NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3082 8.2644 123.5814 52.0897 19.4108 176.4601 3 R 3.9036 8.5690 123.9292 58.5164 30.1283 175.6818 4 R 4.0642 8.3123 118.0130 57.8129 31.6105 176.9143 5 R 4.3920 7.3892 116.9476 55.1213 31.7855 176.5880 6 R 3.9150 8.4419 117.2543 55.6997 30.2236 174.4676 7 A 3.5171 7.8102 119.7581 53.2731 16.1448 176.1269 8 E 4.3328 8.3909 120.2964 55.6679 30.7385 177.0285 9 V 3.6038 8.2235 123.5385 62.5193 31.8422 175.5118 10 R 3.9817 8.4502 128.5042 56.1341 30.4373 175.7826 11 Q 4.2052 8.5134 126.3622 55.7713 29.9030 174.6383 12 L 4.5705 8.1346 122.3851 53.0861 44.2157 175.9039 13 Q 4.3848 8.2487 121.0727 53.8127 29.0459 173.1806 14 P 4.2712 0.0000 0.0000 62.0746 32.4582 175.7607 15 D 4.6430 8.6415 119.3097 54.6085 41.9305 176.8958 16 L 4.2557 8.4830 121.8164 56.4202 42.6112 178.4686 17 V 3.7866 8.2689 116.8356 64.5430 32.0456 175.8441 18 Y 4.3997 8.7996 115.7380 57.7526 39.5556 176.1253 19 G 4.3229 8.6322 105.5298 46.2575 0.0000 172.4629 20 D 4.9591 7.7686 116.3403 52.0221 44.4828 176.2523 21 V 3.8242 8.3125 117.1073 63.2000 31.9988 178.0302 22 L 4.1333 9.3372 122.8178 57.3121 41.9113 178.6563 23 V 3.1794 7.7274 118.1153 65.8635 31.5992 177.6107 24 T 3.7192 7.4673 108.7762 65.1426 68.3214 176.0799 25 A 4.0164 7.5267 123.4205 54.1920 18.3527 179.2164 26 F 4.1511 7.8336 118.1423 61.0137 39.4446 177.7128 27 I 3.4189 7.1674 119.6623 64.3841 36.6530 178.1999 28 N 4.2608 7.7120 115.8940 56.0572 38.3597 177.3470 29 K 4.0473 7.2396 118.7040 59.0387 32.1847 179.1008 30 I 3.9264 6.9297 118.9912 62.7389 37.0452 175.5971 31 M 3.9869 7.6424 119.3778 55.9756 31.7234 175.9211 32 R 4.3654 8.3826 128.1642 52.3385 29.3630 173.7007 33 D 4.4602 9.6819 117.5481 52.9780 40.1622 176.1585 34 G 3.7545 8.0761 106.7297 47.3286 0.0000 175.1216 35 K 4.5709 7.5018 115.3218 53.6238 32.4667 177.1033 36 K 3.7987 8.0422 122.4368 59.8587 32.3378 177.1148 37 N 4.3549 8.1109 115.9798 56.3030 38.4851 176.6809 38 L 4.1755 7.5776 118.7118 56.7093 42.4379 177.8847 39 A 4.2773 7.6953 119.7276 55.1127 19.4263 178.9876 40 A 4.0074 8.1834 118.9077 54.8384 18.6416 179.9285 41 R 4.1935 8.1761 116.8482 58.8248 29.9799 178.4463 42 I 4.1491 7.6925 117.6158 62.6358 37.9148 177.4902 43 F 4.4326 7.7241 121.7009 61.6425 39.2184 176.8539 44 Y 4.0274 7.5891 115.8048 61.0354 37.5004 178.1730 45 D 4.3881 8.0462 118.1818 56.7393 41.3136 178.0636 46 A 4.2084 7.8238 121.1296 54.6091 18.5170 179.2198 47 C 4.1999 7.6789 115.0347 62.3890 28.2007 175.7908 48 K 4.2051 8.2957 118.9431 58.4249 32.1371 177.6105 49 I 4.3313 7.3048 117.9378 61.3712 37.5801 177.2374 50 I 4.0938 8.0283 124.1419 63.7374 37.0649 178.0977 51 Q 4.1860 7.9497 117.7752 59.1722 28.7275 177.6382 52 E 4.0838 8.1280 118.8609 59.1672 29.7033 178.9306 53 K 4.0965 7.8036 118.8190 58.6049 32.9571 177.4828 54 T 4.6620 7.4769 112.1571 60.5526 70.4689 173.7697 55 G 3.9542 8.6443 115.9539 46.1695 0.0000 173.2225 56 Q 4.6486 7.6061 118.1750 53.3056 31.0901 175.8378 57 E 4.1253 8.5363 120.9987 56.1494 29.9314 176.0558 58 P 4.5615 0.0000 0.0000 63.1363 31.0283 176.4171 59 L 4.5719 7.9998 118.3428 55.0989 43.6573 176.2473 60 K 4.4956 8.0242 117.3079 57.0135 33.7114 177.8370 61 V 3.7065 7.7778 117.7588 65.7882 31.7076 176.9506 62 F 4.3336 8.0678 119.2547 59.7430 39.5202 177.2643 63 K 3.9130 7.9010 119.2197 59.2745 32.0608 178.2781 64 Q 3.9781 7.9935 119.1847 58.7062 28.7782 177.6635 65 A 4.1501 7.3583 119.6989 54.4037 18.7439 179.5468 66 V 3.4845 6.9886 116.2617 66.0229 31.0548 177.8651 67 E 3.9405 7.6185 118.3819 59.2025 29.3183 177.8584 68 N 4.6654 7.7805 113.1365 54.3284 38.6441 175.4662 69 V 4.3455 7.4653 118.2798 62.1092 33.3230 175.3038 70 K 4.0599 7.6593 117.9347 56.0397 31.3906 174.8689 71 P 4.5121 0.0000 0.0000 62.5041 31.8697 176.8486 72 R 4.1177 8.6901 123.1795 59.2001 