NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4493 8.2931 120.3284 54.4650 33.8686 173.7630 2 G 3.5504 7.5758 106.7854 43.1883 0.0000 171.3107 3 D 4.4790 8.6761 118.5380 54.2400 41.3378 174.0297 4 N 4.8882 8.0485 118.6791 51.8761 41.8515 172.7134 5 I 4.7559 8.3139 127.4110 59.5833 39.8998 174.7200 6 V 4.6061 8.8076 127.5005 60.8977 34.1961 173.7469 7 L 4.9984 8.9045 130.7712 54.0124 43.7884 174.3777 8 Y 4.8740 9.1171 124.8328 56.6832 40.2505 174.3706 9 Y 4.8133 7.3533 123.1732 56.7448 43.3186 173.0016 10 F 4.5227 7.0318 120.7311 56.5119 40.0265 176.4524 11 D 4.8526 8.3915 120.7419 52.7953 38.1101 174.4374 12 A 4.6287 7.6360 122.6388 51.0019 22.2428 176.0904 13 R 4.3884 7.6638 117.9699 54.6432 31.7528 181.6882 14 G 3.9356 7.5986 106.3648 46.9446 0.0000 176.0970 15 K 3.8929 9.4184 124.4339 57.3180 32.2015 177.6482 16 A 4.1982 6.4817 120.2362 52.7470 19.2583 178.3790 17 E 3.9171 7.8606 118.3493 59.5609 29.5608 178.8450 18 L 4.0300 7.8269 119.7750 58.0409 42.2281 178.8337 19 I 3.2982 7.4918 119.4850 64.1377 36.9361 178.4444 20 R 3.7843 7.7204 118.9798 59.0679 29.8011 179.0824 21 L 3.8078 8.1087 119.1474 57.7771 41.6236 179.6597 22 I 3.6664 7.7160 119.8382 64.2849 36.9026 178.5444 23 F 4.3814 7.8144 118.4357 60.4534 38.5281 177.6187 24 A 3.9301 8.1003 120.6714 55.2462 17.9302 179.0234 25 Y 3.9922 8.0323 117.1958 60.6946 39.0395 177.6486 26 L 4.1007 7.9023 116.6489 54.0456 42.0296 177.0482 27 G 3.8187 7.3913 107.0000 46.4125 0.0000 173.8164 28 I 3.9010 7.7199 121.3491 59.9416 37.5054 175.6818 29 E 4.2386 8.5759 127.2363 55.9653 30.2700 174.8453 30 Y 4.8133 7.7289 122.1163 56.1877 41.1442 173.9273 31 T 3.8868 9.0413 118.3686 63.0283 69.7128 174.1626 32 D 4.7963 8.0980 128.2771 52.7971 39.9684 173.8443 33 K 4.1185 8.6190 124.0609 55.5799 33.7191 175.3432 34 R 4.8276 8.2020 125.5802 54.1833 33.5089 175.0863 35 F 4.6563 8.2786 123.7694 58.3653 39.6452 176.4762 36 G 4.2312 8.9704 111.2972 44.8690 0.0000 175.4749 37 V 3.6921 7.9139 118.9958 66.0971 32.2175 176.6165 38 N 4.7385 8.0242 117.2848 51.9831 38.5696 176.3165 39 G 3.7589 8.2538 115.3830 46.6458 0.0000 173.8589 40 D 4.8158 9.1987 127.5715 53.2382 41.9367 175.6054 41 A 4.2609 8.7560 129.7110 54.9299 18.6764 178.8546 42 F 4.1011 8.5322 119.3315 61.4995 39.4214 177.6517 43 V 3.6920 8.1057 117.5252 65.9555 31.4883 177.4546 44 E 3.9213 8.0580 119.3079 59.1554 29.4167 178.6389 45 F 3.2873 8.0503 120.8462 60.5772 39.1338 177.0943 46 K 3.5669 7.6848 118.9438 59.5528 31.9493 178.5898 47 N 4.3529 8.3418 117.0164 56.0393 38.4446 177.0909 48 F 4.0478 8.1227 122.1619 61.3467 39.1907 177.4108 49 K 3.5911 7.3751 116.8601 59.0969 31.7932 179.2505 50 K 4.0441 7.3445 119.1924 59.8234 31.9922 179.7753 *51 E 4.0827 7.6839 117.6036 59.8589 30.2539 179.0288 52 K 4.3041 7.1524 119.0318 54.7872 33.1918 177.5970 53 D 4.4414 8.1137 123.8353 53.4224 39.8574 174.6787 54 T 4.2758 7.4643 113.8128 59.5301 70.3419 175.1597 55 P 4.0415 0.0000 0.0000 64.8843 30.7775 176.9135 56 F 5.0342 7.4497 114.5243 56.1012 40.7111 174.3814 57 E 4.0845 8.3300 117.5643 56.6404 26.8697 174.0865 58 Q 5.1284 7.7611 111.9122 54.3242 32.4697 175.1963 59 V 5.0285 8.3061 111.9490 58.7012 35.0791 174.0185 60 P 5.0572 0.0000 0.0000 63.2924 32.3311 175.5767 61 I 4.8959 9.0183 122.2005 59.6625 40.5802 174.0307 62 L 5.0379 9.3280 129.9799 53.5959 43.9853 174.5847 63 Q 5.0841 9.6382 128.4905 54.7071 31.4362 174.2124 64 I 4.4343 8.8847 128.9761 59.9838 38.7630 178.2902 65 G 3.9144 8.7739 121.5793 46.9832 0.0000 173.5720 66 D 4.6932 9.0908 124.0176 53.7535 41.9892 175.8990 67 L 4.0790 8.0264 123.5255 54.8006 42.4331 175.1190 68 I 4.6736 8.2750 127.0842 59.8537 38.7462 174.8921 69 L 4.8212 9.4733 127.4600 