NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 5.2482 8.0632 120.4216 55.6689 34.0955 173.7948 2 K 4.9672 8.8828 126.4803 54.2957 35.1440 173.7848 3 I 5.0565 9.2255 128.5092 59.4931 40.2537 174.4152 4 A 4.5790 8.7835 129.8733 51.0515 20.4408 175.7801 5 I 4.9572 9.0621 122.7191 59.4859 40.2165 174.6003 6 F 5.3943 10.2928 129.1260 55.6993 42.4495 174.2900 7 G 3.8366 7.6770 113.2686 46.0007 0.0000 171.3037 8 T 3.6167 6.6070 114.7468 60.6219 68.1669 173.0698 9 V 3.7144 8.1677 123.2947 64.3158 31.5666 175.8096 10 G 3.7532 8.9660 114.3004 45.7793 0.0000 174.8654 11 A 3.9076 7.5203 124.3676 54.1978 18.5547 179.0912 12 G 4.2816 8.2168 105.2927 46.1570 0.0000 176.5484 13 K 3.9786 8.5744 120.9135 59.1747 32.2295 178.8046 14 S 4.1690 8.0215 114.0341 61.7230 63.0042 176.4391 15 T 3.8244 7.8024 118.7644 66.4562 68.2580 176.4331 16 I 3.7395 8.0744 122.2094 64.5217 37.0756 178.7690 17 S 4.1421 8.6496 115.2848 61.3283 62.9929 176.3176 18 A 3.9606 8.2024 124.3823 54.7752 18.0713 179.6145 19 E 3.8742 8.0042 116.7724 59.6392 29.6148 179.2082 20 I 3.6293 7.9226 120.1346 64.5089 37.0979 178.1341 21 S 4.0213 8.2365 113.8406 61.5649 61.9945 176.2571 22 K 3.7599 7.5542 118.9439 59.6165 31.8585 179.1794 23 K 4.0847 7.7820 117.4423 59.0127 32.0922 178.7209 24 L 4.1771 7.9858 118.0359 54.7705 42.1304 177.9108 25 G 4.0094 8.6423 106.3938 45.5301 0.0000 172.4423 26 Y 5.0933 7.4612 115.8566 56.0418 40.0278 175.5075 27 E 4.3091 8.7541 119.6247 56.4140 31.6749 175.1598 28 I 4.8436 8.0001 121.5340 59.7785 39.3918 175.2982 29 F 4.1156 9.5741 127.3659 56.5183 39.8330 175.1230 30 K 4.5845 8.3847 125.4635 54.1585 34.0481 175.2551 31 E 4.0406 8.9473 127.0213 55.7590 28.9504 175.0454 32 P 4.4066 0.0000 0.0000 61.7873 32.4571 177.8140 33 V 3.3213 8.3839 123.2119 65.6736 31.4579 177.3286 34 E 4.2046 7.9828 117.2312 57.9298 29.5863 176.9965 35 E 4.3174 7.7978 117.0497 56.6484 30.7982 175.4991 36 N 4.1098 7.6670 117.0079 52.9522 38.5022 173.2323 37 P 4.4459 0.0000 0.0000 63.8053 32.0158 176.4296 38 Y 4.3283 8.5627 117.6870 59.5408 38.8110 177.5044 39 F 4.0784 8.0042 121.4743 61.3235 39.3774 176.4103 40 E 4.0957 8.2311 117.5163 59.1028 29.7749 177.9730 41 Q 4.2831 7.9880 116.1886 56.9759 29.2103 176.7025 42 Y 4.1812 7.4855 121.0995 61.4038 38.4717 178.0590 43 Y 3.8463 7.4700 115.5677 60.2555 38.3644 177.5235 44 K 4.0733 7.5819 118.7543 59.0920 32.2881 177.0666 45 D 4.5708 7.2632 113.2226 53.2476 43.4978 175.4716 46 L 3.7041 7.8762 124.2029 57.2059 42.3830 179.6094 47 K 4.1566 8.1137 115.8909 58.8297 32.1062 178.3611 48 K 4.1499 7.8438 115.6076 59.3419 32.2927 178.9462 49 T 4.3687 7.7411 115.0899 65.1671 68.9578 177.2130 50 V 3.8722 7.7369 121.3808 65.4036 31.1275 177.7578 51 F 3.9560 8.4041 121.1892 60.7197 39.0253 176.6819 52 K 3.7599 8.3040 117.0739 59.8289 32.0079 178.5639 53 M 3.5241 7.9116 118.0491 58.8670 32.0153 178.3960 54 Q 4.0533 8.6003 118.1235 58.7464 28.7236 179.0574 55 I 3.7977 7.5805 121.2058 64.5193 37.2189 177.6346 56 Y 4.1183 8.1746 120.5662 60.9219 38.4756 178.3350 57 M 4.0762 8.0161 119.4634 58.2098 32.0813 178.5367 58 L 3.9957 7.7286 119.1131 58.2083 41.9196 179.4304 59 T 3.8184 7.8500 115.3532 66.8232 68.5244 176.3769 60 A 3.7919 7.7388 122.1150 55.2005 18.5941 179.7449 61 R 3.9474 8.3923 117.6079 59.5494 29.8606 178.7673 62 S 4.3005 8.0927 114.4888 60.8870 63.0165 176.1142 63 K 4.1313 8.0573 122.7783 59.2348 31.8924 178.9192 64 Q 4.2978 8.1453 117.9945 59.3560 28.3588 178.5469 65 L 4.0311 7.4182 118.4542 56.8636 41.5958 178.4859 66 K 4.2317 