NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2838 7.8827 121.4438 61.1412 38.8065 173.7840 17 V 4.4012 8.4709 125.1275 61.6733 33.1663 174.2846 18 G 3.9105 9.1068 115.1002 46.4620 0.0000 172.8078 19 G 4.2101 7.7950 110.1155 43.5572 0.0000 172.2486 20 Y 4.9631 7.4943 116.2498 55.0210 42.1482 174.8152 21 T 4.3431 8.5738 116.7596 63.8868 68.4987 175.5139 22 C 4.3962 8.8330 125.3203 61.1471 34.9682 174.3855 23 G 4.1490 8.6754 105.9669 43.5368 0.0000 172.8943 24 A 4.3829 8.5794 124.4517 52.8742 18.4823 177.0921 25 N 4.2420 8.8099 120.3934 54.6595 36.1819 175.3859 26 T 4.2236 7.6265 107.3198 62.5387 69.9832 175.1001 27 V 4.0410 7.0287 122.2377 60.2303 31.3301 173.6625 28 P 4.5333 0.0000 0.0000 63.6642 32.0325 178.0069 29 Y 4.9528 6.7810 116.0059 56.2313 38.6962 174.5465 30 Q 4.6883 7.4223 123.2942 56.1283 29.9631 175.0946 31 V 4.8316 8.9531 125.1652 61.1383 35.7670 173.7444 32 S 5.0261 8.5912 118.5478 56.4084 65.2604 172.4704 33 L 4.6209 8.6745 127.5509 53.2073 43.5019 174.9912 34 N 6.0275 9.0445 122.4641 50.0489 42.0584 174.9634 *37 S 4.4003 8.4524 120.6969 58.5984 64.1731 174.3935 38 G 3.9729 8.8255 108.3534 46.5036 0.0000 173.0370 39 Y 4.5115 6.4616 115.5126 56.1859 40.1017 172.6455 40 H 4.7186 8.8284 121.3244 56.0632 30.3826 174.6835 41 F 5.0243 7.9739 119.8019 57.0780 39.9672 173.7790 42 C 4.7556 6.7888 114.9237 55.9462 45.0433 172.8988 43 G 4.4058 8.6179 108.6352 45.2603 0.0000 172.0589 44 G 4.3468 8.2539 105.2384 46.3105 0.0000 172.4666 45 S 5.4970 8.8335 115.1134 56.5004 67.0181 173.5858 46 L 4.7949 9.1959 127.0861 54.5670 42.5550 177.0999 47 I 4.2808 8.4377 119.4926 61.0987 39.2464 174.7864 48 N 4.4687 7.8598 116.9606 51.9431 39.1613 175.0884 49 S 4.1704 8.4375 113.4654 61.0612 62.8038 175.8053 50 Q 4.4725 8.1845 116.9001 55.1598 30.1625 174.5480 51 W 5.5887 8.1745 117.4834 54.8032 33.6063 174.4083 52 V 5.1434 9.1276 122.2852 61.1086 34.7813 174.4520 53 V 4.9307 8.6874 125.8573 60.5075 34.2010 174.8771 54 S 5.1077 8.9986 116.6161 57.8494 66.0010 172.1859 55 A 4.7957 8.5574 120.3068 50.7448 20.6205 178.4763 56 A 3.9103 8.2312 123.5575 55.0023 18.5579 179.1319 57 H 4.5830 8.5006 109.6083 57.0781 28.6701 175.1891 58 C 4.7892 7.7095 117.1730 56.9125 40.3663 173.1947 59 Y 4.2666 7.7213 122.1769 57.7785 38.7613 175.2106 60 K 3.8601 7.0846 123.9737 55.4133 36.1930 174.6614 61 S 4.4307 7.8988 114.6800 57.7009 64.4151 173.2586 62 G 3.6177 8.4234 111.0585 46.5215 0.0000 173.4503 63 I 4.5903 7.2687 118.6275 59.6060 40.0992 175.9437 64 Q 4.8079 8.6989 126.6728 54.2484 32.0977 174.0855 65 V 4.4014 9.0773 126.6199 61.6188 33.7474 174.5138 66 R 5.2613 8.9149 126.9935 54.6115 32.7101 175.0161 67 L 4.7582 9.2350 124.4689 52.6001 45.0277 177.0376 *69 G 4.5349 8.2351 105.9889 46.4133 0.0000 172.7424 70 E 4.7264 8.4460 118.6724 55.1098 30.5454 174.2188 71 D 4.7698 7.7941 117.4587 54.8911 44.5600 173.9133 72 N 4.9941 8.7013 117.5995 52.8582 39.5632 175.9671 73 I 4.1290 8.4540 119.2729 61.6951 37.9728 176.0638 74 N 4.7545 8.8383 118.1187 53.1498 39.4856 174.8388 75 V 4.2857 7.3161 116.8432 60.6665 34.0569 175.1628 76 V 4.0940 8.4043 126.8933 62.5770 30.6208 175.1484 77 E 4.3353 9.1123 126.9337 56.0913 29.7778 177.1019 78 G 4.0901 8.1219 107.4210 45.1829 0.0000 174.3261 79 N 4.9699 8.1379 115.9753 53.1130 39.8465 174.4072 80 E 5.5854 7.9387 117.2589 54.7663 31.8819 175.7739 81 Q 4.2854 8.2925 119.5251 54.3521 32.9591 173.8795 82 F 5.6384 8.7720 123.0212 55.9808 40.9507 175.1484 83 I 4.7103 8.9558 124.8504 59.4976 41.0332 175.6867 84 S 4.8668 8.6517 121.4364 58.0983 64.5340 173.0256 85 A 4.7685 8.2001 123.6770 51.6628 18.9788 177.5919 86 S 4.6362 8.6980 115.7835 59.5261 64.9138 174.6640 87 K 4.7214 7.5690 117.2506 55.5949 35.6521 175.0476 88 S 5.3370 8.7636 117.4092 56.9874 66.4489 173.7853 89 I 4.5908 9.1203 124.2738 59.5870 40.1172 174.8187 90 V 4.3093 8.4418 127.3139 62.0122 32.8725 