NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5191 8.1633 120.2462 55.2117 33.9060 174.2462 2 N 5.2282 8.7456 120.4160 52.2503 40.4891 172.3772 3 I 4.8357 9.8038 123.0235 59.6645 42.7503 173.1181 4 I 4.9047 8.3554 128.6920 59.4304 39.9715 174.2515 5 L 4.9582 9.1137 128.8792 53.2316 44.5125 175.0447 6 K 4.6476 9.3605 129.8413 55.1389 33.7828 175.4193 7 I 4.2886 8.4254 130.5489 59.7991 38.3245 175.8266 8 S 4.3776 8.8143 123.1397 58.3427 63.1863 175.6358 9 G 3.9360 9.0310 113.7844 48.6808 0.0000 175.8492 10 K 4.3192 8.0076 120.3904 58.7090 31.7161 178.6403 11 F 3.2869 7.4685 121.0143 60.2516 39.0888 176.7357 12 F 4.4512 7.9853 114.7674 58.9366 39.3000 177.3713 13 D 4.6016 8.1862 118.9276 56.7904 40.5019 177.8363 14 E 4.1082 8.1170 117.0888 56.7586 29.5491 176.1904 15 D 4.4990 7.5361 117.7060 54.8628 39.4171 173.8455 16 N 4.5799 7.7897 116.0551 52.7086 39.6751 175.8194 17 V 3.7492 8.2732 119.6447 63.9163 32.0274 177.9475 18 D 4.3918 8.1004 118.5218 57.7226 40.3607 178.7113 19 N 4.1092 7.7376 115.7608 56.2272 38.4178 177.0990 20 L 4.2106 7.0950 118.6742 58.0863 41.6509 179.5822 21 I 3.7355 8.4577 120.2785 64.6561 37.1486 178.8212 22 V 3.7814 7.7986 119.0690 64.1556 31.3828 178.3128 23 L 3.8991 8.2430 121.4686 58.2342 42.1669 178.7034 24 R 3.9578 8.2154 118.6925 59.6574 29.8469 178.4951 25 Q 4.0264 7.9811 117.8813 59.0286 28.7328 178.8415 26 S 4.1823 8.1109 114.9617 60.9923 63.0623 176.6397 27 I 3.6787 7.8634 123.8519 64.2153 36.8953 178.1377 28 K 3.8906 7.8529 118.8237 59.6645 31.5305 178.9295 29 E 3.9673 8.2229 118.5420 59.6077 29.4628 179.5829 30 L 3.8586 8.2014 118.8662 57.6565 41.6595 179.4247 31 A 4.2410 8.6558 121.0113 55.2532 18.2312 178.7798 32 D 4.6199 8.4522 113.3862 55.7148 41.1927 175.8890 33 N 5.0405 7.3306 115.1462 53.7461 39.7951 174.4905 34 G 3.8945 8.1429 104.1682 46.6093 0.0000 173.9289 35 F 4.9644 8.2868 117.9530 55.7252 40.6621 175.9351 36 R 4.5386 8.7140 122.3214 55.2916 31.7344 175.6014 37 V 5.1643 8.5226 122.1696 61.1873 34.9845 174.0821 38 G 4.7082 9.4610 115.0460 44.7241 0.0000 172.1797 39 I 5.1889 9.2381 124.0548 59.1633 41.1756 174.5831 40 V 4.7566 8.7504 126.3186 61.2556 33.6203 174.0365 41 T 4.9504 8.9323 119.0737 59.9207 70.9187 174.7451 42 G 3.7669 8.6378 112.7626 45.4852 0.0000 174.1710 43 G 3.7137 8.8592 108.8535 46.0807 0.0000 175.1516 44 G 4.0846 8.1617 109.1778 46.2172 0.0000 174.6834 45 S 4.2353 9.3707 113.3666 61.6072 62.9338 176.7757 46 T 3.9526 8.0531 118.8359 66.4898 68.1958 175.7631 47 A 4.0876 7.9468 122.7052 55.5086 18.4458 179.9490 48 R 3.9723 7.9327 113.5130 58.7434 29.4316 178.9639 49 R 3.8829 8.3502 120.6854 59.7218 30.0439 177.9633 50 Y 3.8987 8.5151 116.7292 60.7936 37.9226 178.1975 51 I 3.7965 8.2635 121.2163 64.2022 37.3814 178.2437 52 K 3.9129 8.2268 120.5734 59.4847 31.7695 178.6033 53 L 3.9189 7.5049 119.2886 58.0184 42.4489 178.4285 54 A 4.1573 8.2972 121.0337 55.2073 18.3298 179.5494 55 R 3.8698 8.6515 117.5875 59.5603 29.9182 178.1130 56 E 4.0943 7.9235 118.0899 58.5330 29.4613 177.9274 57 I 4.4584 7.3221 110.6818 60.2314 38.3429 175.6592 58 G 3.8761 8.3415 107.1333 47.1226 0.0000 174.6136 59 I 3.8974 7.8628 120.0371 60.3038 37.9979 177.1860 60 G 3.9584 8.6855 111.0006 44.6508 0.0000 174.0408 61 E 3.9786 8.8887 121.2262 59.2714 29.5286 179.1493 62 A 3.8768 7.9068 120.1467 55.4077 18.4491 179.0197 63 Y 4.1402 7.7939 114.4779 60.6295 38.0889 178.1302 64 L 4.0950 8.0826 120.3190 57.8204 41.6618 178.9520 65 D 4.3837 8.1401 118.7756 57.6153 40.7503 178.9405 66 L 3.9256 7.8246 119.1809 57.8913 41.6256 179.6918 67 L 4.2948 8.3012 119.0680 57.8529 41.5181 179.8300 68 G 3.6695 8.2989 105.7242 47.6407 0.0000 175.8896 69 I 3.5907 7.9150 122.3098 64.1344 37.1363 178.5680 70 W 4.3733 8.4695 119.8867 59.6645 28.8698 178.5126 71 A 3.9718 8.1688 121.1168 55.1763 17.8707 179.8989 72 S 4.1727 8.3641 113.0211 61.4106 62.9964 176.9372 73 R 3.8422 8.0416 122.0695 58.7817 29.8150 178.4675 