7.3745 113.8412 56.8664 31.4931 176.4644 67 Q 4.3371 7.9701 118.5608 53.8375 31.1977 174.7195 *71 L 4.0553 8.4156 124.1525 54.8368 43.0790 176.2499 72 E 4.0262 8.9491 125.7794 58.7352 29.7612 176.5999 73 N 4.8399 7.7500 115.5729 51.3129 40.5932 174.3123 74 I 4.7529 8.3962 123.6783 59.5186 42.3441 174.3559 75 I 5.0139 8.6237 125.0017 59.7030 40.5346 174.5327 76 F 4.8148 9.8309 127.3228 56.0907 40.4315 174.9886 77 D 4.8853 8.8679 125.8072 54.0341 40.2025 175.0767 78 R 4.5487 9.0380 124.3526 56.5476 31.9293 175.1244 79 T 4.7317 8.1774 112.0469 59.2942 71.6734 174.2943 80 L 4.5338 8.3050 121.2200 56.5855 42.2451 177.7364 81 L 4.3072 7.5191 116.7381 57.8344 41.8552 178.5316 82 E 3.8208 8.0309 117.2482 57.8222 29.5400 178.3739 83 D 4.4704 8.0975 119.0629 57.1833 41.0174 176.8963 84 P 4.4798 0.0000 0.0000 65.2777 31.1652 178.6641 85 I 3.5694 7.3098 118.7335 64.3989 36.7896 178.3055 86 F 3.9924 8.2510 118.2327 60.6996 38.8340 177.4527 87 M 3.9934 7.9843 117.4600 58.3806 31.9551 178.0645 88 K 3.9439 8.2133 120.0233 59.2144 32.4997 178.8400 89 V 3.4676 7.7224 118.6301 66.3376 31.3961 177.9404 90 N 4.4653 7.9978 115.8204 56.0124 38.2173 177.0277 91 Y 4.1301 7.7349 120.8933 60.8870 38.6992 177.5125 92 D 3.9946 7.9589 118.3821 56.7587 40.9104 177.8125 93 L 4.2437 7.4384 116.5705 53.7658 41.8952 176.2162 94 N 4.0893 7.7367 115.3280 54.5778 36.3130 174.6076 95 N 4.7377 8.6612 114.3202 53.2866 39.4926 175.3808 96 V 4.5690 7.3088 118.3405 60.3452 34.5204 174.0009 97 D 4.7489 8.6930 127.4457 52.7717 41.5581 177.0554 98 Q 4.2223 8.7833 118.0658 59.9218 28.6202 179.1075 99 T 3.9040 8.1429 115.6505 67.4090 68.0274 176.0143 100 D 4.4101 8.4544 119.8763 57.4977 40.8377 178.5389 101 Y 4.2697 8.1586 120.3287 60.6848 38.8059 177.2722 102 N 4.3063 8.7738 117.9268 56.4859 38.5138 177.5182 103 T 3.9381 8.2274 117.2576 66.7546 68.0509 176.0013 104 Y 4.1103 7.8473 120.1481 60.8143 39.0268 177.9470 105 I 3.7968 7.7207 120.5873 64.5742 37.2245 177.4173 106 D 4.3382 8.1728 118.6213 58.0678 40.9675 177.7223 107 F 4.0390 8.7236 120.1812 61.8985 39.2824 176.4448 108 Y 3.6691 9.2606 118.7334 60.9126 38.4220 178.5082 109 N 4.1843 7.8533 115.1976 55.0241 39.1328 176.3186 110 N 4.7050 7.8480 114.7227 52.9886 39.4150 174.8642 111 V 4.0143 7.6633 117.9102 64.4643 33.2940 176.9455 112 V 3.3522 6.7042 118.0644 65.1169 31.8097 175.9839 113 L 3.5199 7.1032 119.2112 55.4811 41.8842 177.4581 *123 L 3.6412 8.3602 123.2546 54.3790 43.1780 176.8944 124 S 4.3529 7.1810 112.8894 55.8112 61.6176 172.4596 125 F 4.6339 7.5169 123.3088 56.8088 39.9174 175.8647 126 D 4.6661 9.1355 124.8854 57.2128 41.9546 176.1273 127 I 4.9058 7.7526 116.8868 59.7012 41.8743 173.6477 128 V 4.5997 8.7513 128.4545 61.2540 33.8526 174.5878 129 I 4.7989 8.9203 131.2118 60.5731 38.4204 175.0894 130 Y 5.4507 9.0923 131.0457 56.6649 39.2304 174.5824 131 L 4.7135 9.0409 128.9531 54.1397 40.1330 175.6742 132 R 3.5572 7.9982 123.6486 55.6860 31.2146 175.2283 133 V 4.7575 7.7980 124.4141 60.3516 34.4403 174.1421 134 S 4.3960 9.2056 118.1224 58.2229 64.0490 175.5242 135 T 3.9087 8.4397 118.3418 66.5475 68.0806 176.8453 136 K 3.8404 8.1017 120.0396 59.9982 32.0672 178.8253 137 T 3.8268 7.6951 115.4714 65.9662 68.3999 176.0795 138 A 4.1037 7.5621 123.1507 54.6582 18.3591 179.5079 139 I 3.3649 8.1672 118.4566 64.7156 37.1664 178.8559 140 S 4.1412 8.2360 114.8906 61.3462 62.9271 176.7113 141 R 3.9977 8.6340 122.0664 58.8483 29.6209 179.0864 142 I 3.5892 7.9399 120.3603 64.0769 36.8394 178.1842 143 K 3.8348 7.8122 