175.1617 91 H 3.5285 8.5924 126.6913 55.8871 29.9494 174.3179 92 P 4.2820 0.0000 0.0000 65.3793 31.0493 177.0410 93 S 4.7054 7.7778 112.9929 58.0394 63.2119 173.0462 94 Y 4.2546 7.9491 122.8963 57.5778 38.8825 174.1625 95 N 4.5674 8.1787 126.7122 51.5030 39.0460 175.2687 96 S 3.8482 7.7558 120.1795 59.3998 63.5406 175.0674 97 N 4.4208 7.9941 118.9428 55.2110 38.7624 176.1280 98 T 3.9640 7.6644 105.4225 60.8457 69.9128 174.9331 99 L 3.6754 7.8117 121.1426 55.4524 39.6099 173.9244 100 N 4.4921 7.5474 117.2335 54.5762 39.6313 174.4440 101 N 4.7649 8.6606 119.3467 54.2459 35.8753 175.6091 102 D 4.7764 7.9290 117.5379 53.0122 39.5649 175.0367 103 I 4.8571 7.1222 120.8246 59.4943 42.4200 173.1371 104 M 5.4310 9.1641 126.0544 54.3310 36.2931 173.2382 105 L 5.4325 9.0603 123.3513 53.1321 45.2488 175.5170 106 I 5.1053 9.0999 122.8191 59.5113 40.8853 174.3175 107 K 3.9169 8.8830 128.1506 54.3967 34.2209 175.1604 108 L 4.6643 7.8675 126.1444 53.6923 42.4563 177.2580 109 K 4.1145 8.8649 122.2487 58.9215 32.4567 177.5921 110 S 4.6756 7.7780 112.7770 56.1864 66.6575 173.0927 111 A 4.5434 8.2541 123.3213 51.4843 19.2532 177.4380 112 A 4.2710 9.0705 123.2633 51.9241 19.7972 177.2449 113 S 4.6430 8.7528 115.9657 57.1083 63.8964 174.4979 114 L 4.6394 8.5020 125.3812 53.9945 42.9884 176.2133 115 N 4.8301 8.7742 117.9799 52.6134 39.6001 174.8708 116 S 4.2457 8.7651 112.8519 62.0618 63.3290 175.6983 117 R 4.1258 8.7477 119.1261 57.1043 30.5516 175.9903 118 V 4.4371 7.8476 115.8970 60.8911 33.1932 173.7624 119 A 5.1576 8.5095 128.2476 50.3436 23.0363 174.8836 120 S 5.0559 8.6878 113.7598 57.4417 65.1876 173.0965 121 I 4.4725 8.2082 120.6320 59.3217 40.1760 175.1320 122 S 4.5769 8.2779 122.4023 57.5075 64.0547 174.0046 123 L 4.3667 8.1113 123.6666 53.2823 42.5154 175.2153 124 P 4.5202 0.0000 0.0000 62.9339 32.4260 176.2944 125 T 4.0497 8.2645 109.3474 63.0892 69.7670 174.6461 *127 S 4.9310 7.5221 114.1827 58.2114 64.0577 173.3453 128 C 4.5361 8.3536 116.9831 56.0271 41.1234 173.3780 129 A 4.5818 7.8664 124.0299 50.9730 20.3432 177.4583 130 S 4.2164 8.0545 115.4429 57.7887 64.0707 173.7189 *132 A 4.1703 8.2249 124.9761 53.4360 19.4253 175.5099 133 G 4.1640 8.9198 109.6585 46.0233 0.0000 175.0749 134 T 3.9137 7.6797 116.3939 64.0852 69.4476 173.7768 135 Q 4.7292 8.6043 124.9444 55.5952 30.1694 175.6576 136 C 5.2789 9.2415 119.9963 55.0489 44.7970 172.2865 137 L 5.2861 9.1148 121.6767 53.4793 44.5008 175.0351 138 I 5.3138 9.1932 126.8361 58.7007 40.3787 174.7404 139 S 4.9371 8.8409 119.3487 56.2735 66.4622 173.0461 140 G 3.8643 7.3176 108.7397 45.9971 0.0000 172.6360 141 W 4.9323 8.5349 117.5788 56.2469 29.5801 177.1198 142 G 4.1270 8.3108 108.1699 43.9709 0.0000 173.6763 143 N 3.5252 8.0540 117.8920 54.2335 38.9603 174.4590 144 T 5.1233 8.1443 111.9616 60.3354 69.5879 173.9160 145 K 4.6115 7.7554 121.2654 54.8873 34.7796 176.3144 146 S 4.1388 8.8664 119.9510 61.4441 62.9783 175.2324 147 S 4.4649 9.2232 120.0285 59.2803 62.1029 173.7389 148 G 4.0581 7.3852 111.8651 43.7575 0.0000 170.3253 149 T 4.7623 7.8744 116.0592 61.9249 72.1497 174.2549 150 S 4.5339 9.4303 121.6657 57.5257 66.1419 172.1278 151 Y 4.9424 8.7363 125.3550 55.5090 39.6684 174.2260 152 P 4.6682 0.0000 0.0000 62.7685 32.7535 175.4720 153 D 4.9008 8.6762 117.6692 54.8945 42.7475 176.6514 154 V 5.4761 7.6924 110.0748 58.1780 34.7745 175.5240 155 L 3.2084 8.2874 123.7001 55.0795 43.1365 175.9296 156 K 4.8904 8.0222 124.5920 54.7219 35.5291 174.4945 157 C 5.3229 8.4770 120.5074 55.1692 42.1140 172.8948 158 L 4.8350 8.5384 122.4590 53.8789 45.5908 174.3030 159 K 5.2160 8.9209 125.3849 54.9391 33.8264 175.6204 160 A 5.2735 8.9901 125.6004 49.6936 23.2747 173.6558 161 P 5.0809 0.0000 0.0000 61.8452 33.9227 175.1840 162 I 4.2861 8.3691 121.7943 61.3868 38.2284 175.6747 163 L 5.0226 8.4989 126.1806 52.7615 43.9269 176.7162 164 S 4.3328 8.3955 114.7671 