52.8205 44.3390 175.6848 70 A 5.0310 8.4434 124.0076 50.8775 22.9760 171.4533 71 Q 3.7292 8.8595 124.8229 56.0417 27.3109 174.6772 72 S 4.1463 8.9115 119.4517 62.1699 62.8600 176.9324 73 Q 4.3080 8.2212 119.2911 59.1602 28.5936 178.7240 74 A 4.0756 8.0603 121.2061 55.1275 18.4086 179.6295 75 I 3.6700 8.0733 118.4903 64.4925 37.2436 178.4976 76 V 3.3262 8.0738 119.3854 66.3366 31.2524 178.3287 77 R 3.2793 8.0509 117.8041 59.0109 29.8848 178.4917 78 Y 4.0485 8.1335 119.4578 60.7630 38.7961 178.1525 79 L 3.9630 8.2952 120.3437 57.8637 41.7122 179.6909 80 S 4.1757 8.0050 115.1845 61.0676 62.1858 176.6292 81 K 3.9645 7.8636 122.6243 59.1883 31.7683 178.9064 82 K 3.7277 7.6609 119.1626 58.6923 32.1949 176.8364 83 Y 4.3915 7.6365 113.5891 56.7149 38.8097 175.2850 84 N 4.2305 7.8418 116.3902 55.0497 37.5659 173.8646 85 I 4.7941 8.5446 107.8036 61.2582 38.7077 176.9177 86 C 4.9690 8.9458 114.5546 58.4627 31.1839 172.0622 87 G 4.2434 7.8312 105.5006 44.0216 0.0000 173.3437 88 E 4.4891 8.5882 121.8444 55.9794 29.7903 176.2090 89 S 4.6443 7.4501 113.9899 55.9766 67.2364 174.4968 90 E 3.9172 8.6910 121.8940 59.4801 29.3574 178.4537 91 L 3.9227 7.8520 119.8427 58.1689 42.2737 178.4836 92 N 4.6861 8.2989 116.4400 56.1255 38.4305 176.9355 93 E 4.9028 8.5665 122.6167 58.8337 29.6854 178.7132 94 F 4.1560 8.1249 120.1387 61.5155 39.3752 176.7159 95 Y 4.1543 8.0722 116.1403 60.9767 37.5847 178.3161 96 A 3.8507 8.1389 121.7034 55.1443 18.3655 179.1999 97 D 4.7732 7.7554 117.2758 57.2228 41.3612 177.9229 98 M 3.8355 8.0837 118.9467 58.8131 32.0995 178.2374 99 I 3.8356 8.0361 120.0891 64.3065 37.2873 178.1100 100 F 4.2868 8.4669 121.7179 61.7538 39.1177 176.9672 101 C 4.0857 8.6628 116.7734 62.6454 27.7325 176.4047 102 G 3.8734 8.3374 107.4707 47.7945 0.0000 175.7617 103 V 3.7152 8.3834 121.2172 66.1140 31.5109 178.1528 104 Q 3.9837 7.8662 117.4888 58.8089 28.0403 178.6247 105 D 4.1404 7.6121 119.8106 57.4772 40.8824 178.7442 106 I 3.3443 6.6640 118.9273 63.8010 37.8848 177.4061 107 H 4.2152 8.5801 119.9406 59.1261 29.6148 176.4059 108 Y 4.0438 8.1015 121.4412 60.8194 38.1559 178.4414 109 K 3.9130 7.8529 118.7993 59.4038 32.0883 179.1157 110 F 3.0721 8.1361 120.8529 60.9470 39.2694 176.9025 111 N 3.8419 8.4470 116.4606 56.3207 38.1437 177.1512 112 N 4.4312 7.9322 116.5919 55.5473 38.5062 176.8205 113 T 4.1485 6.5027 114.8777 65.5684 69.4890 176.2274 114 N 4.0085 7.6908 117.8307 55.9550 38.8563 176.0842 115 L 3.8802 7.0863 118.4889 55.5353 42.5223 177.4179 116 F 4.7146 7.1864 112.9456 57.5468 41.4665 175.9163 *120 E 4.5397 8.1482 119.8139 56.8250 31.4625 177.7069 121 T 3.8770 8.1449 114.8141 67.3300 68.4312 176.3469 122 T 3.9047 7.9319 116.5967 66.5691 68.5178 176.4005 123 F 4.4412 8.1198 123.3079 60.9047 39.3963 176.8809 124 L 3.6421 8.4267 118.8536 57.2805 41.9246 177.6134 125 N 4.7247 8.1611 114.5804 53.3995 38.5835 175.7047 126 E 4.5059 7.8110 117.6345 57.9153 31.3264 177.7666 127 D 4.3940 7.9268 118.5722 57.1812 41.0849 178.2844 128 L 3.7408 7.8398 120.8387 58.0292 42.0243 177.5253 129 P 4.3654 0.0000 0.0000 65.1194 31.4277 178.6574 130 K 3.6030 7.4354 118.7041 59.3574 32.2978 179.0882 131 W 3.6718 8.3437 119.3432 59.4916 28.8833 178.8347 132 S 4.8737 7.9762 117.3696 60.8716 62.0234 176.8665 133 G 3.6424 7.8802 108.5740 47.8066 0.0000 175.3167 134 Y 4.2790 7.2531 118.8016 61.1785 37.7990 178.9768 135 F 4.6900 8.0572 118.1571 60.4464 38.9569 177.4990 136 E 4.0335 8.5658 118.5588 59.6433 29.3655 179.5091 137 K 3.9908 8.2796 119.2994 59.4072 32.2476 178.9010 138 L 4.0924 8.0146 119.4201 57.5943 41.4974 179.4140 139 L 3.7453 8.2707 119.3642 57.5182 41.3136 179.2088 140 K 3.7743 7.9872 118.5207 59.6077 32.1178 178.1665 141 