NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 V 4.1630 8.0549 120.3376 61.6976 32.5771 175.0011 11 L 4.5890 8.0700 119.1360 53.6953 43.8609 175.2456 12 Q 4.7062 8.4480 117.6292 53.2749 35.2543 172.0827 13 P 4.3349 0.0000 0.0000 63.8474 30.2623 178.1347 14 R 5.0838 8.7954 122.6359 55.4524 29.6855 175.3750 15 S 4.5233 8.0099 115.8269 58.2214 65.1288 175.3410 16 I 4.4135 8.3381 124.0856 61.4284 37.4099 175.8234 17 V 4.7378 9.5572 128.3339 59.8234 34.4560 175.0780 18 V 4.8982 8.3081 121.0761 58.8429 35.0031 173.1188 19 P 4.6409 0.0000 0.0000 64.1540 31.7015 176.9363 20 G 3.9430 9.4914 111.2422 44.8992 0.0000 173.0732 21 E 4.1997 7.8614 121.8058 55.7167 30.9001 175.4395 22 L 3.8626 8.4366 129.1514 55.3173 42.3710 175.4927 23 L 3.7997 9.1006 126.9827 55.6894 42.6255 175.9834 24 A 4.6371 7.3193 119.0181 50.1520 23.0500 173.8641 25 E 4.9683 8.8750 119.5112 55.0774 31.9952 175.3148 26 G 3.9727 8.8013 109.4570 43.9004 0.0000 173.1833 27 E 4.4365 8.5364 119.2003 55.7312 29.5489 176.5643 28 F 4.8471 8.5906 121.6136 55.8015 42.5364 175.8647 29 Q 4.4827 8.3726 124.3088 54.7056 27.4303 174.0100 30 I 4.1425 7.4248 120.7165 58.5678 38.9862 174.4538 31 P 4.5210 0.0000 0.0000 61.9362 32.0038 176.0358 32 W 4.2803 8.6266 130.2475 57.8086 31.3473 175.2253 33 S 3.8024 6.7400 117.5715 55.7950 64.7233 173.0255 34 P 3.8149 0.0000 0.0000 64.6649 31.3520 176.7538 35 Y 4.6982 6.6776 115.5674 58.2552 38.3431 174.6977 36 I 5.1209 7.0699 119.2497 59.1956 40.3687 174.6558 37 L 4.8002 9.0307 128.5058 53.0833 44.8683 174.6393 38 K 4.7793 8.7338 127.1398 54.7581 33.9018 175.2536 39 I 4.4577 8.4409 128.2072 60.1872 40.7813 175.9398 40 N 4.3924 9.6073 125.3639 53.8911 36.8184 174.5640 41 S 4.7385 8.9188 118.8980 58.1879 66.2740 174.9471 42 K 4.9370 8.3219 121.4760 55.4550 34.1108 174.8423 43 Y 5.0059 9.2251 122.9574 56.8171 39.8520 174.4080 44 Y 5.1487 9.2675 121.8304 56.0503 41.7735 174.9877 45 S 4.9527 8.9189 117.5657 58.5470 63.6662 174.4846 46 T 4.5703 9.1491 115.6457 61.9622 70.2627 173.9874 47 V 4.9004 7.4979 114.0689 59.3079 36.5955 175.1583 48 V 3.8752 8.4007 122.0166 63.5518 32.4337 175.3107 49 G 4.1728 8.8193 114.5390 46.0391 0.0000 170.5614 50 L 5.3254 8.5706 122.5444 53.1730 44.2790 175.8913 51 F 5.0958 9.3072 130.1585 57.6282 40.4823 173.5051 52 D 4.8112 8.4045 126.3346 52.2179 43.7871 174.7147 53 V 4.3228 8.0494 124.9454 60.9720 34.0104 175.8909 54 K 4.3514 8.4449 126.8133 56.6262 33.4205 176.3410 55 D 4.2460 8.4343 125.7930 55.8795 40.5392 174.3510 56 T 4.0280 8.3853 110.9617 62.2695 70.1878 176.2119 57 Q 2.5972 8.6768 123.6684 56.5111 29.1597 171.2746 58 F 5.1983 6.6898 110.6503 55.7961 41.5714 172.9018 59 E 4.8194 8.3453 115.0708 55.8245 33.2303 174.5385 60 V 4.7309 8.3725 120.0817 61.1525 33.5306 174.8599 61 I 3.9424 8.4056 130.7569 59.8548 37.9365 174.2662 62 P 4.4995 0.0000 0.0000 62.9202 31.4361 176.2936 63 L 4.5822 8.4828 120.0196 54.2512 43.6729 176.2335 64 E 4.5854 7.9287 118.2002 54.8559 32.5668 174.3001 65 G 4.0593 8.5344 110.2791 44.6107 0.0000 173.6711 66 S 4.7169 8.6410 112.0586 57.2896 63.7012 173.4302 67 F 5.3599 7.6112 114.7412 55.7051 40.1728 173.6902 68 Y 4.8367 9.2655 121.8649 56.5786 40.7129 173.6225 69 Y 4.6678 8.1692 127.6441 55.2506 39.8821 173.3446 70 P 3.7405 0.0000 0.0000 62.4636 31.7587 175.9301 71 K 4.7579 8.2057 121.6595 54.0438 34.8967 175.9972 72 I 4.0711 8.3874 124.2272 63.1513 37.4538 176.2654 73 N 4.6561 9.3431 121.4966 53.2212 37.4872 174.6108 74 D 4.6519 7.8210 118.7484 54.2769 42.4134 175.0639 75 I 4.6177 8.3702 122.3994 60.0230 39.7288 174.6599 76 V 4.7458 8.4394 121.9984 59.3806 35.7866 174.4070 77 I 4.7755 8.4370 117.6467 59.4490 39.0373 175.0967 78 G 4.2815 9.3121 114.3511 44.1114 0.0000 170.8207 79 L 5.0336 8.6874 121.8079 52.6562 44.6938 175.6604 80 V 4.0961 8.5234 127.3554 63.5267 31.8347 175.7177 81 E 4.4839 9.0881 127.2465 57.3371 31.9356 176.2135 82 D 4.9208 7.9856 117.6144 52.3725 45.2510 174.4185 83 V 4.6746 8.4756 124.8341 