58.2217 63.7857 175.2834 165 D 4.4676 8.7059 122.2509 57.2699 40.5561 179.2906 166 S 4.1394 8.0419 115.0718 61.5320 62.9870 176.5813 167 S 4.5513 7.8396 119.1677 60.1509 62.8319 175.7536 168 C 4.3456 7.9946 122.4462 59.7772 43.2985 175.7749 169 K 3.9905 8.1930 119.0296 59.2790 31.9665 179.2621 170 S 4.2670 8.1510 114.5359 61.2108 62.7741 176.4275 171 A 3.9076 7.6054 123.8579 53.5506 19.7168 177.2473 172 Y 4.8240 7.7640 113.9427 55.2741 38.2420 172.9507 173 P 4.5120 0.0000 0.0000 63.9588 32.3278 177.0773 174 G 4.0106 8.9952 109.7246 46.3259 0.0000 173.8193 175 Q 4.5461 8.1583 117.7370 55.4816 30.7979 175.7848 176 I 4.3426 7.9006 119.2383 60.2349 38.1616 175.3029 177 T 4.6173 8.2159 115.4837 59.5829 71.0929 174.9484 178 S 4.3588 8.5343 114.5825 60.2352 63.2645 174.3058 179 N 4.9243 8.1141 118.7509 53.4337 38.4949 173.8654 180 M 5.8983 8.0360 117.1810 52.7801 36.2473 174.4903 181 F 5.0573 8.2111 113.7495 56.1134 41.6832 173.5891 182 C 5.5353 9.0372 116.6089 55.6203 39.2982 172.6576 183 A 4.9695 9.1735 121.8079 50.6400 22.4524 176.6749 184A G 3.7085 6.6260 107.1424 45.0301 0.0000 172.0117 184 Y 4.6069 8.1507 119.4292 55.9989 40.8040 176.4798 185 L 4.1587 8.6226 125.5448 57.2576 42.0813 179.1614 186 E 3.7952 8.1939 115.8089 57.4175 29.8403 177.3367 187 G 3.8778 7.4987 105.4199 44.7838 0.0000 171.4022 188A G 4.2193 8.7567 106.0406 44.8051 0.0000 174.4270 188 K 5.4163 7.1125 116.7061 53.4248 35.2150 175.2894 189 D 4.5764 8.2719 122.2635 54.2407 44.6909 174.8157 190 S 5.0391 8.7052 116.7327 57.7472 65.5253 172.8475 191 C 4.7602 9.0821 119.0071 55.2692 47.9182 172.4397 192 Q 4.3775 8.5167 119.2848 57.7050 28.3053 176.9198 193 G 4.3250 8.5662 109.7973 46.0940 0.0000 174.4693 194 D 4.6638 8.7445 118.8382 55.6292 41.6581 176.4467 195 S 4.2995 7.8794 114.6861 59.6597 63.0075 175.3453 196 G 4.2596 9.0172 113.9147 46.4707 0.0000 173.7521 197 G 3.9586 7.9510 107.1549 45.4834 0.0000 171.4597 198 P 5.0853 0.0000 0.0000 62.5793 33.4942 175.8268 199 V 4.6259 8.3057 120.1897 61.5317 34.2615 173.5012 200 V 4.8329 8.8746 128.7901 61.2596 33.9811 173.8051 201 C 5.0286 8.5835 124.1908 55.8211 44.2051 174.4860 202 S 3.4232 10.0228 119.1851 59.5112 60.0950 173.4937 203 G 3.9701 8.6775 107.0731 45.1362 0.0000 174.1658 204 K 4.8048 7.6479 118.3139 53.2520 35.0593 175.2439 *209 L 4.2601 8.2679 122.6822 55.4228 42.2876 175.8984 210 Q 4.6036 8.9090 125.4106 56.3158 31.2910 175.6794 211 G 5.1793 8.1016 103.7591 45.6690 0.0000 171.8655 212 I 5.0423 8.2473 119.2349 58.9439 41.3495 175.3176 213 V 3.7207 9.0425 127.3969 63.7763 31.7599 174.1765 214 S 5.0043 8.5569 121.2929 58.6113 64.4192 174.6649 215 W 4.9719 7.5783 114.4195 56.4575 32.0821 171.9606 216 G 3.6734 8.0866 104.2546 46.8059 0.0000 172.5896 217 S 4.7357 8.4539 115.5206 56.5303 63.4607 172.9004 *219 G 4.4759 8.0739 118.8860 45.6351 0.0000 171.2329 220 C 5.0390 8.2601 116.9821 56.2757 42.0870 173.3305 221A A 4.1783 8.5697 122.6953 53.2092 16.8581 176.7818 221 Q 4.7293 7.2889 117.1526 55.3598 30.4328 175.9304 222 K 4.2477 8.4900 122.5635 58.0186 32.6623 176.0934 223 N 4.2777 9.4120 121.8734 54.0769 36.9744 175.2937 224 K 4.4044 7.6452 116.8759 53.7107 32.1547 173.5190 225 P 4.6004 0.0000 0.0000 62.2633 33.2283 177.2097 226 G 3.7563 8.5109 107.2756 45.7444 0.0000 172.8460 227 V 4.3713 7.6949 121.0006 60.6930 34.2230 174.1476 228 Y 4.9197 8.1350 124.2657 56.0518 42.1271 174.9224 229 T 4.4298 8.5119 118.6028 63.5091 70.1701 174.7169 230 K 5.2403 9.1903 128.0406 54.9652 30.7003 177.0459 231 V 3.9812 8.6499 125.0634 65.8801 31.4615 174.5995 232 C 4.4629 8.3419 112.2505 57.8863 41.5105 174.6167 233 N 4.3021 8.1009 117.4694 54.1498 38.6136 174.9905 234 Y 4.8223 7.9846 117.8904 57.5634 39.1100 177.5752 235 V 3.6814 8.0472 121.9504 66.3859 31.4634 178.1826 236 S 4.1341 8.0931 114.3981 61.2174 62.6975 176.2876 237 W 4.1620 8.2620 130.6989 60.4071 30.4688 177.8911 