74 L 4.1621 8.0891 120.3556 58.3933 42.0567 178.9015 75 N 4.0120 7.9167 115.6611 55.7088 38.1980 177.3282 76 A 3.8821 7.5089 123.7040 54.7252 18.3682 179.2319 77 Y 3.3960 7.9910 115.5648 60.7541 37.6368 178.4640 78 L 4.1047 7.4748 119.9304 58.3194 42.3591 178.8964 79 V 3.8594 7.8807 117.9059 66.1891 31.4755 177.4126 80 M 4.0245 8.2347 118.2114 59.0084 32.2270 178.2380 81 F 4.6892 8.8447 118.6284 60.4878 38.8098 177.4150 82 S 4.5405 7.9497 112.6830 60.1606 63.5133 175.5695 83 L 4.3331 8.6075 121.6478 55.3146 41.7674 175.8702 84 Q 3.5386 7.1151 117.7803 54.9093 29.7005 176.9001 85 D 4.7750 8.9828 123.1520 54.3903 40.9378 173.9977 86 L 4.5807 8.1285 116.5733 54.8456 43.6870 175.8753 87 A 5.2966 7.6779 119.9531 49.8710 21.5939 175.0094 88 Y 4.2434 8.9379 122.9113 57.7263 39.7286 177.2707 89 M 4.4624 7.8517 129.6999 54.2282 30.7406 175.7660 90 H 4.7118 7.3431 116.0003 55.1075 33.3787 172.8763 91 V 4.2162 8.1530 125.9655 59.1707 31.0960 173.2642 92 P 4.3689 0.0000 0.0000 63.6513 31.3207 176.3066 93 Q 4.6449 8.7359 118.9296 55.5619 29.3840 175.8280 94 S 3.7913 7.1259 112.1070 55.7859 66.6848 175.1008 95 L 3.4162 7.0360 124.0410 58.1340 41.6499 179.0185 96 E 3.9313 7.8222 118.0291 59.5023 29.3879 179.0706 97 E 3.9831 8.1473 118.5968 59.1120 29.4710 178.9866 98 F 4.0731 8.2272 120.7761 61.5674 39.2443 177.0834 99 I 3.7851 7.7778 117.8772 64.4925 37.1689 178.0223 100 Q 3.9860 7.7304 120.2264 59.4368 28.9070 177.9002 101 D 3.7741 8.2872 120.2504 56.8929 40.9175 178.6821 102 W 3.8474 8.2671 129.0739 60.0514 30.3372 178.1102 103 S 4.1152 7.5565 114.6861 61.6836 62.4621 175.5794 104 H 4.4140 7.4815 116.9584 55.8314 28.0541 176.8519 105 G 3.5275 7.3528 108.4055 45.6248 0.0000 173.5133 106 K 4.4475 6.8388 118.4700 53.9428 34.9257 175.6927 107 V 4.1014 8.0236 119.3873 62.7285 32.7787 175.1986 108 V 4.8348 8.6985 126.3222 61.1253 34.7906 173.8780 109 V 4.9599 8.5194 127.0560 61.5861 34.0191 174.3228 110 T 4.7508 9.4221 123.5551 61.7528 72.6432 173.1633 111 G 4.0434 8.1875 112.1370 44.9137 0.0000 172.9427 112 G 3.6264 8.2062 112.8651 45.4277 0.0000 172.4619 113 F 5.1075 8.4259 114.8921 58.4610 39.9955 175.7854 114 Q 4.5310 7.7310 119.5387 53.2798 32.1343 172.3412 115 P 4.4151 0.0000 0.0000 63.8050 31.8423 177.1208 116 G 3.9585 9.9319 109.6175 45.3966 0.0000 172.8336 117 Q 4.5259 7.2062 116.2409 54.4938 31.8459 173.4853 118 S 4.7649 8.1377 111.4815 55.9086 66.1390 174.8841 119 T 3.7104 8.2987 110.0763 64.3156 67.9914 176.0764 120 A 3.9028 7.6798 123.8751 55.2030 18.4075 179.3186 121 A 3.8485 7.6869 118.6178 55.2120 18.4426 179.9201 122 V 3.2435 7.4823 115.9172 66.0091 31.5118 177.7600 123 A 3.7711 8.4881 120.7490 55.0581 18.0661 179.4927 124 A 3.8142 7.9397 119.0759 55.2128 18.5268 179.6612 125 L 3.8366 8.1288 117.8826 58.1736 41.8105 180.0641 126 V 3.0827 8.0588 117.9849 65.5286 31.2031 177.9465 127 A 3.7483 7.7894 120.5882 54.9264 18.2697 179.1001 128 E 3.7472 8.2853 117.8629 59.5682 29.5519 178.9701 129 A 4.0481 8.1962 119.7222 54.3681 18.4139 178.6602 130 S 4.2374 7.4665 110.1128 57.1595 63.6078 174.1658 131 S 3.7029 7.7167 116.6777 59.9318 60.6816 172.3789 132 S 4.7819 8.1459 115.5829 57.1625 63.6637 175.0997 133 K 4.3440 8.6296 123.7023 57.8894 33.3981 176.5069 134 T 5.0470 7.8402 116.7061 61.4045 72.6827 172.5080 135 L 4.8833 8.9094 127.6982 53.3237 44.9055 175.1008 136 V 4.4028 8.8588 128.0281 61.7427 33.2196 174.8804 137 V 4.4265 8.9064 129.5216 61.4464 32.5738 174.4788 138 A 4.8726 8.9856 132.1210 51.4583 19.3739 175.9339 139 T 4.9018 9.4518 118.7211 60.3442 71.2066 173.5709 140 N 4.0553 8.2610 117.7786 51.8203 38.2864 175.0828 141 V 4.4303 7.2186 116.9110 62.3167 34.9121 174.5521 142 D 4.5121 9.0022 126.5257 56.6327 41.6605 176.9415 143 G 3.9983 6.5145 106.2997 46.3504 0.0000 172.4138 144 V 4.1729 9.9903 122.6454 61.2012 32.9837 175.2491 145 Y 5.0055 8.2759 123.7972 55.9590 40.7337 175.6600 146 E 4.1723 8.3916 119.1957 58.6247 