60.3823 32.9270 175.4312 84 E 4.4025 8.5444 127.6788 55.0584 31.5442 176.0680 85 I 3.7256 8.0135 111.5916 63.3821 38.1546 176.0060 86 Y 4.6870 7.2879 116.4640 57.4063 39.5228 175.0189 87 G 2.9872 6.5290 104.4863 45.6986 0.0000 171.3781 88 W 5.2231 7.7596 119.8704 54.6568 32.6002 175.3559 89 V 4.4173 9.2039 125.6318 62.6898 32.4096 174.7769 90 V 4.8988 9.1774 128.0458 61.0364 34.5584 173.6613 91 D 4.9498 9.3954 129.1959 53.3794 42.1267 176.4199 92 I 4.5477 8.2728 119.3061 60.3761 38.2351 175.3527 93 K 3.8807 8.2919 117.7808 58.2653 28.9627 175.2584 94 A 5.4159 7.5820 119.6550 48.7018 21.6733 176.7211 95 P 4.2108 0.0000 0.0000 64.7087 31.4762 176.7870 96 Y 4.8477 7.0016 111.5887 55.7355 40.5681 175.1431 97 K 4.4921 8.6508 122.2648 55.9498 33.2027 176.9408 98 A 4.6550 9.2095 127.2259 51.8840 20.5324 175.3399 99 Y 5.0639 9.1951 120.3215 55.7839 42.0699 174.0247 100 L 4.9184 8.5968 129.5334 52.5338 44.0026 173.8660 101 P 4.4124 0.0000 0.0000 62.1957 32.1102 177.7972 102 A 4.0642 8.8718 126.6870 55.1850 18.6017 179.9738 103 S 4.1774 8.0618 110.6342 61.1787 62.6057 176.1057 104 N 4.3268 7.9417 120.4558 56.4021 38.8916 176.3863 105 L 4.0509 8.0402 120.2443 57.2747 42.2847 177.7211 106 L 4.4567 7.6857 117.6503 53.7336 43.1202 176.9587 107 G 3.5830 8.0576 105.7950 46.3285 0.0000 172.5672 108 R 3.6621 8.0358 121.6739 56.4270 27.8462 176.3670 109 S 4.6901 7.9987 121.7821 55.5162 63.1667 174.9043 110 I 4.5303 7.8738 111.7687 61.0049 39.5927 173.9629 111 N 3.4363 7.6165 113.4000 56.2579 38.4977 175.6222 *117 R 4.4776 7.7089 121.5809 54.8834 32.6886 177.1241 118 R 4.1441 8.0961 112.7851 57.8693 30.4849 177.0036 119 Y 4.4341 8.0998 114.6393 59.2193 38.7892 175.8684 120 L 4.6771 7.7003 116.8749 52.8820 45.6206 174.8429 121 D 4.9603 9.1341 121.5580 51.5621 44.5316 174.7363 122 V 3.9694 8.2484 121.5906 64.9431 31.3974 175.3474 123 G 3.9663 8.3025 115.7676 45.5836 0.0000 173.6083 124 D 4.4883 8.0876 120.3756 54.4220 42.2970 175.0279 125 Y 5.0391 8.3324 119.1651 56.7470 40.5191 174.7198 126 V 4.4237 8.9204 123.2637 61.2591 34.6946 174.7452 127 I 4.5292 8.4139 129.9229 60.2168 36.3293 175.3695 128 A 4.9906 8.2174 135.0000 51.0259 21.1804 177.0855 129 R 4.3744 7.9271 112.6601 57.1747 34.8193 174.4107 130 I 4.2312 8.2456 127.8924 61.5015 36.1786 176.5471 131 E 4.0582 8.8508 126.9610 58.7908 30.2685 177.2590 132 N 5.0294 8.0566 117.9172 51.9975 42.3699 173.0565 133 F 5.2871 8.7483 127.2905 56.9795 43.3596 172.8155 134 D 3.7659 7.4098 127.7836 53.9106 43.4122 175.1391 135 R 4.1145 8.3318 114.1109 56.6561 31.9890 176.9650 136 S 4.5828 8.1666 110.6609 57.6371 63.1680 173.3851 137 I 4.5671 6.8721 112.6111 59.7997 40.3641 173.8863 138 D 4.7011 8.2033 120.6106 52.1015 42.4737 174.7778 139 P 4.5583 0.0000 0.0000 63.7757 32.4792 175.2481 140 V 4.6824 9.3553 125.1582 61.8893 32.8025 175.1953 141 L 5.2142 9.1512 128.6187 53.7303 43.4436 176.1651 142 S 4.8670 8.7310 114.5430 57.1694 66.1080 174.8209 143 V 3.8561 9.3777 122.2499 62.4376 32.0427 175.6601 144 K 4.0020 8.1625 117.8495 60.3537 31.7028 176.7983 145 G 3.7127 7.8283 113.4692 44.9619 0.0000 169.6997 146 K 4.0933 8.1883 121.4168 57.0643 33.0904 176.4195 147 D 4.3279 8.6618 125.2377 55.7000 37.8569 173.1210 148 L 4.6752 7.6447 116.4356 53.0319 45.5012 175.4001 149 G 3.6499 8.4940 104.4670 43.9444 0.0000 173.2063 150 R 4.0217 8.2425 118.7503 56.6312 30.4281 177.0105 151 V 3.6765 7.7344 124.4312 61.1844 31.8942 175.9494 152 S 4.3589 8.6492 124.4670 61.3084 63.5516 173.5544 153 N 4.6115 8.0933 117.4462 54.6511 40.1880 173.2926 154 G 4.1771 10.2017 105.4560 45.6381 0.0000 172.9699 155 I 4.6507 9.0062 122.4848 59.5848 41.9891 173.6475 156 V 4.7910 8.4793 128.6722 61.3890 32.9922 174.4418 157 I 4.4929 8.5894 129.4131 59.8622 39.3395 174.4222 158 D 5.4089 8.6548 126.3373 52.4637 42.5682 176.5677 159 I 4.9314 8.3171 116.6198 59.8451 39.0563 172.2552 160 M 2.9010 8.5938 128.3499 55.1679 30.2643 174.5617 161 P 4.7369 0.0000 0.0000 63.9282 30.3129 