30.5034 176.1216 73 M 5.0519 7.7903 114.1579 55.0259 35.6914 173.9368 74 E 4.8559 8.7168 119.6760 54.7956 34.2100 174.6303 75 V 4.6270 8.4376 113.7979 60.3631 32.5020 175.7530 76 R 4.6123 8.5760 125.5222 54.3068 32.1779 176.8332 77 S 4.1804 8.5838 117.1182 58.6500 63.1839 173.1061 78 R 3.9639 7.6696 119.1016 55.3284 32.2484 173.5050 79 R 4.1904 8.2760 125.0405 54.8460 30.2980 174.2818 80 V 3.8627 8.7210 124.1069 61.5171 33.8657 174.2332 81 G 4.1560 7.8255 115.3344 46.1273 0.0000 171.2143 82 G 3.9488 8.7931 112.5807 44.6521 0.0000 172.7930 83 A 4.0864 6.4922 119.1643 52.3707 22.0467 173.9927 84 N 4.8264 8.3282 114.8731 51.4886 40.5356 174.5520 85 Y 4.1507 8.0254 120.8784 58.3194 38.4743 176.5728 86 Q 4.4827 7.8493 120.9564 53.8868 29.5795 174.4140 87 V 3.9379 8.2690 124.4306 62.1375 32.4825 173.2440 88 P 5.2841 0.0000 0.0000 62.9722 32.8901 174.7562 89 M 4.5992 8.1540 117.1823 54.7590 35.0108 173.7682 90 E 4.1304 8.9341 118.7900 56.3509 30.0907 177.2698 91 V 4.2194 8.0158 121.8077 60.5747 32.8004 175.8254 92 S 4.2478 8.4742 122.0854 57.6613 64.2188 172.4693 93 P 4.2268 0.0000 0.0000 66.5468 30.5968 178.7666 94 R 3.8822 7.9899 116.9446 58.9066 29.9365 178.6460 95 R 3.9220 7.8080 117.7154 58.8424 30.2511 178.0912 96 Q 3.8775 8.0548 117.9491 59.0600 28.7885 178.7952 97 Q 3.8737 8.0825 120.2383 59.3559 28.7690 178.3286 98 S 4.0690 7.4900 115.5771 61.5946 62.7960 176.9056 99 L 3.3141 7.6270 121.1102 57.7021 41.3257 178.7729 100 A 3.9703 7.8853 120.6889 55.6314 18.1179 179.3512 101 L 4.0749 8.1253 116.3127 58.1899 41.7672 179.9520 102 R 3.9103 7.5342 118.1315 59.0203 30.1619 178.1679 103 W 4.7623 8.3811 119.0565 60.6912 29.0912 177.8014 104 L 4.1021 8.4693 118.4579 58.0572 40.9304 179.3790 105 V 3.6519 8.2424 118.0020 66.4932 31.2730 178.7947 106 Q 4.0312 8.4476 117.1476 58.9756 28.8454 178.1502 107 A 4.1530 8.7028 121.9039 54.7159 18.2374 179.4118 108 A 4.0676 8.2615 119.7069 55.7012 18.3909 179.5347 109 N 4.4272 7.7968 112.6255 55.3806 38.7020 176.7313 110 Q 4.3119 7.4950 118.3729 55.9009 29.4467 176.3379 111 R 4.1656 7.3471 119.5686 55.6999 30.6262 174.5033 112 P 4.7056 0.0000 0.0000 62.7368 31.6837 175.8771 113 E 4.2071 7.8420 118.6484 56.6958 29.9890 177.2267 114 R 4.1505 8.5432 121.4080 57.8860 31.1158 177.0002 115 R 4.6282 7.6001 115.7530 54.0234 32.1555 177.0283 116 A 4.1295 8.4483 122.6256 54.5991 19.0752 179.8120 117 A 4.1669 7.9934 117.6171 54.8481 19.1746 179.7133 118 V 3.4982 7.7436 110.4058 64.7174 31.5656 178.8871 119 R 3.9632 7.6228 116.4018 59.3138 30.0861 179.0515 120 I 4.0551 7.4396 118.7895 63.5597 36.9596 178.0795 121 A 4.2481 8.1120 122.0544 55.0326 18.7361 179.2577 122 H 4.1962 8.7811 115.2112 58.5004 28.8721 177.0437 123 E 4.2928 8.4382 120.1167 57.5787 29.8300 177.5186 124 L 4.2858 7.6114 117.0036 56.3814 41.9818 178.3890 125 M 4.1851 7.4927 118.7129 57.8143 32.4091 177.9847 126 D 4.3591 7.9592 118.6478 57.5096 40.7993 178.9333 127 A 3.8332 7.4684 119.0655 54.9826 18.4650 179.1151 128 A 4.0921 7.4120 117.5883 55.1815 18.3944 179.1470 129 E 4.1396 8.0782 117.2783 59.3429 30.3051 177.2282 130 G 3.3722 7.4909 107.9492 45.0154 0.0000 174.7490 131 K 4.4808 7.9446 114.9827 56.7789 33.9813 175.9558 132 G 4.0306 7.9194 110.1390 44.3361 0.0000 175.1744 133 G 3.5451 8.6048 106.6527 48.2089 0.0000 175.4461 134 A 4.2473 8.1832 121.5383 53.6091 19.0481 179.1885 135 V 3.8837 7.4722 115.2486 64.8718 31.8832 177.8513 136 K 3.9071 7.8642 119.0340 58.7540 31.7100 178.1407 137 K 3.8974 7.5903 117.4801 57.0112 32.1377 178.9338 138 K 3.5851 7.0235 120.8170 59.4127 32.2522 178.4704 139 E 3.9562 8.3069 119.1815 59.3922 29.1733 178.7777 140 D 4.2435 7.7980 117.6179 57.4764 41.3391 178.6714 141 V 3.6451 7.1212 118.3118 65.8978 31.2861 177.9336 142 E 4.0593 8.0514 117.8057 59.1207 29.4632 179.0435 143 R 4.0788 8.2938 118.6268 