00 2 I 7.62 4.23 1.96 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 1.42 1.35 0.96 0.00 0.00 3 D 9.41 4.90 0.00 2.58 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 4 L 8.90 4.69 0.00 1.82 1.64 0.95 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 5 T 7.31 4.35 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 1.20 0.00 0.00 6 G 9.08 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 7 K 7.87 4.72 0.00 1.79 1.78 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.83 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.60 7.81 8 T 8.91 5.08 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 1.23 0.00 0.00 9 S 9.16 5.33 0.00 3.76 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 L 9.03 5.11 0.00 1.69 1.49 0.98 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 11 I 8.73 5.00 1.88 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.44 0.92 0.00 0.00 12 T 9.02 4.46 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 13 G 8.62 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.33 4.15 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 15 S 7.86 4.48 0.00 3.98 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 16 S 7.81 4.48 0.00 4.07 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 17 G 8.49 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 0.00 0.00 0.00 18 I 7.74 3.84 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 1.59 0.61 0.96 0.00 0.00 19 G 8.20 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 20 S 8.47 4.16 0.00 4.02 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 0.00 21 A 7.97 4.01 1.44 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 22 I 8.06 3.63 2.05 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 1.48 0.80 0.93 0.00 0.00 23 A 8.20 4.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 R 8.12 3.90 0.00 1.89 2.00 0.00 3.25 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 25 L 7.93 3.96 0.00 1.91 1.83 1.00 0.82 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 26 L 8.21 4.05 0.00 1.76 1.74 0.94 1.26 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 27 H 8.32 4.65 0.00 3.30 3.51 0.00 5.64 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 K 8.53 3.96 0.00 1.89 2.08 0.00 1.87 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.51 7.81 29 L 7.93 4.30 0.00 1.91 1.69 0.99 0.86 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 30 G 8.49 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 31 S 8.26 4.69 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 32 K 9.13 4.63 0.00 1.76 1.74 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.48 1.44 7.81 33 V 8.73 4.94 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 0.85 0.00 0.00 1.03 0.00 0.00 34 I 9.22 4.85 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 1.31 0.79 0.93 0.00 0.00 35 I 8.89 4.60 1.88 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.91 0.92 0.00 0.00 36 S 9.87 5.27 0.00 3.89 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 37 G 7.70 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 0.00 0.00 0.00 0.00 38 S 8.50 4.62 0.00 3.99 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 39 N 7.72 4.66 0.00 2.77 2.76 0.00 0.00 6.84 7.65 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 40 E 8.45 3.90 0.00 2.08 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 2.39 2.40 0.00 41 E 8.23 3.91 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 42 K 8.47 4.03 0.00 1.97 1.83 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.61 7.81 43 L 8.21 4.00 0.00 1.86 1.74 0.96 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 44 K 8.35 4.03 0.00 1.97 1.88 0.00 1.68 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.51 1.67 7.81 45 S 7.98 4.19 0.00 4.03 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 46 L 8.06 3.89 0.00 1.72 1.85 0.83 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 47 G 8.29 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 0.00 0.00 0.00 48 N 8.19 4.28 0.00 2.80 2.89 0.00 0.00 7.08 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 A 7.45 4.08 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 50 L 7.40 3.78 0.00 1.17 1.35 0.64 0.53 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 51 K 9.12 4.48 0.00 1.97 2.08 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.62 7.81 52 D 7.79 4.68 0.00 2.64 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 53 N 8.82 4.27 0.00 3.11 2.93 0.00 0.00 6.32 7.48 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 54 Y 7.33 5.45 0.00 2.99 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 55 T 9.08 4.57 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 1.18 0.00 0.00 56 I 8.41 4.84 1.94 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.82 0.96 0.00 0.00 57 E 8.98 4.55 0.00 1.86 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 2.23 2.37 0.00 58 V 8.44 4.39 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 0.74 0.00 0.00 1.00 0.00 0.00 