176.8279 162 V 5.1592 7.5671 135.0000 61.8444 30.1211 173.0386 163 K 4.3051 7.4446 118.4330 55.9657 32.1810 178.2016 164 V 3.5250 7.7868 120.0851 65.6897 31.2644 175.7782 165 P 4.2571 0.0000 0.0000 65.1962 30.3746 177.6325 166 R 4.0843 7.9726 118.6094 58.0690 30.0646 177.3439 167 V 4.0543 7.1921 115.7882 63.1096 31.5544 175.9842 168 I 4.1802 7.9060 118.7533 61.5599 39.0070 176.3006 169 G 4.2456 7.4878 115.5112 45.3436 0.0000 172.7566 *174 M 4.0437 7.4452 118.0096 54.3899 33.4194 174.9658 175 Y 4.7118 7.9998 120.6207 57.9925 40.5146 176.4162 176 E 4.1454 8.6604 120.9559 59.3742 29.8200 176.5820 177 T 4.1522 7.8171 110.0706 61.8366 67.0192 173.3198 178 L 3.9670 8.1603 128.3698 58.4248 41.3876 178.4608 179 T 3.3133 7.4938 111.2159 65.4711 67.5973 172.9131 180 S 4.7441 10.7700 116.8675 57.9752 63.1436 175.1360 181 K 4.2631 7.9568 121.1208 57.8961 32.7220 176.8629 182 S 4.5226 7.7430 113.5247 56.1098 65.0983 174.4617 183 G 3.9239 9.0257 117.0026 48.6542 0.0000 174.3342 184 C 3.9416 7.7252 115.3020 56.5397 39.0416 173.5961 185 S 4.5388 8.4858 118.9391 57.5815 63.8812 172.9571 186 I 4.6222 8.2294 125.7124 59.5712 39.1698 175.1995 187 F 4.8245 9.1175 127.9048 56.4963 42.0822 173.9806 188 V 4.0154 8.0203 126.9773 61.4317 31.8978 175.2041 189 A 3.9593 8.1789 131.9083 50.8559 19.5168 177.7857 190 N 4.1951 8.0126 119.7006 55.8538 38.7369 175.5811 191 N 4.1894 7.5761 114.1097 52.4254 37.8814 174.9939 192 G 3.8441 7.8506 105.4038 47.3300 0.0000 173.8012 193 R 5.2313 7.6332 116.9863 53.8333 34.6699 174.2896 194 I 4.8520 8.7652 116.3439 58.8139 40.8647 174.0344 195 W 5.2989 9.3656 135.0000 56.4026 31.8225 174.5735 196 A 4.9393 9.2029 129.6996 50.3349 21.5408 174.9179 197 T 4.5700 7.9742 114.0758 60.3945 68.2006 171.3789 198 C 4.9462 8.3387 128.3151 53.4069 45.8448 173.0370 199 P 4.1789 0.0000 0.0000 63.6425 31.0930 174.6230 200 S 3.2788 7.1893 115.2309 58.2790 64.0197 172.6021 *203 S 4.2505 8.3522 117.1286 55.8994 64.1641 173.3503 204 E 5.1165 7.6171 120.4401 57.3624 33.7867 175.5232 205 E 4.3571 7.8347 115.1617 55.9781 29.1282 176.5051 206 I 3.9940 7.2740 113.1974 62.0323 38.8892 177.1986 207 L 3.9714 7.9398 123.3052 57.5521 41.7330 177.8974 208 I 3.6821 7.8682 119.4819 64.9026 36.9896 177.9846 209 E 3.9834 7.8582 117.7276 58.9174 29.1860 179.4697 210 A 3.9652 7.7568 120.7607 55.3189 18.5991 179.6022 211 I 3.7830 7.9439 118.0264 63.9772 36.8841 178.6263 212 R 3.9130 7.9063 119.5115 59.0228 30.2503 178.0198 213 K 4.1681 7.8835 119.4526 59.2890 32.3133 178.9811 214 I 3.7550 7.8189 120.3593 64.2449 36.8871 178.1294 215 E 4.0933 8.6976 119.6278 58.2081 29.2208 177.4929 216 N 5.4099 7.8946 118.6085 54.9076 40.4458 174.6959 217 E 4.4509 7.9573 118.7498 55.6588 32.4571 178.7507 218 S 4.1338 9.0302 112.3072 62.0253 62.1811 171.5774 219 H 4.4559 7.6337 115.3176 55.6372 29.2924 175.6237 220 I 3.2450 8.1497 121.6472 61.9924 35.8193 174.2827 221 K 4.3066 8.2554 118.2666 56.5540 32.2873 174.9379 *228 K 4.1214 8.2280 124.9252 55.1164 34.4879 177.5620 229 Q 4.0805 7.2944 117.9897 56.6959 30.3266 176.4933 230 F 4.6232 7.6453 112.6662 58.0221 37.8188 175.8574 231 I 4.2561 7.1554 113.5547 62.1523 38.4165 177.1711 232 E 3.9339 7.5220 121.2735 58.8032 28.1030 177.6535 233 E 4.4506 8.0676 115.1771 56.7729 30.1068 177.6348 234 K 4.4077 7.6396 120.0494 58.4878 33.4691 178.6605 235 L 4.1051 7.7721 120.0574 57.5390 41.7516 179.1323 236 G 3.7126 7.5498 102.5609 46.9992 0.0000 174.8743 237 E 4.1412 7.5687 118.1261 58.1183 29.7452 177.7146 238 R 4.4385 7.1593 114.0011 57.0573 31.7833 176.5070 239 N 5.0244 8.2733 116.1127 52.5999 39.0881 174.7034 240 A 4.3831 9.0169 127.6781 54.5481 24.4217 176.1473 241 S 4.2066 7.5160 114.3296 57.5598 62.7579 173.4342 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 10 V 8.05 4.