29.6963 178.2522 147 K 4.4403 7.4789 115.9194 53.6751 35.5145 175.2124 148 D 4.3183 8.7765 121.4053 54.5268 41.2232 174.9332 149 P 4.2945 0.0000 0.0000 63.9756 31.4187 176.8978 150 R 3.4603 7.5345 116.1614 59.2444 30.4489 176.4742 151 I 4.2453 7.1405 129.0504 59.7922 38.3406 174.2589 152 Y 4.4417 8.2888 117.3768 56.9962 39.9955 172.6404 153 A 3.8370 8.1703 129.4758 52.5729 17.9801 177.9804 154 D 4.0486 9.1608 120.2400 55.5453 41.3073 177.0068 155 V 2.8839 8.3930 118.5229 62.8215 32.2925 174.6535 156 K 4.3107 8.1326 115.7376 55.0898 34.9714 173.7968 157 L 3.8140 9.0199 130.8542 55.0936 42.8942 175.9063 158 I 4.2814 8.3134 127.7866 58.9150 38.1363 173.6100 159 P 4.6654 0.0000 0.0000 64.9364 32.3462 175.8611 160 H 5.3141 7.8472 115.7327 54.2306 32.8993 172.8547 161 L 4.5502 8.1417 120.2750 55.8044 44.2008 173.0623 162 T 5.3583 8.1914 108.1859 59.5281 71.9705 175.2807 163 T 3.9958 8.8526 112.7419 64.1741 68.4294 176.4685 164 Q 4.0850 7.8575 121.1372 58.8421 29.0421 177.4111 165 D 4.4015 7.8325 117.8724 56.3142 40.8480 177.9911 166 L 4.1631 7.6767 120.8577 57.7635 42.4905 177.9970 167 R 4.0657 7.5870 116.8799 59.1472 30.2133 178.9208 168 K 4.4277 8.1942 112.9023 57.1181 32.2381 176.6382 169 I 4.2978 7.6765 124.2032 60.5517 39.7399 173.9178 *182 E 4.1790 8.5272 126.3623 56.6410 30.2574 176.3003 183 L 3.4815 8.5598 115.1833 54.8052 38.8849 174.8826 184 L 5.1734 6.7752 125.6999 54.4071 44.8464 172.6245 185 D 4.9544 7.6222 126.6425 50.3917 43.2253 174.8845 186 P 4.1699 0.0000 0.0000 66.3586 30.7730 177.9883 187 L 3.8601 7.9786 119.9843 57.2679 41.8644 178.4641 188 A 3.9374 8.7344 120.9608 55.3948 18.3525 179.6985 189 I 3.6070 7.5917 117.8764 64.2642 37.1602 178.4573 190 K 3.8463 8.1840 120.5804 59.6402 32.0076 178.8238 191 I 3.6617 7.9868 120.0741 64.6437 37.1121 178.9959 192 V 3.6746 8.0827 113.3242 64.0584 31.2198 178.7103 193 E 3.9325 8.2035 118.8910 59.3744 29.2960 179.3377 194 R 3.9992 7.9570 114.6176 58.6202 29.4257 177.9756 195 S 4.5581 7.8270 112.7324 56.4285 64.5981 174.3797 196 K 3.7998 7.4510 120.0857 57.4752 29.6457 174.2923 197 I 4.6734 8.2174 118.7339 59.4775 39.4596 177.4182 198 R 4.4893 8.8152 123.8901 55.3992 31.5981 175.2980 199 V 4.7102 8.4477 121.6842 61.3224 34.1266 174.2308 200 I 4.6782 8.6505 129.2104 59.6616 39.3388 174.7366 201 V 4.6108 8.8507 129.2636 62.0713 32.7081 174.8431 202 M 5.3918 8.7690 124.0325 53.7961 35.5732 173.3572 203 N 4.9484 8.5767 118.1749 53.0403 39.7404 175.2892 204 Y 4.3799 9.2299 124.3476 59.0231 38.4091 178.2887 205 R 4.0880 8.5342 120.3743 58.7469 30.4466 177.3865 206 K 4.5814 8.0501 116.5783 56.1842 32.1914 178.0805 207 L 4.2073 7.7189 120.2245 56.5672 41.4658 177.6655 208 N 4.6689 7.9816 114.7373 53.6495 38.3862 176.2522 209 R 4.3890 7.9211 118.2575 56.2707 30.1808 177.4834 210 I 3.5907 7.6599 121.4090 64.5745 37.5128 177.7314 211 I 3.6625 7.5832 119.0587 64.2240 37.1964 177.8093 212 D 4.4645 7.8871 119.2452 57.4201 40.8492 178.1911 213 I 3.6538 7.7463 120.4402 64.7016 36.9737 178.1785 214 L 3.9819 7.7740 117.9591 57.1153 41.5699 178.3899 215 K 4.3490 8.2614 114.9258 56.3549 32.8007 177.1802 216 G 3.9925 8.2374 108.3370 45.7608 0.0000 173.5988 217 E 4.5860 7.5337 117.9163 55.7611 30.1840 175.3735 218 E 4.6890 7.8029 115.5071 54.9871 32.4133 175.1193 219 V 3.6409 8.4253 117.7048 61.3994 31.9425 175.9158 220 S 5.2232 7.4580 120.0580 58.6475 65.1640 175.5920 221 S 4.8290 7.9988 116.9771 56.8139 65.4866 173.2372 222 I 4.7409 8.1460 125.6854 59.6523 39.3425 174.7684 223 I 4.5030 9.0080 129.6148 60.2485 38.5554 174.8995 224 E 4.8699 9.0799 128.2512 54.4330 31.0299 174.3976 225 P 4.6653 0.0000 0.0000 63.0732 32.5545 176.8159 226 V 3.9980 7.8800 113.2491 62.0511 32.8314 174.2470 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 8.16 4.52 0.00 2.00 1.77 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.52 0.00 2 N 8.75 5.23 0.00 2.89 3.03 0.00 0.00 6.52 6.44 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 