K 3.9902 7.8922 118.6824 59.0473 32.1349 177.3309 142 N 4.6693 7.4038 113.9384 54.0313 39.9126 174.3901 143 H 4.2671 8.3386 120.0569 55.0372 30.9358 173.4299 *148 N 4.3147 8.3307 119.2142 53.4676 39.1860 173.3654 149 D 4.6413 8.4445 123.5339 53.0840 40.4772 176.2285 150 K 2.6399 7.2152 120.0517 55.1040 32.8558 175.9789 151 Y 4.1392 5.9103 120.0267 56.2991 39.7604 174.1875 152 Y 5.3743 7.9853 121.8864 56.1305 40.8922 176.6253 153 F 4.2538 9.7203 122.8168 59.3610 38.7202 176.3430 154 V 4.4111 7.5524 120.0318 61.6866 34.6419 174.8000 155 G 3.8817 8.8345 116.1149 47.1529 0.0000 173.6588 156 N 5.0885 8.7635 122.2386 52.8315 39.5221 173.4082 157 N 4.3840 6.9809 111.5601 50.4770 42.6445 174.0070 158 L 4.2975 8.0621 122.0937 55.3847 42.6789 176.2847 159 T 4.7755 8.6764 115.5328 59.3554 71.7014 174.7141 160 Y 4.0646 8.8977 120.5531 59.7602 37.6407 178.2399 161 A 3.7553 6.6216 122.9168 55.0695 18.3735 179.1382 162 D 4.6632 7.8925 117.3823 57.8859 40.9567 179.2377 163 L 4.1391 7.8557 118.5859 57.4510 41.5829 179.2911 164 A 4.0885 8.5312 121.4271 55.2840 18.4250 179.9154 165 V 3.2295 7.8743 116.9074 65.7352 31.4295 178.0041 166 F 4.2024 8.5256 120.5657 61.3983 39.2352 176.5449 167 N 4.0113 8.6501 117.0741 56.5047 38.6039 176.0952 168 L 3.3392 7.9484 121.8202 58.6540 42.0813 178.7269 169 Y 3.8184 7.7412 116.0285 60.3351 37.6291 177.6748 170 D 4.0671 7.7800 119.2149 57.1645 41.5733 177.4251 171 D 4.3615 8.0947 118.9394 57.2303 41.2058 178.3062 172 I 2.6828 7.3527 120.5466 63.9906 36.7387 177.8370 173 E 4.7674 8.6352 119.5376 57.5047 29.0186 178.9627 174 T 4.0227 7.3588 109.1151 63.7911 69.1109 175.8300 175 K 4.2428 7.8328 120.4483 56.4554 34.3074 175.5073 176 Y 4.8670 8.0509 117.3330 54.8853 38.5124 173.8186 177 P 4.4489 0.0000 0.0000 64.5539 31.9416 177.3893 178 S 4.6322 8.0862 110.9308 58.1427 62.2334 175.1414 179 S 4.4512 8.1152 113.1817 60.2094 63.4009 174.5150 180 L 4.6773 7.7696 120.3357 54.3599 42.2404 177.7754 181 K 3.8295 7.9041 121.3824 59.5396 32.0398 177.1648 182 N 4.5241 7.8567 112.2829 52.9814 38.6178 175.5748 183 F 4.7669 7.6466 118.2792 54.1398 39.9563 173.6663 184 P 4.1872 0.0000 0.0000 65.3622 31.4779 178.0043 185 L 3.7748 8.0033 117.3700 57.5902 41.6172 179.1680 186 L 3.9641 9.3447 121.5790 57.7694 41.9869 178.9811 187 K 3.8656 8.2981 119.7596 59.5083 32.1158 178.8017 188 A 3.8066 8.0474 121.3384 54.8945 18.0006 179.1869 189 H 4.0442 8.2206 117.4919 59.2951 29.8896 176.8080 190 N 4.6045 8.2926 118.8835 57.0157 38.5698 176.5549 191 E 4.0585 7.9418 119.5602 58.7671 29.7123 178.7909 192 F 4.4228 8.4197 120.7919 61.5791 39.4945 177.2698 193 I 3.1011 7.9172 119.8716 64.0766 36.3141 178.6500 194 S 3.8002 8.0884 115.1011 60.4847 62.4528 175.2121 195 N 4.8214 7.1450 117.6855 51.7256 39.1690 174.9442 196 L 4.0046 7.1242 122.1503 54.1340 40.9986 175.9943 197 P 4.4195 0.0000 0.0000 66.0508 30.1427 178.3661 198 N 4.6989 8.1144 114.7288 56.0783 39.2942 177.7478 199 I 4.0173 7.7677 118.8968 63.9316 37.4023 177.7276 200 K 4.3245 8.6903 122.9986 59.0837 31.7108 178.2045 201 N 4.3254 7.6584 116.0206 56.7707 38.8027 176.1942 202 Y 4.1545 7.6096 120.4569 60.9058 38.7288 178.0983 203 I 3.6146 7.5931 119.3903 64.3753 37.3360 178.0061 204 T 4.0594 7.8303 112.7686 63.8668 67.2773 175.0934 205 N 4.8185 7.4439 115.7900 51.9313 39.6920 174.8258 206 R 4.1651 6.8149 117.4312 54.8807 30.8130 176.7271 207 K 4.1085 8.3477 117.4268 57.2797 32.8529 176.7598 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 8.29 4.45 0.00 2.08 2.20 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.51 0.00 2 G 7.58 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 D 8.68 4.48 0.00 2.78 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 