238 I 3.0871 8.2981 120.0684 64.2260 36.4782 178.4174 239 K 3.7133 8.1571 119.4238 59.5765 31.6726 179.2485 240 Q 3.8517 8.0383 118.9166 59.2877 29.3453 178.0713 241 T 3.7193 7.5198 117.0313 66.5247 67.9483 176.8346 242 I 2.6063 7.1466 114.6308 63.2875 37.1365 177.8360 243 A 4.1159 7.3875 121.4594 53.8082 18.2843 178.6243 244 S 4.6950 7.2761 111.3591 58.2617 63.3327 174.0130 245 N 4.7006 7.8637 124.8794 53.6230 39.4867 174.1557 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 16 I 7.88 4.28 1.77 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 1.48 0.54 0.84 0.00 0.00 17 V 8.47 4.40 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 1.04 0.00 0.00 0.89 0.00 0.00 18 G 9.11 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 19 G 7.80 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 20 Y 7.49 4.96 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 8.57 4.34 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 8.83 4.40 0.00 2.76 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 23 G 8.68 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.58 4.38 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 8.81 4.24 0.00 2.86 2.91 0.00 0.00 7.35 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 26 T 7.63 4.22 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 1.32 0.00 0.00 27 V 7.03 4.04 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.00 0.77 0.00 0.00 28 P 0.00 4.53 0.00 2.36 2.37 0.00 3.76 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 2.16 1.95 0.00 29 Y 6.78 4.95 0.00 3.24 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.42 4.69 0.00 1.85 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.53 0.00 0.00 0.00 0.00 0.00 2.01 2.57 0.00 31 V 8.95 4.83 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 1.10 0.00 0.00 32 S 8.59 5.03 0.00 3.04 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 33 L 8.67 4.62 0.00 0.38 1.05 0.82 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.04 6.03 0.00 2.44 2.50 0.00 0.00 6.55 7.98 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 *37 S 8.45 4.40 0.00 3.71 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 38 G 8.83 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 39 Y 6.46 4.51 0.00 3.07 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 8.83 4.72 0.00 2.87 3.19 0.00 5.86 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 41 F 7.97 5.02 0.00 3.05 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 42 C 6.79 4.76 0.00 2.19 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 G 8.62 4.41 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 0.00 44 G 8.25 4.35 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 0.00 45 S 8.83 5.50 0.00 3.83 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 9.20 4.79 0.00 1.86 1.66 1.08 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.44 4.28 1.90 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 1.56 0.94 0.95 0.00 0.00 48 N 7.86 4.47 0.00 2.93 2.97 0.00 0.00 6.26 7.68 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 49 S 8.44 4.17 0.00 4.15 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.18 4.47 0.00 2.13 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 51 W 8.17 5.59 0.00 3.17 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 52 V 9.13 5.14 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 1.19 0.00 0.00 0.99 0.00 0.00 53 V 8.69 4.93 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 0.74 0.00 0.00 1.02 0.00 0.00 54 S 9.00 5.11 0.00 3.90 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 55 A 8.56 4.80 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 56 A 8.23 3.91 0.29 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 57 H 8.50 4.58 0.00 3.37 3.57 0.00 5.55 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.71 4.79 0.00 3.27 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 