3 I 9.80 4.84 2.08 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 1.25 1.80 1.10 0.00 0.00 4 I 8.36 4.90 1.80 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.71 0.86 0.00 0.00 5 L 9.11 4.96 0.00 1.62 1.48 0.86 0.54 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 6 K 9.36 4.65 0.00 1.73 1.63 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.79 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.28 1.48 7.81 7 I 8.43 4.29 1.78 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.97 -0.21 0.00 0.00 8 S 8.81 4.38 0.00 4.05 4.07 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 9 G 9.03 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 K 8.01 4.32 0.00 2.12 2.06 0.00 1.86 0.00 0.00 1.78 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.57 1.45 7.81 11 F 7.47 3.29 0.00 2.12 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 F 7.99 4.45 0.00 3.11 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 13 D 8.19 4.60 0.00 2.76 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 14 E 8.12 4.11 0.00 1.78 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 2.33 2.54 0.00 15 D 7.54 4.50 0.00 2.70 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 16 N 7.79 4.58 0.00 2.57 2.56 0.00 0.00 7.03 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 17 V 8.27 3.75 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 0.89 0.00 0.00 0.91 0.00 0.00 18 D 8.10 4.39 0.00 2.72 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 19 N 7.74 4.11 0.00 1.94 1.42 0.00 0.00 7.06 6.74 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 20 L 7.10 4.21 0.00 1.86 1.81 1.03 1.07 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 21 I 8.46 3.74 2.04 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 1.87 1.61 0.93 0.00 0.00 22 V 7.80 3.78 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 0.95 0.00 0.00 1.00 0.00 0.00 23 L 8.24 3.90 0.00 1.90 2.00 0.79 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 24 R 8.22 3.96 0.00 1.98 2.13 0.00 3.19 0.00 0.00 3.39 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.73 0.00 25 Q 7.98 4.03 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.58 0.00 0.00 0.00 0.00 0.00 2.68 2.53 0.00 26 S 8.11 4.18 0.00 4.03 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 27 I 7.86 3.68 2.04 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 1.76 0.97 0.95 0.00 0.00 28 K 7.85 3.89 0.00 2.09 1.90 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.66 7.81 29 E 8.22 3.97 0.00 2.19 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 0.00 2.35 2.60 0.00 30 L 8.20 3.86 0.00 1.82 1.70 0.79 -0.14 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 31 A 8.66 4.24 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 32 D 8.45 4.62 0.00 2.89 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 33 N 7.33 5.04 0.00 2.87 2.97 0.00 0.00 6.90 7.53 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 34 G 8.14 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 35 F 8.29 4.96 0.00 3.05 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 R 8.71 4.54 0.00 2.24 1.71 0.00 2.84 0.00 0.00 3.11 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.55 0.00 37 V 8.52 5.16 2.18 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 1.07 0.00 0.00 1.01 0.00 0.00 38 G 9.46 4.71 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 39 I 9.24 5.19 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 1.13 0.89 0.93 0.00 0.00 40 V 8.75 4.76 1.96 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 0.90 0.00 0.00 0.73 0.00 0.00 41 T 8.93 4.95 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 1.33 0.00 0.00 42 G 8.64 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 43 G 8.86 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 44 G 8.16 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 45 S 9.37 4.24 0.00 4.08 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 0.00 46 T 8.05 3.95 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 1.31 0.00 0.00 47 A 7.95 4.09 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 48 R 7.93 3.97 0.00 2.06 2.25 0.00 2.81 0.00 0.00 3.13 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.81 0.00 49 R 8.35 3.88 0.00 2.09 2.28 0.00 3.08 0.00 0.00 2.75 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.80 0.00 50 Y 8.52 3.90 0.00 3.16 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 51 I 8.26 3.80 2.