4 N 8.05 4.89 0.00 2.83 2.70 0.00 0.00 7.10 7.82 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 5 I 8.31 4.76 1.72 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 1.16 0.73 0.85 0.00 0.00 6 V 8.81 4.61 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 0.25 0.00 0.00 0.91 0.00 0.00 7 L 8.90 5.00 0.00 2.02 1.75 1.03 1.07 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 8 Y 9.12 4.87 0.00 2.85 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 0.00 0.00 0.00 9 Y 7.35 4.81 0.00 2.86 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 10 F 7.03 4.52 0.00 2.45 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 11 D 8.39 4.85 0.00 2.94 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 12 A 7.64 4.63 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 13 R 7.66 4.39 0.00 1.94 1.91 0.00 3.57 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.63 0.00 14 G 7.60 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 15 K 9.42 3.89 0.00 1.80 1.88 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.12 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.60 1.70 7.81 16 A 6.48 4.20 0.66 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 0.00 0.00 0.00 0.00 0.00 0.00 17 E 7.86 3.92 0.00 2.18 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 2.39 2.56 0.00 18 L 7.83 4.03 0.00 1.85 1.66 0.98 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 19 I 7.49 3.30 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 1.40 0.43 0.23 0.00 0.00 20 R 7.72 3.78 0.00 2.10 1.99 0.00 3.53 0.00 0.00 3.54 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.91 0.00 21 L 8.11 3.81 0.00 1.84 1.74 1.17 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.72 3.67 1.62 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.78 0.69 0.00 0.00 23 F 7.81 4.38 0.00 2.75 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 24 A 8.10 3.93 1.07 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 0.00 0.00 25 Y 8.03 3.99 0.00 2.92 3.15 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 26 L 7.90 4.10 0.00 1.52 1.36 0.59 0.92 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 27 G 7.39 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 I 7.72 3.90 1.69 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 0.96 0.32 0.52 0.00 0.00 29 E 8.58 4.24 0.00 1.89 1.79 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 2.22 2.23 0.00 30 Y 7.73 4.81 0.00 2.83 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 0.00 0.00 0.00 31 T 9.04 3.89 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 1.08 0.00 0.00 32 D 8.10 4.80 0.00 2.29 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 33 K 8.62 4.12 0.00 1.63 1.36 0.00 1.45 0.00 0.00 1.69 0.00 0.00 2.89 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.54 1.32 7.81 34 R 8.20 4.83 0.00 1.64 1.75 0.00 3.25 0.00 0.00 3.44 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 35 F 8.28 4.66 0.00 2.89 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 36 G 8.97 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 0.00 0.00 0.00 0.00 37 V 7.91 3.69 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.99 0.00 0.00 38 N 8.02 4.74 0.00 2.83 2.83 0.00 0.00 6.89 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 G 8.25 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 D 9.20 4.82 0.00 2.76 2.66 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 0.00 0.00 0.00 0.00 41 A 8.76 4.26 1.65 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 42 F 8.53 4.10 0.00 3.18 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 V 8.11 3.69 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 1.06 0.00 0.00 44 E 8.06 3.92 0.00 2.31 