7.72 4.27 0.00 2.95 2.92 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 60 K 7.08 3.86 0.00 1.22 1.20 0.00 0.61 0.00 0.00 1.03 0.00 0.00 2.61 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.95 0.86 7.81 61 S 7.90 4.43 0.00 3.73 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.42 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.27 4.59 1.88 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 1.41 1.03 0.96 0.00 0.00 64 Q 8.70 4.81 0.00 2.02 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.17 2.23 0.00 65 V 9.08 4.40 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.92 0.00 0.00 66 R 8.91 5.26 0.00 1.70 1.84 0.00 2.68 0.00 0.00 2.44 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.26 0.00 67 L 9.23 4.76 0.00 1.57 1.60 0.95 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.24 4.53 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 0.00 0.00 0.00 70 E 8.45 4.73 0.00 2.09 1.88 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 2.36 2.09 0.00 71 D 7.79 4.77 0.00 2.76 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 72 N 8.70 4.99 0.00 2.85 2.80 0.00 0.00 7.22 8.01 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 73 I 8.45 4.13 1.47 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.55 -0.27 0.00 0.00 74 N 8.84 4.75 0.00 2.80 2.89 0.00 0.00 6.55 7.87 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 75 V 7.32 4.29 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 0.74 0.00 0.00 1.00 0.00 0.00 76 V 8.40 4.09 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 0.76 0.00 0.00 1.02 0.00 0.00 77 E 9.11 4.34 0.00 2.01 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.44 0.00 78 G 8.12 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 79 N 8.14 4.97 0.00 2.72 2.79 0.00 0.00 7.10 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 80 E 7.94 5.59 0.00 1.32 1.56 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 2.67 2.44 0.00 81 Q 8.29 4.29 0.00 1.94 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.85 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 82 F 8.77 5.64 0.00 2.81 2.90 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 83 I 8.96 4.71 1.88 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 1.23 0.98 0.95 0.00 0.00 84 S 8.65 4.87 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 8.20 4.77 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 86 S 8.70 4.64 0.00 3.78 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 87 K 7.57 4.72 0.00 1.86 1.89 0.00 1.46 0.00 0.00 1.96 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.24 1.53 7.81 88 S 8.76 5.34 0.00 3.98 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 89 I 9.12 4.59 2.04 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.20 1.14 0.00 0.00 90 V 8.44 4.31 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.76 0.00 0.00 91 H 8.59 3.53 0.00 2.89 3.08 0.00 5.66 0.00 0.00 0.00 0.00 6.66 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 4.28 0.00 2.15 2.18 0.00 2.57 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.89 0.00 93 S 7.78 4.71 0.00 3.92 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 94 Y 7.95 4.25 0.00 3.01 2.90 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 95 N 8.18 4.57 0.00 2.59 2.45 0.00 0.00 6.44 7.43 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 96 S 7.76 3.85 0.00 4.00 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 97 N 7.99 4.42 0.00 2.79 2.78 0.00 0.00 6.81 7.61 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 98 T 7.66 3.96 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 1.09 0.00 0.00 99 L 7.81 3.68 0.00 1.45 1.91 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.55 4.49 0.00 2.77 2.62 0.00 0.00 7.27 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 0.00 101 N 8.66 4.76 0.00 3.05 2.59 0.00 0.00 7.24 8.32 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 