119.7026 58.8448 32.0518 178.0442 144 K 4.3702 7.9014 117.0807 57.3707 33.5389 176.9114 145 R 4.6443 7.8782 116.4121 55.2955 33.2136 175.1740 146 G 3.9054 8.4089 109.7056 46.1255 0.0000 176.4829 147 R 4.5213 8.6756 121.3459 55.0398 32.2439 175.8858 148 S 4.2149 8.6134 112.5815 61.4962 63.4113 176.4927 149 E 3.9884 8.4403 120.2567 59.3085 29.2775 178.5439 150 E 3.8263 7.8040 115.0018 57.8602 29.7326 177.8661 151 L 4.2785 7.4500 117.9661 56.7797 42.2468 178.5384 152 L 4.0920 7.6552 118.3510 57.5314 41.6593 178.0046 153 I 3.8193 7.2259 110.2043 59.8517 38.2384 175.6870 154 G 3.8367 8.2306 110.8499 45.7974 0.0000 174.2607 155 E 4.3500 8.6590 118.5478 58.4332 29.5501 179.0334 156 E 4.2301 8.2430 119.2053 58.9496 29.3250 178.2915 157 Y 3.8803 7.3653 120.2643 60.5124 38.7486 178.5016 158 W 4.6075 7.9346 119.4781 59.6750 29.0033 178.5298 159 E 4.0817 8.2197 118.4461 59.5943 29.0171 179.2944 160 T 3.9595 7.9173 115.8854 66.2072 68.5125 176.4823 161 L 3.6768 7.5968 122.3228 58.2090 42.0891 178.6173 162 N 4.3461 8.2082 116.5462 56.7614 38.9779 176.5927 163 K 3.9060 8.1580 119.9055 60.0455 32.2254 179.0105 164 N 4.4549 8.8115 116.5221 56.1956 38.2730 177.2290 165 Y 3.7770 8.1887 118.6239 60.7856 37.9653 177.9507 166 E 4.1603 8.4113 120.1123 59.4278 29.8551 178.1103 167 E 3.8971 8.2275 119.4378 59.6202 29.6401 178.9021 168 F 3.9812 8.3641 120.2137 61.3260 39.3535 176.3303 169 Y 3.5501 8.3990 119.4102 60.7085 38.3299 178.4617 170 K 3.5326 8.2957 118.1223 59.1923 32.1291 179.0756 171 Q 4.0871 7.8017 117.7765 57.6555 28.9044 176.6079 172 N 5.1884 7.6945 114.6377 51.8688 39.3119 176.5872 173 V 3.2602 6.9034 120.4071 64.7769 31.0368 177.0387 174 Y 4.5993 7.5364 115.3432 58.9785 38.0370 175.6460 175 D 4.5707 8.2749 119.1548 54.3661 41.8356 176.1149 176 F 4.8274 7.8789 116.5576 54.8477 43.1329 173.5639 177 P 4.7964 0.0000 0.0000 61.9791 29.2970 175.3769 178 F 4.9036 8.1224 121.2857 58.5208 40.5591 175.8878 179 F 5.0486 9.6878 124.8273 56.7205 42.4338 173.3862 180 V 4.1479 8.2518 126.7906 61.9645 32.6929 174.9808 181 V 3.9947 7.9612 127.8251 60.5834 34.0038 173.7462 182 D 4.2281 8.5564 127.1849 54.6252 41.3658 175.9230 183 A 4.2820 9.0955 128.0079 52.9358 18.2516 178.1559 184 E 3.9681 8.3848 115.5820 58.6152 29.8078 177.6340 185 L 4.1712 7.2284 117.8403 53.9605 42.4483 176.8326 186 D 4.4195 8.3825 118.9830 54.3318 42.8969 176.9965 187 V 3.5563 8.4474 125.0100 66.3989 31.4737 178.5294 188 K 3.9388 8.1692 117.3965 59.8934 31.9476 179.2929 189 T 4.0034 7.8036 115.4468 66.2985 68.4745 176.9106 190 Q 3.9704 8.2582 120.1688 59.0741 28.7846 178.6459 191 I 3.6970 7.9302 120.9450 64.4812 37.0518 177.7989 192 E 3.9293 8.2333 119.8558 59.6305 29.2833 179.0505 193 L 4.1287 8.0574 118.6767 57.8007 41.5514 179.6832 194 I 3.9894 8.0268 119.9329 64.7137 37.0391 178.3463 195 M 4.0487 8.5155 119.9890 58.4746 31.5011 178.6435 196 N 4.3406 7.8120 115.8577 55.8955 38.8795 177.1803 197 K 3.8748 7.7476 121.2262 59.3682 32.1445 178.8410 198 L 3.9613 8.0490 119.5077 58.0506 41.3449 179.3842 199 N 4.3512 8.3006 115.6504 55.7247 38.5277 176.6316 200 S 4.4922 7.5149 112.9379 58.8531 63.6016 175.0473 201 I 4.1859 7.2269 122.4182 63.0761 38.4016 175.1048 202 K 4.0745 8.0366 123.9388 56.9108 31.9718 175.6652 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 8.06 5.25 0.00 2.29 2.16 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 2.80 2.81 0.00 2 K 8.88 4.97 0.00 2.00 2.10 0.00 1.83 0.00 0.00 1.87 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.55 1.60 7.81 3 I 