59.5911 30.3029 178.8956 144 M 4.1519 7.8307 118.0437 57.4915 31.9543 177.0897 145 A 4.3834 7.0527 119.4007 53.1255 19.3031 176.1574 146 E 4.0700 8.9423 122.0307 57.5048 27.8459 177.3889 147 A 3.9718 7.5852 118.8358 54.5901 18.7519 177.9178 148 N 4.8711 8.0117 111.4507 53.0517 39.3432 176.5953 149 R 3.9535 8.1284 120.3154 58.2818 30.4814 178.0527 150 A 3.6988 7.9426 119.7933 55.8268 18.1371 178.8211 151 Y 4.2375 7.0071 110.9755 58.1794 38.1016 176.9592 152 A 4.2676 7.7707 124.2652 54.1281 19.0572 179.2579 153 H 4.8671 7.9728 110.5180 55.9310 28.7010 175.2387 154 Y 5.1238 7.2603 116.4264 58.1246 38.2123 177.8890 155 R 4.1217 8.6076 119.8575 57.5104 30.6321 177.1459 156 W 4.2368 7.9696 120.3265 56.8570 30.2290 174.3140 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 2 A 8.26 4.31 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 3 R 8.57 3.90 0.00 1.86 1.96 0.00 3.23 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 4 R 8.31 4.06 0.00 1.84 1.88 0.00 3.24 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 5 R 7.39 4.39 0.00 1.76 1.85 0.00 3.24 0.00 0.00 3.14 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 6 R 8.44 3.91 0.00 1.75 1.91 0.00 3.36 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 7 A 7.81 3.52 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 8 E 8.39 4.33 0.00 1.96 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.22 0.00 9 V 8.22 3.60 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 0.74 0.00 0.00 0.91 0.00 0.00 10 R 8.45 3.98 0.00 1.80 1.82 0.00 3.27 0.00 0.00 3.14 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 11 Q 8.51 4.21 0.00 2.03 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.60 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 12 L 8.13 4.57 0.00 1.65 1.56 0.96 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 8.25 4.38 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.85 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 14 P 0.00 4.27 0.00 2.10 2.06 0.00 3.75 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 15 D 8.64 4.64 0.00 2.80 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 16 L 8.48 4.26 0.00 1.71 1.71 0.96 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 17 V 8.27 3.79 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 0.35 0.00 0.00 0.47 0.00 0.00 18 Y 8.80 4.40 0.00 3.20 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 8.63 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 0.00 0.00 0.00 0.00 20 D 7.77 4.96 0.00 2.72 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 8.31 3.82 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.95 0.00 0.00 22 L 9.34 4.13 0.00 1.76 1.91 0.95 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.73 3.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.79 0.00 0.00 24 T 7.47 3.72 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 1.31 0.00 0.00 25 A 7.53 4.02 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 26 F 7.83 4.15 0.00 3.49 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 27 I 7.17 3.42 1.77 0.00 0.00 -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 1.17 -0.20 0.84 0.00 0.00 28 N 7.71 4.26 0.00 2.65 2.82 0.00 0.00 7.13 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 29 K 7.24 4.05 0.00 1.57 1.73 0.00 1.64 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 1.66 1.56 7.81 30 I 6.93 3.93 1.82 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 0.95 0.32 0.83 0.00 0.00 31 M 7.64 3.99 0.00 2.10 1.95 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 2.64 2.51 0.00 32 R 8.38 4.37 0.00 1.74 1.78 0.00 3.26 0.00 0.00 3.21 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.59 0.00 33 D 9.68 4.46 0.00 2.77 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 34 G 8.08 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 