0.00 102 D 7.93 4.78 0.00 3.13 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.12 4.86 1.54 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 1.41 1.37 0.23 0.00 0.00 104 M 9.16 5.43 0.00 2.28 1.84 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.66 0.00 105 L 9.06 5.43 0.00 1.69 1.71 0.03 0.54 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 0.00 106 I 9.10 5.11 1.95 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 1.21 0.84 0.91 0.00 0.00 107 K 8.88 3.92 0.00 0.79 1.05 0.00 1.21 0.00 0.00 1.30 0.00 0.00 2.58 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.61 0.21 7.81 108 L 7.87 4.66 0.00 1.52 1.55 0.97 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.86 4.11 0.00 1.68 1.83 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.47 7.81 110 S 7.78 4.68 0.00 3.77 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 0.00 111 A 8.25 4.54 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 0.00 112 A 9.07 4.27 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 8.75 4.64 0.00 3.76 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.50 4.64 0.00 1.65 1.72 0.96 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.77 4.83 0.00 2.85 2.92 0.00 0.00 6.97 7.68 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 0.00 116 S 8.77 4.25 0.00 3.89 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 0.00 117 R 8.75 4.13 0.00 1.98 1.97 0.00 3.06 0.00 0.00 3.23 7.40 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.52 4.93 0.00 4.00 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 0.00 128 C 8.35 4.54 0.00 2.93 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.87 4.58 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 8.05 4.22 0.00 3.94 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *132 A 8.22 4.17 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 8.92 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 0.00 0.00 0.00 0.00 134 T 7.68 3.91 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 1.15 0.00 0.00 135 Q 8.60 4.73 0.00 1.94 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 136 C 9.24 5.28 0.00 2.77 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 0.00 137 L 9.11 5.29 0.00 1.74 1.54 1.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.19 5.31 1.87 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 1.47 1.03 0.00 0.00 139 S 8.84 4.94 0.00 3.52 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 0.00 140 G 7.32 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 8.53 4.93 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 8.31 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 8.05 3.53 0.00 2.14 2.57 0.00 0.00 7.28 7.16 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 0.00 144 T 8.14 5.12 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 1.26 0.00 0.00 145 K 7.76 4.61 0.00 1.60 1.71 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.28 1.33 7.81 146 S 8.87 4.14 0.00 3.87 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 0.00 147 S 9.22 4.46 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 0.00 148 G 7.39 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 T 7.87 4.76 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 1.47 0.00 0.00 150 S 9.43 4.53 0.00 3.81 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 0.00 151 Y 8.74 4.94 0.00 2.92 2.90 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 0.00 152 P 0.00 4.67 0.00 2.42 2.08 0.00 3.94 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 2.12 2.00 0.00 153 D 8.68 4.90 0.00 2.69 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 0.00 154 V 7.69 5.48 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 1.07 0.00 0.00 0.97 0.00 0.00 155 L 8.29 3.21 0.00 1.45 1.25 -0.85 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.02 4.89 0.00 1.57 1.47 0.00 1.59 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.44 7.81 157 C 8.48 5.32 0.00 1.46 2.29 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 0.00 158 L 8.54 4.84 0.00 1.66 1.42 1.