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.94 0.00 0.00 11 L 8.07 4.59 0.00 1.55 1.57 0.98 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 12 Q 8.45 4.71 0.00 1.79 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.12 0.00 0.00 0.00 0.00 0.00 2.18 2.23 0.00 13 P 0.00 4.33 0.00 2.06 1.74 0.00 3.64 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 2.03 2.08 0.00 14 R 8.80 5.08 0.00 1.76 1.83 0.00 3.03 0.00 0.00 2.25 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.42 0.00 15 S 8.01 4.52 0.00 3.85 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 16 I 8.34 4.41 1.87 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 1.41 0.74 0.91 0.00 0.00 17 V 9.56 4.74 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 0.99 0.00 0.00 0.84 0.00 0.00 18 V 8.31 4.90 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 0.84 0.00 0.00 0.93 0.00 0.00 19 P 0.00 4.64 0.00 2.22 2.24 0.00 3.77 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 20 G 9.49 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 21 E 7.86 4.20 0.00 2.08 1.87 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 2.16 2.19 0.00 22 L 8.44 3.86 0.00 1.57 1.38 0.85 0.67 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 23 L 9.10 3.80 0.00 1.20 0.58 0.92 -0.18 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 24 A 7.32 4.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 E 8.88 4.97 0.00 2.01 1.92 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 2.18 2.23 0.00 26 G 8.80 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 27 E 8.54 4.44 0.00 1.93 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 2.47 0.00 28 F 8.59 4.85 0.00 2.82 2.67 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 29 Q 8.37 4.48 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.80 0.00 0.00 0.00 0.00 0.00 2.27 2.43 0.00 30 I 7.42 4.14 1.82 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.02 0.70 0.00 0.00 31 P 0.00 4.52 0.00 2.24 2.10 0.00 3.67 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 32 W 8.63 4.28 0.00 3.31 3.22 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 33 S 6.74 3.80 0.00 3.66 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 3.81 0.00 1.41 1.49 0.00 2.87 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 35 Y 6.68 4.70 0.00 2.98 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 36 I 7.07 5.12 1.95 0.00 0.00 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 1.29 0.74 1.31 0.00 0.00 37 L 9.03 4.80 0.00 1.78 1.57 0.99 0.30 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 38 K 8.73 4.78 0.00 1.43 1.59 0.00 1.41 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.10 0.61 7.81 39 I 8.44 4.46 2.01 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.92 0.92 0.00 0.00 40 N 9.61 4.39 0.00 2.91 2.70 0.00 0.00 6.93 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 41 S 8.92 4.74 0.00 3.92 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 42 K 8.32 4.94 0.00 1.89 1.30 0.00 1.75 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.43 7.81 43 Y 9.23 5.01 0.00 2.85 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 44 Y 9.27 5.15 0.00 2.88 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 45 S 8.92 4.95 0.00 3.89 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 46 T 9.15 4.57 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 1.25 0.00 0.00 47 V 7.50 4.90 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 0.84 0.00 0.00 0.99 0.00 0.00 48 V 8.40 3.88 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 0.95 0.00 0.00 0.94 0.00 0.00 49 G 8.82 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 L 8.57 5.33 0.00 1.68 1.48 1.03 0.99 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 51 F 9.31 5.10 0.00 3.02 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 D 8.40 4.81 0.00 2.71 2.32 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 53 V 8.05 4.32 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 0.89 0.00 0.00 0.63 0.00 0.00 54 K 8.44 4.35 0.00 1.88 1.72 0.00 1.78 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.27 1.37 7.81 55 D 8.43 4.25 0.00 2.79 2.58 