9.23 5.06 2.04 0.00 0.00 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 1.30 1.24 1.03 0.00 0.00 4 A 8.78 4.58 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 I 9.06 4.96 2.03 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.23 1.00 0.00 0.00 6 F 10.29 5.39 0.00 3.17 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 7.68 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 8 T 6.61 3.62 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 1.10 0.00 0.00 9 V 8.17 3.71 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 0.75 0.00 0.00 1.49 0.00 0.00 10 G 8.97 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 A 7.52 3.91 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 G 8.22 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 13 K 8.57 3.98 0.00 1.83 2.04 0.00 1.71 0.00 0.00 2.06 0.00 0.00 3.10 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.57 1.48 7.81 14 S 8.02 4.17 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 15 T 7.80 3.82 4.36 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 1.20 0.00 0.00 16 I 8.07 3.74 1.98 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 1.73 0.98 0.95 0.00 0.00 17 S 8.65 4.14 0.00 4.04 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 18 A 8.20 3.96 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 19 E 8.00 3.87 0.00 2.22 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 2.38 2.50 0.00 20 I 7.92 3.63 1.97 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 1.69 0.96 0.87 0.00 0.00 21 S 8.24 4.02 0.00 3.97 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 22 K 7.55 3.76 0.00 1.94 1.85 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.56 7.81 23 K 7.78 4.08 0.00 1.81 1.80 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.44 7.81 24 L 7.99 4.18 0.00 0.78 0.44 0.51 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.64 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 26 Y 7.46 5.09 0.00 2.81 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 27 E 8.75 4.31 0.00 1.94 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 2.40 2.40 0.00 28 I 8.00 4.84 1.82 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.62 0.92 0.00 0.00 29 F 9.57 4.12 0.00 2.66 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 K 8.38 4.58 0.00 1.66 1.64 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.30 1.61 7.81 31 E 8.95 4.04 0.00 2.04 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 2.42 2.30 0.00 32 P 0.00 4.41 0.00 2.19 2.16 0.00 3.74 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.96 0.00 33 V 8.38 3.32 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 -0.48 0.00 0.00 0.69 0.00 0.00 34 E 7.98 4.20 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 2.25 2.28 0.00 35 E 7.80 4.32 0.00 2.13 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 2.28 2.22 0.00 36 N 7.67 4.11 0.00 2.82 2.80 0.00 0.00 6.78 7.59 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 37 P 0.00 4.45 0.00 1.73 1.95 0.00 2.70 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.97 0.00 38 Y 8.56 4.33 0.00 3.05 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 39 F 8.00 4.08 0.00 2.89 3.21 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 40 E 8.23 4.10 0.00 2.09 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 2.32 2.45 0.00 41 Q 7.99 4.28 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.42 2.36 0.00 42 Y 7.49 4.18 0.00 3.00 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 43 Y 7.47 3.85 0.00 2.85 