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.92 5.22 0.00 1.80 1.81 0.00 1.86 0.00 0.00 1.77 0.00 0.00 2.74 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.46 1.63 7.81 160 A 8.99 5.27 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 P 0.00 5.08 0.00 2.05 2.13 0.00 3.20 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.84 0.00 162 I 8.37 4.29 1.76 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.62 0.79 0.00 0.00 163 L 8.50 5.02 0.00 1.55 1.59 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.40 4.33 0.00 4.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 D 8.71 4.47 0.00 2.73 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 S 8.04 4.14 0.00 4.05 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 S 7.84 4.55 0.00 4.06 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 0.00 168 C 7.99 4.35 0.00 3.13 3.41 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 0.00 169 K 8.19 3.99 0.00 1.87 1.91 0.00 1.80 0.00 0.00 1.80 0.00 0.00 3.12 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.60 7.81 170 S 8.15 4.27 0.00 4.06 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 0.00 171 A 7.61 3.91 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.76 4.82 0.00 3.18 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 P 0.00 4.51 0.00 2.07 2.04 0.00 3.86 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.33 0.00 174 G 9.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 8.16 4.55 0.00 2.48 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.32 6.62 0.00 0.00 0.00 0.00 0.00 2.30 2.61 0.00 176 I 7.90 4.34 1.98 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 1.89 0.93 0.98 0.00 0.00 177 T 8.22 4.62 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 8.53 4.36 0.00 4.01 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 0.00 179 N 8.11 4.92 0.00 3.01 3.09 0.00 0.00 6.63 9.28 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 0.00 180 M 8.04 5.90 0.00 1.76 1.97 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.44 0.00 181 F 8.21 5.06 0.00 3.05 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 C 9.04 5.54 0.00 2.96 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 0.00 183 A 9.17 4.97 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184A G 6.63 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 Y 8.15 4.61 0.00 3.12 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 0.00 185 L 8.62 4.16 0.00 1.73 1.73 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.19 3.80 0.00 2.10 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 0.00 2.38 2.30 0.00 187 G 7.50 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188A G 8.76 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 0.00 188 K 7.11 5.42 0.00 1.52 1.72 0.00 0.90 0.00 0.00 1.96 0.00 0.00 2.41 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.42 1.10 7.81 189 D 8.27 4.58 0.00 2.78 2.54 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 0.00 0.00 0.00 0.00 190 S 8.71 5.04 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 0.00 191 C 9.08 4.76 0.00 2.94 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 8.52 4.38 0.00 2.43 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.17 5.66 0.00 0.00 0.00 0.00 0.00 2.49 2.51 0.00 193 G 8.57 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.74 4.66 0.00 2.99 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 0.00 195 S 7.88 4.30 0.00 3.97 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 G 9.02 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 0.00 197 G 7.95 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.09 0.00 2.32 2.35 0.00 3.72 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.27 0.00 199 V 8.31 4.63 