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 56 T 8.39 4.03 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 1.21 0.00 0.00 57 Q 8.68 2.60 0.00 1.85 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.69 0.00 0.00 0.00 0.00 0.00 2.21 2.13 0.00 58 F 6.69 5.20 0.00 2.47 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 59 E 8.35 4.82 0.00 2.02 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 0.00 2.13 2.16 0.00 60 V 8.37 4.73 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 0.82 0.00 0.00 1.13 0.00 0.00 61 I 8.41 3.94 1.78 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 1.21 0.17 0.79 0.00 0.00 62 P 0.00 4.50 0.00 1.79 1.44 0.00 3.27 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.35 0.00 63 L 8.48 4.58 0.00 1.59 1.67 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 64 E 7.93 4.59 0.00 1.83 1.76 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 2.18 2.33 0.00 65 G 8.53 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 66 S 8.64 4.72 0.00 4.00 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 67 F 7.61 5.36 0.00 3.08 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 Y 9.27 4.84 0.00 3.06 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 69 Y 8.17 4.67 0.00 3.07 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 70 P 0.00 3.74 0.00 0.49 1.22 0.00 2.61 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 1.63 0.00 71 K 8.21 4.76 0.00 2.24 1.80 0.00 1.91 0.00 0.00 1.83 0.00 0.00 3.17 0.00 0.00 3.40 0.00 0.00 0.00 0.00 1.63 1.68 7.81 72 I 8.39 4.07 1.96 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 1.54 0.62 1.08 0.00 0.00 73 N 9.34 4.66 0.00 2.92 3.11 0.00 0.00 7.04 8.02 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 74 D 7.82 4.65 0.00 2.98 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 75 I 8.37 4.62 2.01 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 1.97 1.59 1.09 0.00 0.00 76 V 8.44 4.75 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 0.52 0.00 0.00 0.96 0.00 0.00 77 I 8.44 4.78 1.82 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.54 1.09 0.00 0.00 78 G 9.31 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.69 5.03 0.00 1.59 1.47 0.36 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 80 V 8.52 4.10 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 0.97 0.00 0.00 0.80 0.00 0.00 81 E 9.09 4.48 0.00 1.92 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.42 0.00 82 D 7.99 4.92 0.00 2.78 2.49 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 83 V 8.48 4.67 2.37 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 0.86 0.00 0.00 0.76 0.00 0.00 84 E 8.54 4.40 0.00 2.09 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 0.00 2.36 2.32 0.00 85 I 8.01 3.73 1.37 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 -0.36 0.71 0.00 0.00 86 Y 7.29 4.69 0.00 3.13 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 87 G 6.53 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 0.00 0.00 0.00 88 W 7.76 5.22 0.00 3.21 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 89 V 9.20 4.42 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 1.00 0.00 0.00 1.10 0.00 0.00 90 V 9.18 4.90 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 0.98 0.00 0.00 1.05 0.00 0.00 91 D 9.40 4.95 0.00 2.95 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 92 I 8.27 4.55 1.94 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.98 0.97 0.00 0.00 93 K 8.29 3.88 0.00 2.05 2.07 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.43 1.44 7.81 94 A 7.58 5.42 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.21 0.00 1.51 1.69 0.00 3.66 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.61 0.00 96 Y 7.00 4.85 0.00 2.93 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 97 K 8.65 4.49 0.00 1.75 1.84 0.00 1.81 0.00 0.00 1.77 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.51 7.81 98 A 9.21 4.65 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 Y 9.20 5.06 0.00 3.07 