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.46 0.00 45 F 8.05 3.29 0.00 2.50 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 K 7.68 3.57 0.00 1.82 1.89 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.35 7.81 47 N 8.34 4.35 0.00 2.89 2.83 0.00 0.00 6.67 8.89 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 48 F 8.12 4.05 0.00 3.02 2.88 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 49 K 7.38 3.59 0.00 1.56 1.55 0.00 1.46 0.00 0.00 1.26 0.00 0.00 2.13 0.00 0.00 2.44 0.00 0.00 0.00 0.00 1.07 0.76 7.81 50 K 7.34 4.04 0.00 1.76 1.76 0.00 1.46 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.39 7.81 *51 E 7.68 4.08 0.00 2.09 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 2.26 2.22 0.00 52 K 7.15 4.30 0.00 0.79 1.12 0.00 1.26 0.00 0.00 1.20 0.00 0.00 3.13 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.06 1.18 7.81 53 D 8.11 4.44 0.00 2.52 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 54 T 7.46 4.28 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 1.16 0.00 0.00 55 P 0.00 4.04 0.00 0.84 1.78 0.00 3.64 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.72 0.00 56 F 7.45 5.03 0.00 3.23 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 57 E 8.33 4.08 0.00 2.17 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.27 0.00 58 Q 7.76 5.13 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.55 6.69 0.00 0.00 0.00 0.00 0.00 2.46 2.72 0.00 59 V 8.31 5.03 2.56 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 1.05 0.00 0.00 0.81 0.00 0.00 60 P 0.00 5.06 0.00 2.12 1.95 0.00 3.85 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 61 I 9.02 4.90 2.37 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.77 1.24 0.00 0.00 62 L 9.33 5.04 0.00 1.82 1.63 1.24 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 9.64 5.08 0.00 2.53 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.53 0.00 0.00 0.00 0.00 0.00 2.53 2.54 0.00 64 I 8.88 4.43 1.95 0.00 0.00 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 1.27 0.97 0.99 0.00 0.00 65 G 8.77 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 66 D 9.09 4.69 0.00 2.68 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 67 L 8.03 4.08 0.00 1.80 1.70 0.90 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 68 I 8.27 4.67 1.84 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 1.49 0.94 0.92 0.00 0.00 69 L 9.47 4.82 0.00 1.62 1.50 0.67 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 70 A 8.44 5.03 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.86 3.73 0.00 2.40 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.73 0.00 0.00 0.00 0.00 0.00 2.62 2.49 0.00 72 S 8.91 4.15 0.00 3.93 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 Q 8.22 4.31 0.00 2.24 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.59 2.53 0.00 74 A 8.06 4.08 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 I 8.07 3.67 2.00 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 1.43 0.88 0.87 0.00 0.00 76 V 8.07 3.33 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 0.38 0.00 0.00 0.88 0.00 0.00 77 R 8.05 3.28 0.00 1.84 1.84 0.00 3.21 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.46 0.00 78 Y 8.13 4.05 0.00 3.02 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 79 L 8.30 3.96 0.00 1.69 1.60 0.38 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.01 4.18 0.00 3.38 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 81 K 7.86 3.96 0.00 1.96 1.69 0.00 1.62 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.42 1.57 7.81 82 K 7.66 3.73 0.00 1.43 1.75 0.00 1.33 0.00 0.00 1.58 0.00 0.00 3.00 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.85 1.08 7.81 83 Y 7.64 4.39 0.00 