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 44 K 7.58 4.07 0.00 1.84 1.85 0.00 1.87 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.37 7.81 45 D 7.26 4.57 0.00 2.62 2.44 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 46 L 7.88 3.70 0.00 1.60 1.57 0.38 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.11 4.16 0.00 1.71 1.88 0.00 1.78 0.00 0.00 0.74 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.56 1.42 7.81 48 K 7.84 4.15 0.00 1.78 1.89 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.48 1.48 7.81 49 T 7.74 4.37 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 1.41 0.00 0.00 50 V 7.74 3.87 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 1.01 0.00 0.00 1.06 0.00 0.00 51 F 8.40 3.96 0.00 3.20 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 52 K 8.30 3.76 0.00 1.76 1.51 0.00 1.83 0.00 0.00 1.89 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.66 1.65 7.81 53 M 7.91 3.52 0.00 2.23 1.86 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 1.59 0.00 54 Q 8.60 4.05 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.60 0.00 0.00 0.00 0.00 0.00 2.55 2.38 0.00 55 I 7.58 3.80 1.92 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 0.94 0.43 0.91 0.00 0.00 56 Y 8.17 4.12 0.00 3.13 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 57 M 8.02 4.08 0.00 2.11 2.26 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.96 0.00 58 L 7.73 4.00 0.00 1.73 1.73 0.87 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 59 T 7.85 3.82 4.20 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 1.16 0.00 0.00 60 A 7.74 3.79 1.13 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 61 R 8.39 3.95 0.00 2.05 1.96 0.00 3.24 0.00 0.00 3.27 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.77 0.00 62 S 8.09 4.30 0.00 3.83 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 63 K 8.06 4.13 0.00 2.08 1.81 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.44 7.81 64 Q 8.15 4.30 0.00 2.88 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.58 0.00 0.00 0.00 0.00 0.00 2.54 2.51 0.00 65 L 7.42 4.03 0.00 1.79 1.71 0.84 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 66 K 7.37 4.23 0.00 1.98 1.85 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.39 7.81 67 Q 7.97 4.34 0.00 2.38 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.40 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 *71 L 8.42 4.06 0.00 1.78 1.62 1.10 1.05 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 72 E 8.95 4.03 0.00 1.93 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 2.28 2.30 0.00 73 N 7.75 4.84 0.00 1.84 1.42 0.00 0.00 6.65 7.45 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 74 I 8.40 4.75 1.85 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 1.16 0.94 0.07 0.00 0.00 75 I 8.62 5.01 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 1.38 1.31 0.99 0.00 0.00 76 F 9.83 4.81 0.00 2.91 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 77 D 8.87 4.89 0.00 2.75 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 78 R 9.04 4.55 0.00 2.06 2.14 0.00 3.49 0.00 0.00 3.60 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 79 T 8.18 4.73 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 80 L 8.31 4.53 0.00 1.65 1.81 1.04 1.02 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 81 L 7.52 4.31 0.00 1.70 1.68 0.26 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 82 E 8.03 3.82 0.00 2.22 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 0.00 1.83 2.30 0.00 83 D 8.10 4.47 0.00 