35 K 7.50 4.57 0.00 1.78 1.73 0.00 1.70 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.37 7.81 36 K 8.04 3.80 0.00 1.81 1.85 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.54 1.57 7.81 37 N 8.11 4.35 0.00 2.79 2.88 0.00 0.00 6.80 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 7.58 4.18 0.00 1.58 1.69 0.94 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 39 A 7.70 4.28 1.37 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 40 A 8.18 4.01 1.57 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 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.18 4.19 0.00 2.11 2.05 0.00 3.16 0.00 0.00 3.21 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 42 I 7.69 4.15 1.91 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 1.55 0.65 0.95 0.00 0.00 43 F 7.72 4.43 0.00 3.02 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 Y 7.59 4.03 0.00 3.18 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 45 D 8.05 4.39 0.00 2.85 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 A 7.82 4.21 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 0.00 0.00 0.00 0.00 0.00 0.00 47 C 7.68 4.20 0.00 3.14 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 48 K 8.30 4.21 0.00 1.75 1.88 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.63 7.81 49 I 7.30 4.33 2.01 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 1.59 1.20 0.96 0.00 0.00 50 I 8.03 4.09 2.04 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.46 0.98 0.00 0.00 51 Q 7.95 4.19 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.09 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 52 E 8.13 4.08 0.00 1.95 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 53 K 7.80 4.10 0.00 1.90 1.88 0.00 1.69 0.00 0.00 1.64 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.56 1.63 7.81 54 T 7.48 4.66 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 55 G 8.64 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 Q 7.61 4.65 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.79 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 57 E 8.54 4.13 0.00 2.08 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 2.43 2.33 0.00 58 P 0.00 4.56 0.00 2.28 2.17 0.00 3.79 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.03 0.00 59 L 8.00 4.57 0.00 1.96 1.84 0.93 0.82 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 60 K 8.02 4.50 0.00 1.91 1.76 0.00 1.58 0.00 0.00 1.59 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.38 7.81 61 V 7.78 3.71 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.03 0.00 0.00 62 F 8.07 4.33 0.00 3.04 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 63 K 7.90 3.91 0.00 1.94 1.86 0.00 1.59 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.51 1.52 7.81 64 Q 7.99 3.98 0.00 2.31 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.34 2.47 0.00 65 A 7.36 4.15 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 66 V 6.99 3.48 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 0.85 0.00 0.00 0.26 0.00 0.00 67 E 7.62 3.94 0.00 2.20 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 68 N 7.78 4.67 0.00 2.78 2.85 0.00 0.00 6.76 9.03 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 69 V 7.47 4.35 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 1.07 0.00 0.00 70 K 7.66 4.06 0.00 1.96 2.03 0.00 1.73 0.00 0.00 1.89 0.00 0.00 2.94 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.44 1.53 7.81 71 P 0.00 4.51 0.00 2.34 2.44 0.00 3.75 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 72 R 8.69 4.12 0.00 1.80 2.03 0.00 3.34 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.73 0.00 73 M 7.79 5.05 0.00 1.94 1.94 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.56 0.00 74 E 8.72 4.86 0.00 2.10 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 2.33 