59 C 9.24 4.79 0.00 2.93 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 60 N 9.05 4.73 0.00 2.90 2.69 0.00 0.00 6.93 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 L 8.78 3.98 0.00 1.67 1.72 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.07 3.96 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 63 N 8.22 4.72 0.00 2.81 2.85 0.00 0.00 7.22 5.35 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 64 K 8.80 4.06 0.00 1.80 1.81 0.00 1.85 0.00 0.00 1.85 0.00 0.00 2.89 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.45 1.08 7.81 65 E 8.26 4.25 0.00 1.97 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 2.31 1.94 0.00 66 E 8.75 4.15 0.00 2.17 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 67 C 7.96 4.08 0.00 3.23 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 68 S 8.11 4.15 0.00 3.89 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 69 N 8.56 4.65 0.00 2.89 2.84 0.00 0.00 6.60 6.84 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 70 L 7.77 3.91 0.00 1.76 1.88 0.92 0.93 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 71 I 7.26 3.86 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.75 0.90 0.00 0.00 72 S 7.25 4.09 0.00 4.20 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 73 K 7.57 3.88 0.00 2.06 1.95 0.00 1.90 0.00 0.00 1.75 0.00 0.00 3.09 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.49 1.49 7.81 74 T 7.49 4.62 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 1.26 0.00 0.00 75 S 8.70 4.44 0.00 3.87 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 76 N 7.82 4.63 0.00 2.72 2.75 0.00 0.00 6.61 7.85 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 77 L 8.17 4.28 0.00 1.54 1.54 0.96 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 78 D 9.30 4.89 0.00 2.74 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 I 7.61 4.97 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.72 0.90 0.00 0.00 80 L 9.24 5.08 0.00 1.66 1.46 0.94 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 81 V 9.14 4.75 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.93 0.00 0.00 82 C 8.98 4.76 0.00 3.03 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 83 N 8.59 4.91 0.00 2.85 2.75 0.00 0.00 6.96 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 84 A 7.88 3.96 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 85 G 8.72 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *99 D 8.37 4.40 0.00 2.72 2.64 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 0.00 0.00 0.00 0.00 100 F 8.84 4.20 0.00 3.12 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 0.00 101 D 8.35 4.44 0.00 2.83 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 K 7.85 3.87 0.00 1.79 1.72 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.46 7.81 103 V 7.13 3.30 1.55 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 0.18 0.00 0.00 0.37 0.00 0.00 104 I 7.26 3.46 1.64 0.00 0.00 -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 1.16 0.03 0.85 0.00 0.00 105 D 8.16 4.35 0.00 2.67 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 0.00 106 I 7.62 3.75 1.80 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.71 0.87 0.00 0.00 107 N 8.63 4.57 0.00 2.73 2.81 0.00 0.00 6.49 6.62 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 0.00 108 L 7.47 4.40 0.00 1.60 1.75 0.95 0.59 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 0.00 109 K 8.20 4.08 0.00 2.05 1.88 0.00 1.92 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.43 7.81 110 A 7.93 4.03 1.42 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 0.00 0.00 111 N 8.15 4.27 0.00 2.91 2.90 0.00 0.00 6.67 8.13 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 0.00 112 F 8.34 4.19 0.00 3.12 3.29 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 0.00 113 I 7.53 3.39 2.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.66 0.88 0.00 0.00 114 L 7.91 3.92 0.00 1.81 1.68 0.96 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.38 4.23 0.00 2.85 2.79 0.00 0.00 6.70 7.25 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 0.00 116 R 7.89 3.66 0.00 1.00 1.42 0.00 3.02 0.00 0.00 2.85 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.45 0.00 117 E 8.29 3.90 0.00 1.99 1.93 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 2.38 2.41 0.00 118 A 8.03 3.97 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 0.00 119 I 8.06 3.59 1.98 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.59 0.88 0.00 0.00 120 K 7.75 3.92 0.00 1.88 1.86 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.61 7.81 121 K 7.74 4.28 0.00 1.88 1.84 0.00 1.65 0.00 0.00 1.64 0.00 0.00 3.24 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.45 7.81 122 M 8.61 4.16 0.00 2.11 2.06 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.55 0.00 123 I 8.22 3.70 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.06 0.90 0.00 0.00 124 Q 7.79 4.03 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.79 0.00 0.00 0.00 0.00 0.00 