2.78 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 84 P 0.00 4.48 0.00 2.01 1.87 0.00 3.58 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.79 0.00 85 I 7.31 3.57 1.65 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.09 0.30 0.00 0.00 86 F 8.25 3.99 0.00 3.45 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 87 M 7.98 3.99 0.00 1.85 1.16 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 1.64 0.00 88 K 8.21 3.94 0.00 2.04 1.95 0.00 1.81 0.00 0.00 1.78 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.59 1.47 7.81 89 V 7.72 3.47 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 0.57 0.00 0.00 0.70 0.00 0.00 90 N 8.00 4.47 0.00 2.81 2.92 0.00 0.00 6.74 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 91 Y 7.73 4.13 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 92 D 7.96 3.99 0.00 2.58 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 L 7.44 4.24 0.00 1.72 1.75 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 94 N 7.74 4.09 0.00 2.78 2.82 0.00 0.00 6.84 7.79 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 95 N 8.66 4.74 0.00 2.91 2.83 0.00 0.00 6.47 8.27 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 96 V 7.31 4.57 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 1.01 0.00 0.00 1.06 0.00 0.00 97 D 8.69 4.75 0.00 3.04 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 98 Q 8.78 4.22 0.00 2.20 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.85 0.00 0.00 0.00 0.00 0.00 2.81 2.57 0.00 99 T 8.14 3.90 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 1.21 0.00 0.00 100 D 8.45 4.41 0.00 2.89 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 Y 8.16 4.27 0.00 3.14 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 0.00 102 N 8.77 4.31 0.00 3.08 2.89 0.00 0.00 7.04 6.78 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 0.00 103 T 8.23 3.94 4.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 104 Y 7.85 4.11 0.00 3.10 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 0.00 105 I 7.72 3.80 1.65 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 0.66 0.46 0.88 0.00 0.00 106 D 8.17 4.34 0.00 2.91 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 0.00 107 F 8.72 4.04 0.00 3.16 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 0.00 108 Y 9.26 3.67 0.00 2.54 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 0.00 109 N 7.85 4.18 0.00 2.74 2.80 0.00 0.00 7.00 7.41 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 0.00 110 N 7.85 4.71 0.00 2.67 2.81 0.00 0.00 6.79 7.84 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 0.00 111 V 7.66 4.01 1.46 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 0.73 0.00 0.00 1.08 0.00 0.00 112 V 6.70 3.35 1.66 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 0.59 0.00 0.00 0.18 0.00 0.00 113 L 7.10 3.52 0.00 1.57 1.42 0.75 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 *123 L 8.36 3.64 0.00 1.43 1.50 0.90 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 124 S 7.18 4.35 0.00 3.69 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 F 7.52 4.63 0.00 3.15 3.13 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 0.00 126 D 9.14 4.67 0.00 2.90 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 0.00 127 I 7.75 4.91 1.94 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 1.39 1.48 1.02 0.00 0.00 128 V 8.75 4.60 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 0.68 0.00 0.00 0.66 0.00 0.00 129 I 8.92 4.80 2.03 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.75 