3.05 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 84 N 7.84 4.23 0.00 2.82 2.85 0.00 0.00 6.83 7.82 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 85 I 8.54 4.79 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.25 1.08 0.00 0.00 86 C 8.95 4.97 0.00 3.29 3.28 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 87 G 7.83 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 E 8.59 4.49 0.00 1.98 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 2.27 2.27 0.00 89 S 7.45 4.64 0.00 4.03 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 90 E 8.69 3.92 0.00 2.07 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 2.37 2.38 0.00 91 L 7.85 3.92 0.00 1.76 1.67 0.59 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.30 4.69 0.00 3.02 2.96 0.00 0.00 6.63 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 93 E 8.57 4.90 0.00 2.21 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 0.00 2.41 2.29 0.00 94 F 8.12 4.16 0.00 3.14 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 95 Y 8.07 4.15 0.00 3.28 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 96 A 8.14 3.85 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 97 D 7.76 4.77 0.00 3.00 2.75 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 98 M 8.08 3.84 0.00 1.99 1.16 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 2.58 2.59 0.00 99 I 8.04 3.84 2.04 0.00 0.00 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 1.56 0.64 0.74 0.00 0.00 100 F 8.47 4.29 0.00 3.10 3.40 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 0.00 101 C 8.66 4.09 0.00 3.18 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 0.00 102 G 8.34 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 V 8.38 3.72 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 0.94 0.00 0.00 0.72 0.00 0.00 104 Q 7.87 3.98 0.00 2.08 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 1.85 2.06 0.00 105 D 7.61 4.14 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 6.66 3.34 1.00 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 1.44 1.22 1.02 0.00 0.00 107 H 8.58 4.22 0.00 3.34 3.22 0.00 5.67 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 Y 8.10 4.04 0.00 3.17 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 K 7.85 3.91 0.00 2.19 2.07 0.00 1.59 0.00 0.00 1.85 0.00 0.00 2.94 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.59 1.70 7.81 110 F 8.14 3.07 0.00 2.79 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 N 8.45 3.84 0.00 2.69 2.74 0.00 0.00 7.06 6.92 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 0.00 112 N 7.93 4.43 0.00 2.55 2.73 0.00 0.00 7.03 7.08 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 0.00 113 T 6.50 4.15 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 1.22 0.00 0.00 114 N 7.69 4.01 0.00 1.44 1.75 0.00 0.00 7.29 7.93 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 0.00 115 L 7.09 3.88 0.00 0.30 0.33 0.62 0.36 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 0.00 116 F 7.19 4.71 0.00 2.98 2.91 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 *120 E 8.15 4.54 0.00 2.12 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 0.00 2.48 2.43 0.00 121 T 8.14 3.88 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 1.23 0.00 0.00 122 T 7.93 3.90 4.32 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 1.35 0.00 0.00 123 F 8.12 4.44 0.00 3.14 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 L 8.43 3.64 0.00 1.78 1.58 -0.08 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 125 N 8.16 4.72 0.00 2.83 2.82 0.00 0.00 6.86 7.27 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 0.00 126 E 7.81 4.51 0.00 2.19 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 