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.87 0.96 0.00 0.00 52 K 8.23 3.91 0.00 1.99 1.80 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.61 7.81 53 L 7.50 3.92 0.00 1.58 1.81 0.88 0.94 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 54 A 8.30 4.16 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 R 8.65 3.87 0.00 1.94 1.96 0.00 3.14 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 56 E 7.92 4.09 0.00 2.33 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 0.00 2.33 2.34 0.00 57 I 7.32 4.46 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 1.61 0.81 0.91 0.00 0.00 58 G 8.34 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 59 I 7.86 3.90 1.95 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 1.57 0.90 1.04 0.00 0.00 60 G 8.69 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 61 E 8.89 3.98 0.00 2.11 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 2.39 2.46 0.00 62 A 7.91 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 7.79 4.14 0.00 3.24 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 64 L 8.08 4.10 0.00 1.89 1.77 0.97 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 65 D 8.14 4.38 0.00 2.87 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 66 L 7.82 3.93 0.00 2.00 1.92 0.83 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 67 L 8.30 4.29 0.00 2.01 1.87 1.09 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.30 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 69 I 7.92 3.59 1.81 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.87 0.52 0.00 0.00 70 W 8.47 4.37 0.00 3.53 3.08 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 71 A 8.17 3.97 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 72 S 8.36 4.17 0.00 4.17 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 73 R 8.04 3.84 0.00 2.32 2.20 0.00 2.26 0.00 0.00 2.88 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 74 L 8.09 4.16 0.00 1.89 1.85 0.94 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 75 N 7.92 4.01 0.00 2.48 1.43 0.00 0.00 6.90 7.24 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 76 A 7.51 3.88 1.10 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 77 Y 7.99 3.40 0.00 2.93 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 78 L 7.47 4.10 0.00 1.68 1.90 1.05 1.23 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 79 V 7.88 3.86 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.29 0.00 0.00 80 M 8.23 4.02 0.00 1.98 1.95 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.72 0.00 81 F 8.84 4.69 0.00 3.33 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 S 7.95 4.54 0.00 4.06 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 83 L 8.61 4.33 0.00 1.92 1.79 0.97 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 84 Q 7.12 3.54 0.00 2.38 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 5.71 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 85 D 8.98 4.77 0.00 2.87 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 86 L 8.13 4.58 0.00 2.11 1.69 0.95 0.66 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 87 A 7.68 5.30 1.31 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 88 Y 8.94 4.24 0.00 2.88 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 89 M 7.85 4.46 0.00 2.07 1.88 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.45 0.00 90 H 7.34 4.71 0.00 2.95 3.27 0.00 5.70 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 