1.05 0.00 0.00 130 Y 9.09 5.45 0.00 3.09 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 0.00 131 L 9.04 4.71 0.00 1.55 1.56 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 132 R 8.00 3.56 0.00 0.97 1.35 0.00 2.55 0.00 0.00 2.74 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.11 0.00 133 V 7.80 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 0.61 0.00 0.00 0.91 0.00 0.00 134 S 9.21 4.40 0.00 4.00 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 0.00 135 T 8.44 3.91 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 136 K 8.10 3.84 0.00 1.77 1.85 0.00 1.67 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.55 7.81 137 T 7.70 3.83 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 138 A 7.56 4.10 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 I 8.17 3.36 1.98 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.91 0.90 0.00 0.00 140 S 8.24 4.14 0.00 4.00 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 0.00 141 R 8.63 4.00 0.00 2.00 1.93 0.00 3.21 0.00 0.00 3.11 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 142 I 7.94 3.59 1.67 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.43 0.69 0.00 0.00 143 K 7.81 3.83 0.00 1.93 1.95 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.43 7.81 144 K 7.90 4.37 0.00 1.93 1.98 0.00 1.58 0.00 0.00 1.60 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.39 7.81 145 R 7.88 4.64 0.00 1.76 1.92 0.00 3.22 0.00 0.00 3.20 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.51 0.00 146 G 8.41 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 0.00 147 R 8.68 4.52 0.00 2.06 2.09 0.00 3.20 0.00 0.00 3.69 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 2.00 0.00 148 S 8.61 4.21 0.00 4.05 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 0.00 149 E 8.44 3.99 0.00 2.19 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 2.40 2.42 0.00 150 E 7.80 3.83 0.00 2.06 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 0.00 2.68 2.68 0.00 151 L 7.45 4.28 0.00 1.79 1.73 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 152 L 7.66 4.09 0.00 1.71 1.69 0.96 0.80 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 0.00 153 I 7.23 3.82 1.47 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 -0.08 0.76 0.00 0.00 154 G 8.23 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 0.00 155 E 8.66 4.35 0.00 2.11 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 2.65 2.49 0.00 156 E 8.24 4.23 0.00 2.17 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.22 0.00 157 Y 7.37 3.88 0.00 2.79 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 0.00 158 W 7.93 4.61 0.00 3.58 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 E 8.22 4.08 0.00 2.20 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 0.00 2.45 2.48 0.00 160 T 7.92 3.96 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 1.13 0.00 0.00 161 L 7.60 3.68 0.00 1.41 1.84 0.19 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 162 N 8.21 4.35 0.00 3.08 2.84 0.00 0.00 7.28 5.