2.29 2.36 0.00 127 D 7.93 4.39 0.00 2.87 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 L 7.84 3.74 0.00 1.01 1.32 0.80 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 129 P 0.00 4.37 0.00 2.23 2.23 0.00 3.57 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.12 0.00 130 K 7.44 3.60 0.00 1.91 1.88 0.00 1.59 0.00 0.00 1.59 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.48 1.09 7.81 131 W 8.34 3.67 0.00 3.53 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 S 7.98 4.87 0.00 2.72 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 0.00 133 G 7.88 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 Y 7.25 4.28 0.00 2.71 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 F 8.06 4.69 0.00 3.40 3.45 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 0.00 136 E 8.57 4.03 0.00 2.38 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 2.58 2.98 0.00 137 K 8.28 3.99 0.00 2.04 2.01 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.50 7.81 138 L 8.01 4.09 0.00 2.34 2.03 1.04 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 139 L 8.27 3.75 0.00 1.75 1.56 0.70 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 140 K 7.99 3.77 0.00 1.91 2.04 0.00 1.83 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.48 7.81 141 K 7.89 3.99 0.00 1.98 1.95 0.00 1.70 0.00 0.00 1.62 0.00 0.00 3.07 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.46 7.81 142 N 7.40 4.67 0.00 2.76 2.92 0.00 0.00 7.21 7.77 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 0.00 143 H 8.34 4.27 0.00 3.05 3.23 0.00 6.03 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 *148 N 8.33 4.31 0.00 2.57 2.52 0.00 0.00 6.88 8.47 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 0.00 149 D 8.44 4.64 0.00 2.86 2.75 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 0.00 150 K 7.22 2.64 0.00 1.51 0.91 0.00 1.41 0.00 0.00 1.63 0.00 0.00 3.16 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.49 1.17 7.81 151 Y 5.91 4.14 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 0.00 152 Y 7.99 5.37 0.00 2.98 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 0.00 153 F 9.72 4.25 0.00 3.09 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 0.00 154 V 7.55 4.41 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 1.20 0.00 0.00 1.08 0.00 0.00 155 G 8.83 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 0.00 156 N 8.76 5.09 0.00 2.67 2.82 0.00 0.00 6.51 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 N 6.98 4.38 0.00 2.49 2.51 0.00 0.00 6.81 7.73 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 0.00 158 L 8.06 4.30 0.00 1.78 1.58 0.69 0.30 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 0.00 159 T 8.68 4.78 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 1.21 0.00 0.00 160 Y 8.90 4.06 0.00 3.05 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 0.00 161 A 6.62 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 D 7.89 4.66 0.00 2.97 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 0.00 163 L 7.86 4.14 0.00 1.86 1.75 0.70 0.78 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 0.00 164 A 8.53 4.09 1.60 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 0.00 0.00 165 V 7.87 3.23 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 0.89 0.00 0.00 -0.07 0.00 0.00 166 F 8.53 4.20 0.00 3.19 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 0.00 167 N 8.65 4.01 0.00 3.03 2.98 0.00 0.00 6.90 6.22 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 0.00 168 L 7.95 3.34 0.00 1.54 1.48 0.41 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 169 Y 7.74 3.82 0.00 3.06 2.91 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 0.00 170 D 7.78 4.07 