V 8.15 4.22 1.62 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 0.72 0.00 0.00 -0.09 0.00 0.00 92 P 0.00 4.37 0.00 2.48 2.38 0.00 4.05 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 93 Q 8.74 4.64 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.67 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 94 S 7.13 3.79 0.00 3.71 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 95 L 7.04 3.42 0.00 1.50 1.46 0.91 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 96 E 7.82 3.93 0.00 1.96 1.94 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 2.34 2.30 0.00 97 E 8.15 3.98 0.00 2.16 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 2.32 0.00 98 F 8.23 4.07 0.00 3.30 3.26 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 99 I 7.78 3.79 2.08 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 1.48 0.88 0.93 0.00 0.00 100 Q 7.73 3.99 0.00 2.03 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.78 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 101 D 8.29 3.77 0.00 2.70 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 0.00 102 W 8.27 3.85 0.00 2.70 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 0.00 103 S 7.56 4.12 0.00 3.81 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 0.00 104 H 7.48 4.41 0.00 2.86 3.12 0.00 5.74 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 0.00 105 G 7.35 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 0.00 0.00 0.00 0.00 106 K 6.84 4.45 0.00 1.92 1.96 0.00 1.82 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.49 7.81 107 V 8.02 4.10 2.21 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 1.14 0.00 0.00 1.02 0.00 0.00 108 V 8.70 4.83 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 1.04 0.00 0.00 109 V 8.52 4.96 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 0.92 0.00 0.00 0.96 0.00 0.00 110 T 9.42 4.75 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 111 G 8.19 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 0.00 112 G 8.21 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.43 5.11 0.00 3.08 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 0.00 114 Q 7.73 4.53 0.00 2.03 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.21 7.02 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 115 P 0.00 4.42 0.00 2.01 1.98 0.00 3.68 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 1.91 1.99 0.00 116 G 9.93 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 0.00 117 Q 7.21 4.53 0.00 2.20 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.63 0.00 0.00 0.00 0.00 0.00 2.35 2.20 0.00 118 S 8.14 4.76 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 0.00 119 T 8.30 3.71 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 1.10 0.00 0.00 120 A 7.68 3.90 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 A 7.69 3.85 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 0.00 122 V 7.48 3.24 1.86 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 -0.27 0.00 0.00 0.44 0.00 0.00 123 A 8.49 3.77 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 0.00 124 A 7.94 3.81 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 0.00 125 L 8.13 3.84 0.00 1.83 1.74 1.02 0.76 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 0.00 126 V 8.06 3.08 1.77 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 0.05 0.00 0.00 -0.10 0.00 0.00 127 A 7.79 3.75 1.31 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 0.00 128 E 8.29 3.75 0.00 1.97 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 2.26 2.29 0.00 129 A 8.20 4.05 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 0.00 130 S 7.47 4.24 0.00 3.03 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 0.00 131 S 7.72 3.70 0.00 4.10 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 0.00 132 S 8.15 4.78 0.00 3.87 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 0.00 133 K 8.63 4.34 0.00 1.74 1.85 0.00 1.62 0.00 