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 K 8.16 3.91 0.00 2.10 1.88 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.53 7.81 164 N 8.81 4.45 0.00 2.82 2.75 0.00 0.00 7.07 7.38 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 0.00 165 Y 8.19 3.78 0.00 3.20 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 0.00 166 E 8.41 4.16 0.00 2.28 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 167 E 8.23 3.90 0.00 2.40 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 0.00 2.36 2.43 0.00 168 F 8.36 3.98 0.00 3.26 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 0.00 169 Y 8.40 3.55 0.00 2.52 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 0.00 170 K 8.30 3.53 0.00 1.87 1.74 0.00 1.77 0.00 0.00 1.69 0.00 0.00 3.08 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.68 7.81 171 Q 7.80 4.09 0.00 1.79 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.99 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 172 N 7.69 5.19 0.00 2.77 3.29 0.00 0.00 6.55 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 0.00 173 V 6.90 3.26 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 -0.49 0.00 0.00 0.49 0.00 0.00 174 Y 7.54 4.60 0.00 3.00 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 0.00 175 D 8.27 4.57 0.00 2.32 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 0.00 0.00 0.00 0.00 176 F 7.88 4.83 0.00 2.29 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 P 0.00 4.80 0.00 2.19 2.28 0.00 3.78 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.10 0.00 178 F 8.12 4.90 0.00 3.21 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 F 9.69 5.05 0.00 3.13 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 0.00 180 V 8.25 4.15 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 0.39 0.00 0.00 0.65 0.00 0.00 181 V 7.96 3.99 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 0.80 0.00 0.00 0.74 0.00 0.00 182 D 8.56 4.23 0.00 2.66 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 0.00 183 A 9.10 4.28 1.13 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 0.00 184 E 8.38 3.97 0.00 2.06 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 2.33 2.37 0.00 185 L 7.23 4.17 0.00 1.65 1.59 0.89 1.42 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 0.00 186 D 8.38 4.42 0.00 2.69 2.52 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 0.00 0.00 0.00 0.00 187 V 8.45 3.56 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 1.09 0.00 0.00 0.91 0.00 0.00 188 K 8.17 3.94 0.00 1.83 1.84 0.00 1.71 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.53 7.81 189 T 7.80 4.00 4.36 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 1.21 0.00 0.00 190 Q 8.26 3.97 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.53 0.00 191 I 7.93 3.70 2.00 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 1.62 1.06 0.91 0.00 0.00 192 E 8.23 3.93 0.00 2.26 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 0.00 2.33 2.38 0.00 193 L 8.06 4.13 0.00 2.02 1.89 0.93 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 194 I 8.03 3.99 2.06 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.97 0.99 0.00 0.00 195 M 8.52 4.05 0.00 1.98 2.12 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.93 0.00 196 N 7.81 4.34 0.00 2.67 2.88 0.00 0.00 6.99 8.73 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 0.00 197 K 7.75 3.87 0.00 1.16 1.48 0.00 1.22 0.00 0.00 1.07 0.00 0.00 2.67 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.30 1.01 7.81 198 L 8.05 3.96 0.00 1.85 1.71 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 199 N 8.30 4.35 0.00 2.79 2.88 0.00 0.00 7.08 8.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 S 7.51 4.49 0.00 3.96 4.03 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 0.00 201 I 7.23 4.19 1.87 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 1.51 0.69 0.93 0.00 0.00 202 K 8.04 4.07 0.00 1.73 1.88 0.00 1.86 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.47 7.81 * Residues marked with a * may have inaccurate shift predictions.