0.00 1.58 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 0.00 0.00 0.00 171 D 8.09 4.36 0.00 2.88 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 0.00 172 I 7.35 2.68 1.59 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 -0.36 1.08 0.00 0.00 173 E 8.64 4.77 0.00 2.03 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 2.56 2.39 0.00 174 T 7.36 4.02 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 175 K 7.83 4.24 0.00 1.60 1.36 0.00 1.38 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.71 0.54 7.81 176 Y 8.05 4.87 0.00 3.16 2.88 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 0.00 177 P 0.00 4.45 0.00 2.08 2.15 0.00 3.81 0.00 0.00 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.06 0.00 178 S 8.09 4.63 0.00 3.90 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 S 8.12 4.45 0.00 4.14 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 L 7.77 4.68 0.00 1.85 1.71 0.98 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 181 K 7.90 3.83 0.00 1.77 1.83 0.00 1.78 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.41 7.81 182 N 7.86 4.52 0.00 1.90 2.22 0.00 0.00 6.66 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 0.00 183 F 7.65 4.77 0.00 3.03 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 0.00 184 P 0.00 4.19 0.00 2.13 2.05 0.00 3.81 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.11 0.00 185 L 8.00 3.77 0.00 1.82 1.64 0.95 0.59 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 0.00 186 L 9.34 3.96 0.00 1.89 1.68 1.06 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 0.00 0.00 0.00 0.00 187 K 8.30 3.87 0.00 2.13 1.91 0.00 1.81 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.56 1.44 7.81 188 A 8.05 3.81 0.58 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 0.00 189 H 8.22 4.04 0.00 3.20 3.49 0.00 5.80 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 N 8.29 4.60 0.00 3.07 3.07 0.00 0.00 7.28 7.23 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 0.00 191 E 7.94 4.06 0.00 2.14 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 192 F 8.42 4.42 0.00 3.16 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 I 7.92 3.10 1.50 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.07 0.26 0.00 0.00 194 S 8.09 3.80 0.00 4.10 4.39 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 0.00 195 N 7.15 4.82 0.00 2.72 2.86 0.00 0.00 7.02 7.73 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 0.00 196 L 7.12 4.00 0.00 1.59 1.58 0.68 1.04 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 0.00 197 P 0.00 4.42 0.00 2.15 2.12 0.00 3.59 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.16 0.00 198 N 8.11 4.70 0.00 2.76 3.06 0.00 0.00 7.04 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 I 7.77 4.02 1.94 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 1.65 1.26 0.71 0.00 0.00 200 K 8.69 4.32 0.00 1.78 1.89 0.00 1.58 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.38 7.81 201 N 7.66 4.33 0.00 2.85 2.85 0.00 0.00 6.93 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 Y 7.61 4.15 0.00 3.16 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 0.00 203 I 7.59 3.61 1.96 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.93 1.02 0.00 0.00 204 T 7.83 4.06 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 205 N 7.44 4.82 0.00 2.76 2.78 0.00 0.00 7.00 7.40 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 0.00 206 R 6.81 4.17 0.00 1.62 1.27 0.00 2.90 0.00 0.00 2.66 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.39 0.00 207 K 8.35 4.11 0.00 1.88 1.81 0.00 1.61 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.43 7.81 * Residues marked with a * may have inaccurate shift predictions.