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 0.84 0.00 0.00 0.74 0.00 0.00 200 V 8.87 4.83 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.63 0.00 0.00 201 C 8.58 5.03 0.00 2.81 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 S 10.02 3.42 0.00 3.96 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 0.00 203 G 8.68 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 0.00 204 K 7.65 4.80 0.00 1.73 1.64 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.30 1.40 7.81 *209 L 8.27 4.26 0.00 1.50 1.63 0.99 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 8.91 4.60 0.00 1.98 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.31 0.00 0.00 0.00 0.00 0.00 2.44 2.34 0.00 211 G 8.10 5.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.25 5.04 1.93 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.11 1.03 0.00 0.00 213 V 9.04 3.72 2.31 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 0.96 0.00 0.00 1.19 0.00 0.00 214 S 8.56 5.00 0.00 3.90 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 0.00 215 W 7.58 4.97 0.00 3.34 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 0.00 216 G 8.09 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 0.00 217 S 8.45 4.74 0.00 4.22 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 *219 G 8.07 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 8.26 5.04 0.00 2.94 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221A A 8.57 4.18 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 Q 7.29 4.73 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 7.16 0.00 0.00 0.00 0.00 0.00 2.53 2.46 0.00 222 K 8.49 4.25 0.00 1.80 1.72 0.00 1.93 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.59 7.81 223 N 9.41 4.28 0.00 2.83 2.82 0.00 0.00 6.79 8.22 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 0.00 224 K 7.65 4.40 0.00 1.91 1.82 0.00 1.52 0.00 0.00 1.43 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.50 7.81 225 P 0.00 4.60 0.00 2.12 2.11 0.00 3.72 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.01 0.00 226 G 8.51 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.69 4.37 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 0.17 0.00 0.00 -0.84 0.00 0.00 228 Y 8.13 4.92 0.00 1.43 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.51 4.43 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 1.22 0.00 0.00 230 K 9.19 5.24 0.00 2.12 1.92 0.00 1.81 0.00 0.00 1.78 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.64 7.81 231 V 8.65 3.98 2.31 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 1.13 0.00 0.00 1.12 0.00 0.00 232 C 8.34 4.46 0.00 3.17 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 N 8.10 4.30 0.00 2.30 2.37 0.00 0.00 6.89 7.32 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 0.00 234 Y 7.98 4.82 0.00 3.14 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 V 8.05 3.68 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 1.13 0.00 0.00 1.10 0.00 0.00 236 S 8.09 4.13 0.00 3.97 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 0.00 237 W 8.26 4.16 0.00 3.45 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 8.30 3.09 2.01 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 1.56 0.94 0.74 0.00 0.00 239 K 8.16 3.71 0.00 1.72 1.79 0.00 1.64 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.60 7.81 240 Q 8.04 3.85 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.94 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 241 T 7.52 3.72 3.53 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 0.72 0.00 0.00 242 I 7.15 2.61 0.63 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.51 -0.38 0.00 0.00 243 A 7.39 4.12 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 0.00 244 S 7.28 4.70 0.00 3.81 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 N 7.86 4.70 0.00 3.03 3.03 0.00 0.00 6.94 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.