0.00 1.83 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.52 1.49 7.81 134 T 7.84 5.05 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 1.27 0.00 0.00 135 L 8.91 4.88 0.00 1.66 1.45 0.90 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 136 V 8.86 4.40 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 0.82 0.00 0.00 0.89 0.00 0.00 137 V 8.91 4.43 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.90 0.00 0.00 138 A 8.99 4.87 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 0.00 139 T 9.45 4.90 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 1.31 0.00 0.00 140 N 8.26 4.06 0.00 2.51 2.60 0.00 0.00 5.64 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 0.00 141 V 7.22 4.43 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 1.16 0.00 0.00 0.96 0.00 0.00 142 D 9.00 4.51 0.00 2.91 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 0.00 143 G 6.51 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 0.00 0.00 0.00 144 V 9.99 4.17 1.96 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 0.95 0.00 0.00 0.87 0.00 0.00 145 Y 8.28 5.01 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 0.00 146 E 8.39 4.17 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 2.50 2.26 0.00 147 K 7.48 4.44 0.00 1.18 0.85 0.00 1.43 0.00 0.00 1.10 0.00 0.00 2.83 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.12 1.19 7.81 148 D 8.78 4.32 0.00 2.69 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 P 0.00 4.29 0.00 1.67 0.95 0.00 3.83 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 1.77 1.39 0.00 150 R 7.53 3.46 0.00 1.98 1.94 0.00 3.11 0.00 0.00 3.23 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 151 I 7.14 4.25 1.76 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 1.38 0.83 0.83 0.00 0.00 152 Y 8.29 4.44 0.00 3.09 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 0.00 153 A 8.17 3.84 1.31 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 0.00 154 D 9.16 4.05 0.00 2.81 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 0.00 155 V 8.39 2.88 1.94 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 0.65 0.00 0.00 0.90 0.00 0.00 156 K 8.13 4.31 0.00 1.89 1.63 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.35 1.45 7.81 157 L 9.02 3.81 0.00 1.33 1.44 0.67 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 158 I 8.31 4.28 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 1.23 0.99 0.88 0.00 0.00 159 P 0.00 4.67 0.00 2.23 2.28 0.00 3.84 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.85 0.00 160 H 7.85 5.31 0.00 2.94 3.19 0.00 5.93 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 L 8.14 4.55 0.00 1.68 1.74 0.89 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 162 T 8.19 5.36 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 1.21 0.00 0.00 163 T 8.85 4.00 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 1.23 0.00 0.00 164 Q 7.86 4.09 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.96 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 165 D 7.83 4.40 0.00 2.84 2.72 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 0.00 166 L 7.68 4.16 0.00 1.75 1.79 0.90 0.84 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 0.00 167 R 7.59 4.07 0.00 2.14 1.95 0.00 3.17 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 1.64 1.84 0.00 168 K 8.19 4.43 0.00 1.87 1.83 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.63 7.81 169 I 7.68 4.30 2.05 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 1.29 0.63 0.91 0.00 0.00 *182 E 8.53 4.18 0.00 2.00 1.86 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 2.23 2.36 0.00 183 L 8.56 3.48 0.00 1.74 1.67 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 184 L 6.78 5.17 0.00 1.65 1.61 0.89 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.00 0.00 185 D 7.62 4.95 0.00 2.89 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 0.00 186 P 0.00 4.17 0.00 2.26 2.36 