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 0.00 100 L 8.60 4.92 0.00 1.81 1.68 1.01 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 101 P 0.00 4.41 0.00 2.28 2.08 0.00 3.81 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.36 0.00 102 A 8.87 4.06 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 S 8.06 4.18 0.00 4.06 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 0.00 104 N 7.94 4.33 0.00 2.80 3.06 0.00 0.00 7.12 7.09 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 0.00 105 L 8.04 4.05 0.00 1.81 1.65 0.47 0.73 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 0.00 106 L 7.69 4.46 0.00 1.51 1.62 0.67 0.44 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 0.00 107 G 8.06 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 0.00 0.00 0.00 108 R 8.04 3.66 0.00 1.90 1.94 0.00 3.34 0.00 0.00 3.28 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.66 0.00 109 S 8.00 4.69 0.00 3.98 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 I 7.87 4.53 2.02 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 1.54 0.30 1.22 0.00 0.00 111 N 7.62 3.44 0.00 2.87 2.84 0.00 0.00 6.05 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 *117 R 7.71 4.48 0.00 1.88 2.10 0.00 3.38 0.00 0.00 3.48 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 118 R 8.10 4.14 0.00 1.64 1.92 0.00 3.33 0.00 0.00 3.41 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 1.29 0.00 119 Y 8.10 4.43 0.00 3.20 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 0.00 120 L 7.70 4.68 0.00 0.27 0.91 -0.12 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 121 D 9.13 4.96 0.00 2.79 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 V 8.25 3.97 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 0.88 0.00 0.00 1.02 0.00 0.00 123 G 8.30 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 0.00 124 D 8.09 4.49 0.00 2.62 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.33 5.04 0.00 2.88 2.63 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 0.00 126 V 8.92 4.42 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 0.85 0.00 0.00 0.74 0.00 0.00 127 I 8.41 4.53 1.70 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.27 0.84 0.00 0.00 128 A 8.22 4.99 1.16 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 0.00 129 R 7.93 4.37 0.00 2.00 1.84 0.00 3.31 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 130 I 8.25 4.23 2.13 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.46 0.97 0.00 0.00 131 E 8.85 4.06 0.00 2.00 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 0.00 2.38 2.44 0.00 132 N 8.06 5.03 0.00 2.82 2.66 0.00 0.00 6.54 7.71 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 0.00 133 F 8.75 5.29 0.00 2.84 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 D 7.41 3.77 0.00 2.39 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 R 8.33 4.11 0.00 1.54 1.72 0.00 3.17 0.00 0.00 3.16 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.45 0.00 136 S 8.17 4.58 0.00 3.95 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 I 6.87 4.57 1.83 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 1.44 0.46 0.84 0.00 0.00 138 D 8.20 4.70 0.00 2.72 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 0.00 139 P 0.00 4.56 0.00 2.09 1.94 0.00 3.67 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 1.97 1.43 0.00 140 V 9.36 4.68 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 1.06 0.00 0.00 1.07 0.00 0.00 141 L 9.15 5.21 0.00 1.67 1.61 0.97 0.89 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 0.00 142 S 8.73 4.87 0.00 3.87 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 V 9.38 3.86 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 0.78 0.00 0.00 0.85 0.00 0.00 144 K 8.16 4.00 0.00 1.90 1.87 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.39 7.81 145 G 7.83 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 0.00 146 K 8.19 4.09 0.00 1.86 1.84 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.44 