2.39 2.33 0.00 125 K 8.06 4.30 0.00 1.81 1.91 0.00 1.93 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.43 7.81 126 R 7.72 4.10 0.00 2.05 2.00 0.00 3.16 0.00 0.00 3.20 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.52 0.00 127 Y 6.57 5.16 0.00 2.90 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 G 6.32 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 0.00 129 R 8.19 5.05 0.00 1.57 1.67 0.00 3.26 0.00 0.00 2.96 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.78 0.00 130 I 8.73 4.91 1.82 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 1.17 0.66 0.93 0.00 0.00 131 I 8.95 4.98 1.85 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.66 0.89 0.00 0.00 132 N 9.12 5.21 0.00 2.61 2.72 0.00 0.00 6.42 8.20 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 0.00 133 I 8.78 4.98 1.97 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 1.28 0.95 0.91 0.00 0.00 134 S 8.63 4.83 0.00 3.93 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 0.00 135 S 8.52 4.56 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 0.00 136 I 7.84 3.81 1.74 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.48 0.75 0.00 0.00 137 V 7.31 3.33 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 0.00 0.00 0.65 0.00 0.00 0.73 0.00 0.00 138 G 8.48 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 0.00 0.00 0.00 *141 G 8.81 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 0.00 142 N 7.70 3.98 0.00 2.76 2.65 0.00 0.00 6.94 7.75 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 0.00 143 P 0.00 4.53 0.00 2.20 2.22 0.00 3.85 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 144 G 7.48 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 0.00 145 Q 8.43 4.21 0.00 2.36 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.54 2.50 0.00 146 A 8.90 4.10 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 N 8.20 3.83 0.00 2.39 2.93 0.00 0.00 6.27 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 0.00 148 Y 7.85 4.04 0.00 2.99 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 0.00 149 C 8.53 4.10 0.00 3.36 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 0.00 150 A 8.49 4.06 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 S 8.06 3.97 0.00 3.95 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 0.00 152 K 8.26 3.90 0.00 1.90 2.12 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.47 7.81 153 A 8.06 4.08 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 G 8.26 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 0.00 0.00 0.00 155 L 8.02 4.15 0.00 1.95 1.89 0.98 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 156 I 7.74 3.88 2.02 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 1.45 0.75 0.92 0.00 0.00 157 G 8.53 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 0.00 158 M 8.61 4.05 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.70 0.00 159 T 8.01 3.87 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 1.20 0.00 0.00 160 K 8.11 3.94 0.00 1.94 1.87 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.63 1.62 7.81 161 S 8.11 4.07 0.00 3.90 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 0.00 162 L 8.15 4.15 0.00 1.77 1.72 1.02 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 163 S 7.86 4.10 0.00 4.10 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 0.00 164 Y 7.98 4.10 0.00 3.15 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 0.00 165 E 8.16 4.06 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 166 V 7.38 4.26 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 1.04 0.00 0.00 167 A 7.44 3.92 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 0.00 168 T 7.73 4.13 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 1.14 0.00 0.00 169 R 7.99 4.45 0.00 1.98 1.92 0.00 3.20 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.52 0.00 170 G 8.17 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 I 7.50 4.73 1.79 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.75 0.81 0.00 0.00 172 T 8.40 4.54 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 1.12 0.00 0.00 173 V 8.58 4.73 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 1.04 0.00 0.00 0.92 0.00 0.00 174 N 9.49 5.58 0.00 2.54 2.71 0.00 0.00 6.24 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 A 9.05 5.17 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 0.00 176 V 8.65 4.60 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.93 0.00 0.00 177 A 8.86 5.06 1.14 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 0.00 178 P 0.00 4.78 0.00 1.92 2.00 0.00 3.74 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 179 G 8.93 4.37 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 0.00 0.00 0.00 180 F 9.15 4.55 0.00 3.12 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 I 8.20 4.95 1.89 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.88 1.03 0.00 0.00 182 K 9.17 3.50 0.00 1.11 1.59 0.00 0.61 0.00 0.00 1.44 0.00 0.00 2.86 