2.40 0.00 75 V 8.44 4.63 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 0.80 0.00 0.00 0.97 0.00 0.00 76 R 8.58 4.61 0.00 1.86 1.89 0.00 3.24 0.00 0.00 3.28 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 77 S 8.58 4.18 0.00 3.79 3.73 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 78 R 7.67 3.96 0.00 1.23 1.49 0.00 2.84 0.00 0.00 2.51 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.30 0.00 79 R 8.28 4.19 0.00 1.65 1.68 0.00 3.32 0.00 0.00 3.01 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.44 0.00 80 V 8.72 3.86 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 0.57 0.00 0.00 0.34 0.00 0.00 81 G 7.83 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 G 8.79 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 6.49 4.09 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 84 N 8.33 4.83 0.00 2.59 2.72 0.00 0.00 6.83 7.46 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 85 Y 8.03 4.15 0.00 2.76 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.85 4.48 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.98 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 87 V 8.27 3.94 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 1.10 0.00 0.00 1.01 0.00 0.00 88 P 0.00 5.28 0.00 2.17 2.09 0.00 4.09 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 89 M 8.15 4.60 0.00 2.22 2.29 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.60 0.00 90 E 8.93 4.13 0.00 2.01 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 91 V 8.02 4.22 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.06 0.00 0.00 92 S 8.47 4.25 0.00 3.91 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 93 P 0.00 4.23 0.00 2.28 2.31 0.00 3.75 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 2.07 2.07 0.00 94 R 7.99 3.88 0.00 1.85 2.00 0.00 3.09 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 95 R 7.81 3.92 0.00 1.84 2.03 0.00 3.19 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 96 Q 8.05 3.88 0.00 2.26 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.58 0.00 0.00 0.00 0.00 0.00 2.51 2.69 0.00 97 Q 8.08 3.87 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 98 S 7.49 4.07 0.00 4.03 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 7.63 3.31 0.00 1.37 0.25 0.76 0.50 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 0.00 100 A 7.89 3.97 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 0.00 101 L 8.13 4.07 0.00 1.73 1.91 0.99 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 102 R 7.53 3.91 0.00 1.91 1.78 0.00 3.02 0.00 0.00 3.14 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 103 W 8.38 4.76 0.00 3.45 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 0.00 104 L 8.47 4.10 0.00 2.20 2.03 1.00 0.80 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 0.00 105 V 8.24 3.65 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 0.95 0.00 0.00 0.63 0.00 0.00 106 Q 8.45 4.03 0.00 2.36 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.77 0.00 0.00 0.00 0.00 0.00 2.46 2.63 0.00 107 A 8.70 4.15 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.26 4.07 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 N 7.80 4.43 0.00 2.69 2.91 0.00 0.00 7.16 7.55 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 0.00 110 Q 7.50 4.31 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.93 0.00 0.00 0.00 0.00 0.00 2.38 2.66 0.00 111 R 7.35 4.17 0.00 2.09 1.89 0.00 3.32 0.00 0.00 3.32 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.78 0.00 112 P 0.00 4.71 0.00 2.18 2.14 0.00 3.79 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.99 0.00 113 E 7.84 4.21 0.00 1.97 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.23 0.00 114 R 8.54 4.15 0.00 1.80 1.99 0.00 3.35 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 115 R 7.60 4.63 0.00 1.85 