7.81 147 D 8.66 4.33 0.00 2.75 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 0.00 148 L 7.64 4.68 0.00 1.69 1.65 0.93 1.09 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 0.00 149 G 8.49 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 R 8.24 4.02 0.00 1.63 1.75 0.00 3.30 0.00 0.00 3.09 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.50 0.00 151 V 7.73 3.68 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 -0.04 0.00 0.00 0.40 0.00 0.00 152 S 8.65 4.36 0.00 3.98 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 N 8.09 4.61 0.00 2.88 2.76 0.00 0.00 6.11 7.00 0.00 0.00 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 10.20 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 I 9.01 4.65 2.03 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 1.14 1.27 1.04 0.00 0.00 156 V 8.48 4.79 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 0.32 0.00 0.00 0.41 0.00 0.00 157 I 8.59 4.49 1.85 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 0.49 0.91 0.00 0.00 158 D 8.65 5.41 0.00 2.58 2.61 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 0.00 159 I 8.32 4.93 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 1.20 1.61 0.89 0.00 0.00 160 M 8.59 2.90 0.00 2.25 2.12 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.56 0.00 161 P 0.00 4.74 0.00 2.33 2.17 0.00 3.85 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.25 0.00 162 V 7.57 5.16 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 0.61 0.00 0.00 0.90 0.00 0.00 163 K 7.44 4.31 0.00 1.97 1.83 0.00 1.94 0.00 0.00 1.54 0.00 0.00 3.12 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.34 1.38 7.81 164 V 7.79 3.52 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 1.00 0.00 0.00 0.89 0.00 0.00 165 P 0.00 4.26 0.00 2.25 2.25 0.00 3.60 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.97 0.00 166 R 7.97 4.08 0.00 1.90 2.03 0.00 3.11 0.00 0.00 3.06 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 167 V 7.19 4.05 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 0.76 0.00 0.00 0.93 0.00 0.00 168 I 7.91 4.18 1.78 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 1.13 0.80 0.78 0.00 0.00 169 G 7.49 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 *174 M 7.45 4.04 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.56 0.00 175 Y 8.00 4.71 0.00 2.89 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 0.00 176 E 8.66 4.15 0.00 2.02 2.27 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 2.46 2.31 0.00 177 T 7.82 4.15 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 1.18 0.00 0.00 178 L 8.16 3.97 0.00 1.87 1.95 0.89 0.51 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 0.00 179 T 7.49 3.31 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 1.22 0.00 0.00 180 S 10.77 4.74 0.00 3.94 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 0.00 181 K 7.96 4.26 0.00 1.74 1.88 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.33 7.81 182 S 7.74 4.52 0.00 3.76 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 0.00 183 G 9.03 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 C 7.73 3.94 0.00 2.85 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.49 4.54 0.00 3.78 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 0.00 186 I 8.23 4.62 1.84 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 1.18 0.83 0.87 0.00 0.00 187 F 9.12 4.82 0.00 3.12 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 0.00 188 V 8.02 4.02 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 0.66 0.00 0.00 0.86 0.00 0.00 189 A 8.18 3.96 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 N 8.01 4.20 0.00 2.53 2.96 0.00 0.00 6.91 7.88 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 0.00 191 N 7.58 4.19 0.00 2.43 1.59 0.00 0.00 6.07 7.00 0.00 0.00 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 G 7.85 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 R 7.63 5.23 0.00 1.63 1.65 0.00 3.27 0.00 0.00 3.40 