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.21 0.93 7.81 *189 L 8.43 4.32 0.00 1.73 1.48 0.92 0.93 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 0.00 190 N 8.69 5.10 0.00 2.87 2.92 0.00 0.00 7.41 7.15 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 0.00 191 E 8.88 4.09 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 1.97 0.00 192 K 8.16 4.18 0.00 1.75 1.82 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.44 1.10 7.81 193 Q 8.23 4.25 0.00 2.26 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.79 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 194 R 7.87 3.80 0.00 1.81 1.93 0.00 3.29 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.25 0.00 195 E 7.85 4.00 0.00 2.09 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 196 A 7.72 3.95 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 0.00 197 I 7.38 3.47 1.52 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.79 -0.85 0.00 0.00 198 V 8.14 3.12 2.01 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 0.92 0.00 0.00 0.89 0.00 0.00 199 Q 8.03 4.03 0.00 2.22 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.73 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 200 K 8.65 4.48 0.00 1.85 1.70 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.39 1.35 7.81 201 I 7.43 4.51 1.93 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 1.40 0.61 1.04 0.00 0.00 202 P 0.00 4.23 0.00 2.15 2.14 0.00 3.84 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.15 0.00 203 L 7.51 3.91 0.00 1.79 1.72 0.97 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 204 G 8.96 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 0.00 205 T 7.00 4.48 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 206 Y 7.52 4.53 0.00 3.09 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 0.00 207 G 9.67 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 0.00 0.00 0.00 0.00 208 I 8.92 5.00 2.06 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.99 1.11 0.00 0.00 209 P 0.00 4.30 0.00 2.20 2.23 0.00 3.63 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 2.12 2.20 0.00 210 E 8.22 4.11 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 211 D 8.20 4.47 0.00 2.93 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 V 7.80 3.72 2.26 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 1.07 0.00 0.00 0.97 0.00 0.00 213 A 8.16 4.04 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 Y 8.20 4.17 0.00 3.17 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 A 7.70 3.82 1.42 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 0.00 0.00 216 V 7.95 3.48 2.23 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 1.00 0.00 0.00 1.02 0.00 0.00 217 A 8.01 3.97 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 0.00 218 F 7.95 4.25 0.00 2.84 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 0.00 219 L 7.77 3.65 0.00 1.73 1.62 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 220 A 8.46 4.12 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 0.00 221 S 7.27 4.60 0.00 4.02 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 0.00 222 N 8.50 4.49 0.00 2.75 2.95 0.00 0.00 6.92 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 N 8.08 4.63 0.00 2.87 3.02 0.00 0.00 6.46 8.61 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 0.00 224 A 7.49 4.42 0.46 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 0.00 225 S 8.29 4.15 0.00 4.04 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 0.00 226 Y 7.98 4.53 0.00 2.82 3.01 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 0.00 227 I 7.40 4.29 1.93 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.81 0.94 0.00 0.00 228 T 7.77 4.60 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 1.10 0.00 0.00 229 G 8.94 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 0.00 230 Q 8.10 4.70 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.40 6.72 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 231 T 8.36 5.00 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 1.04 0.00 0.00 232 L 8.79 4.70 0.00 1.74 1.49 0.96 1.32 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 0.00 233 H 8.91 5.10 0.00 3.11 3.24 0.00 5.69 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 V 8.94 4.48 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 1.15 0.00 0.00 0.98 0.00 0.00 235 N 8.23 5.03 0.00 2.99 3.05 0.00 0.00 6.08 7.20 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 0.00 236 G 8.68 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 0.00 237 G 8.50 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 0.00 238 M 7.95 4.26 0.00 2.07 2.28 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.56 0.00 239 L 7.72 4.63 0.00 1.65 1.38 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 240 M 8.48 4.48 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.50 0.00 241 V 7.97 3.97 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 0.69 0.00 0.00 0.78 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.