1.82 0.00 3.13 0.00 0.00 3.35 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 116 A 8.45 4.13 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 A 7.99 4.17 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 0.00 118 V 7.74 3.50 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 0.79 0.00 0.00 0.90 0.00 0.00 119 R 7.62 3.96 0.00 1.95 2.14 0.00 3.31 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.92 0.00 120 I 7.44 4.06 2.00 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 1.81 1.24 1.32 0.00 0.00 121 A 8.11 4.25 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.78 4.20 0.00 3.21 3.37 0.00 5.63 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.44 4.29 0.00 2.21 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 2.54 2.48 0.00 124 L 7.61 4.29 0.00 2.02 1.71 0.95 0.82 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 0.00 125 M 7.49 4.19 0.00 2.16 2.23 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.57 0.00 126 D 7.96 4.36 0.00 2.77 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 0.00 127 A 7.47 3.83 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 0.00 128 A 7.41 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 129 E 8.08 4.14 0.00 2.04 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 130 G 7.49 3.37 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 0.00 131 K 7.94 4.48 0.00 1.81 1.82 0.00 1.56 0.00 0.00 1.70 0.00 0.00 3.33 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.43 7.81 132 G 7.92 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 0.00 0.00 0.00 133 G 8.60 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 0.00 134 A 8.18 4.25 1.47 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 0.00 0.00 135 V 7.47 3.88 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 1.08 0.00 0.00 0.94 0.00 0.00 136 K 7.86 3.91 0.00 1.93 1.69 0.00 1.72 0.00 0.00 1.77 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.43 7.81 137 K 7.59 3.90 0.00 1.23 0.74 0.00 1.54 0.00 0.00 1.25 0.00 0.00 2.13 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.16 1.20 7.81 138 K 7.02 3.59 0.00 2.01 1.95 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.26 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.60 1.79 7.81 139 E 8.31 3.96 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.54 0.00 140 D 7.80 4.24 0.00 2.91 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 V 7.12 3.65 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 1.16 0.00 0.00 1.04 0.00 0.00 142 E 8.05 4.06 0.00 2.13 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 2.38 2.63 0.00 143 R 8.29 4.08 0.00 2.06 1.97 0.00 3.11 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.83 0.00 144 M 7.83 4.15 0.00 2.00 2.28 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.92 0.00 145 A 7.05 4.38 1.37 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 0.00 146 E 8.94 4.07 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.24 0.00 147 A 7.59 3.97 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 0.00 148 N 8.01 4.87 0.00 3.03 3.10 0.00 0.00 6.46 6.94 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 0.00 149 R 8.13 3.95 0.00 1.79 1.98 0.00 3.36 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 150 A 7.94 3.70 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 7.01 4.24 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 0.00 152 A 7.77 4.27 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 H 7.97 4.87 0.00 3.28 3.32 0.00 5.49 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 7.26 5.12 0.00 3.20 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 0.00 155 R 8.61 4.12 0.00 1.93 2.14 0.00 3.37 0.00 0.00 3.34 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.97 0.00 156 W 7.97 4.24 0.00 3.57 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