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.03 0.00 187 L 7.98 3.86 0.00 1.75 1.68 0.90 1.14 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 0.00 188 A 8.73 3.94 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 0.00 189 I 7.59 3.61 1.96 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 1.38 0.84 0.89 0.00 0.00 190 K 8.18 3.85 0.00 1.79 1.97 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.48 7.81 191 I 7.99 3.66 1.96 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 1.72 0.86 0.93 0.00 0.00 192 V 8.08 3.67 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 0.77 0.00 0.00 0.97 0.00 0.00 193 E 8.20 3.93 0.00 2.28 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 194 R 7.96 4.00 0.00 1.95 2.05 0.00 3.02 0.00 0.00 3.20 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.65 0.00 195 S 7.83 4.56 0.00 3.95 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 0.00 196 K 7.45 3.80 0.00 1.84 1.79 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.38 7.81 197 I 8.22 4.67 1.84 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 1.42 0.68 0.90 0.00 0.00 198 R 8.82 4.49 0.00 1.99 2.03 0.00 2.72 0.00 0.00 3.10 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 199 V 8.45 4.71 2.05 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 0.97 0.00 0.00 0.90 0.00 0.00 200 I 8.65 4.68 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 1.07 0.47 0.87 0.00 0.00 201 V 8.85 4.61 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.89 0.00 0.00 202 M 8.77 5.39 0.00 2.08 2.07 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.34 0.00 203 N 8.58 4.95 0.00 2.87 2.66 0.00 0.00 6.62 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 0.00 204 Y 9.23 4.38 0.00 3.30 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 0.00 205 R 8.53 4.09 0.00 2.10 2.05 0.00 3.21 0.00 0.00 3.20 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 206 K 8.05 4.58 0.00 1.91 1.79 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.38 1.38 7.81 207 L 7.72 4.21 0.00 1.78 1.75 0.84 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 208 N 7.98 4.67 0.00 2.95 2.95 0.00 0.00 6.07 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 0.00 209 R 7.92 4.39 0.00 1.98 2.10 0.00 3.10 0.00 0.00 3.52 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 210 I 7.66 3.59 1.94 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.07 0.85 0.00 0.00 211 I 7.58 3.66 1.86 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.92 0.95 0.00 0.00 212 D 7.89 4.46 0.00 2.85 2.77 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 0.00 213 I 7.75 3.65 2.00 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 1.73 0.86 0.87 0.00 0.00 214 L 7.77 3.98 0.00 1.79 1.79 0.63 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 215 K 8.26 4.35 0.00 1.87 1.93 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.69 1.39 7.81 216 G 8.24 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 0.00 217 E 7.53 4.59 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 218 E 7.80 4.69 0.00 1.84 1.81 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 2.13 2.32 0.00 219 V 8.43 3.64 2.05 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 0.77 0.00 0.00 0.92 0.00 0.00 220 S 7.46 5.22 0.00 3.89 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 0.00 221 S 8.00 4.83 0.00 3.68 3.68 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 0.00 222 I 8.15 4.74 1.66 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.88 0.89 0.00 0.00 223 I 9.01 4.50 1.84 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 1.20 0.80 0.88 0.00 0.00 224 E 9.08 4.87 0.00 1.92 1.85 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 2.40 2.41 0.00 225 P 0.00 4.67 0.00 2.06 2.28 0.00 3.76 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.90 0.00 226 V 7.88 4.00 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 0.59 0.00 0.00 0.92 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.