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.57 0.00 194 I 8.77 4.85 1.87 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 1.18 0.69 0.80 0.00 0.00 195 W 9.37 5.30 0.00 3.43 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 0.00 196 A 9.20 4.94 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 0.00 197 T 7.97 4.57 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 0.74 0.00 0.00 198 C 8.34 4.95 0.00 2.91 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 0.00 199 P 0.00 4.18 0.00 2.20 2.15 0.00 3.93 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 200 S 7.19 3.28 0.00 4.44 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 *203 S 8.35 4.25 0.00 4.02 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 0.00 204 E 7.62 5.12 0.00 2.04 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 2.06 2.08 0.00 205 E 7.83 4.36 0.00 2.17 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 0.00 2.34 2.29 0.00 206 I 7.27 3.99 1.87 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 1.30 1.20 0.91 0.00 0.00 207 L 7.94 3.97 0.00 1.76 1.63 0.88 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 208 I 7.87 3.68 1.88 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 1.64 0.41 0.92 0.00 0.00 209 E 7.86 3.98 0.00 2.27 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 2.34 2.48 0.00 210 A 7.76 3.97 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 0.00 211 I 7.94 3.78 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 1.38 0.84 0.88 0.00 0.00 212 R 7.91 3.91 0.00 1.95 2.16 0.00 3.32 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 213 K 7.88 4.17 0.00 2.07 1.95 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.17 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.68 7.81 214 I 7.82 3.75 1.98 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 1.45 1.11 0.87 0.00 0.00 215 E 8.70 4.09 0.00 2.20 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 2.32 2.50 0.00 216 N 7.89 5.41 0.00 2.84 2.86 0.00 0.00 6.61 7.52 0.00 0.00 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 7.96 4.45 0.00 1.96 1.59 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 2.15 2.14 0.00 218 S 9.03 4.13 0.00 3.90 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 0.00 219 H 7.63 4.46 0.00 3.20 3.25 0.00 5.85 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 I 8.15 3.24 2.16 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.27 0.92 0.00 0.00 221 K 8.26 4.31 0.00 1.72 1.72 0.00 1.84 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.40 7.81 *228 K 8.23 4.12 0.00 1.80 1.77 0.00 1.45 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.38 7.81 229 Q 7.29 4.08 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 7.01 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 230 F 7.65 4.62 0.00 3.22 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 0.00 231 I 7.16 4.26 1.80 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 1.41 0.80 0.68 0.00 0.00 232 E 7.52 3.93 0.00 1.89 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 2.29 2.30 0.00 233 E 8.07 4.45 0.00 2.32 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 0.00 2.39 2.41 0.00 234 K 7.64 4.41 0.00 2.04 2.35 0.00 1.32 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.36 1.46 7.81 235 L 7.77 4.11 0.00 1.70 1.73 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 236 G 7.55 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 0.00 237 E 7.57 4.14 0.00 1.94 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 0.00 2.33 2.35 0.00 238 R 7.16 4.44 0.00 2.06 1.95 0.00 3.32 0.00 0.00 3.23 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.87 0.00 239 N 8.27 5.02 0.00 2.69 2.35 0.00 0.00 6.80 6.90 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 0.00 240 A 9.02 4.38 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 241 S 7.52 4.21 0.00 3.85 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 * Residues marked with a * may have inaccurate shift predictions.