NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4463 8.3049 120.3496 54.9717 32.8548 175.8505 2 N 4.7649 7.2363 113.2305 53.6660 43.9903 174.4473 3 R 3.8369 8.2733 118.9678 56.7587 33.0284 181.3867 4 G 3.7526 7.9315 104.9224 46.5430 0.0000 175.4160 5 A 4.0324 8.6266 121.1166 54.7660 19.1810 179.4104 6 L 4.1657 8.4635 115.6797 56.4101 41.3500 178.9793 7 I 4.0942 7.3473 120.2434 63.6923 37.6444 177.6688 8 K 4.8994 7.6416 117.8359 57.7474 32.0768 177.9382 9 L 4.4866 7.2709 117.2758 55.1869 42.2706 178.3268 10 V 3.7038 8.9513 120.2723 65.7705 31.5998 177.5088 11 E 4.0751 8.2372 117.9365 58.9331 29.0200 178.4442 12 S 4.4521 7.7211 116.2977 58.7411 62.5115 174.4564 13 R 4.0132 8.2294 116.3436 57.3352 30.0800 177.3032 14 Y 4.4389 7.4847 114.5434 57.0605 39.9668 176.7366 15 V 3.3154 6.7214 118.4800 62.3756 31.5146 176.0084 16 R 4.6503 8.5169 122.0129 55.2900 32.0086 175.9494 17 T 4.5966 8.1707 111.5893 62.0183 68.8148 173.6636 18 D 4.7149 8.1200 117.3516 53.1732 39.8822 175.8712 19 L 4.3474 7.5130 120.4859 53.2247 42.5520 174.9940 20 P 4.3265 0.0000 0.0000 62.6009 31.9399 175.2213 21 E 4.1432 8.4761 121.5368 55.0433 30.1253 175.4916 22 F 5.0858 7.5832 119.9848 55.6477 41.2613 173.2627 23 R 4.8204 8.7525 115.9823 55.2126 32.4099 174.7514 24 P 4.6605 0.0000 0.0000 63.9555 28.7537 174.2469 25 G 4.2441 8.8095 105.0672 43.2473 0.0000 173.1562 26 D 5.3823 8.5907 119.2599 53.8016 38.5534 177.1409 27 T 4.3783 7.8139 128.1105 59.7185 69.5832 176.6019 28 V 4.7995 8.9913 124.1123 64.5581 30.3651 168.9245 29 R 4.4892 8.4491 125.1537 55.3588 32.6660 174.5084 30 V 4.5061 7.6833 112.5172 61.6792 32.9767 175.3973 31 S 5.0130 9.0175 116.9329 58.6984 66.8569 176.6946 32 Y 3.7703 9.5661 112.5965 56.9275 40.5014 177.3022 33 K 3.6047 9.1120 111.1579 56.5983 28.4084 174.1748 34 V 3.8961 7.4642 119.4910 61.9109 32.4601 175.6358 35 K 4.3639 8.5633 125.0775 57.0763 35.3201 174.4256 36 E 3.4437 8.7711 123.4624 58.7692 25.7153 174.5195 37 G 3.8896 7.8821 110.7418 45.3766 0.0000 172.2446 38 N 4.3305 7.4594 111.9248 52.1401 39.0284 175.9781 39 R 4.3271 8.6974 126.0726 56.5204 27.5798 174.8667 40 T 4.5740 7.1056 109.1565 59.6955 72.4152 170.6730 41 R 3.6618 8.6079 127.0254 55.9761 30.6799 174.7519 42 I 5.2913 8.2464 117.7470 58.5695 39.5716 174.8638 43 Q 4.5042 8.8965 127.4941 55.4796 31.0577 174.7842 44 D 5.0610 7.9935 123.9506 55.0287 44.0648 175.7315 45 F 4.4266 8.0249 110.3390 58.8938 41.1810 174.3500 46 E 4.4712 8.1490 128.4226 55.5961 27.6540 174.3729 47 G 4.3539 7.5594 107.9092 44.4105 0.0000 170.7767 48 I 4.7486 8.1073 119.5574 59.3494 40.4251 175.7608 49 V 4.4725 8.3099 125.9045 60.9829 32.2349 176.6418 50 I 4.1269 8.5861 127.6810 63.0730 38.5958 176.0825 51 R 4.8442 7.5947 114.1000 54.9617 33.2370 174.9260 52 I 4.8368 8.1909 120.2734 59.6677 39.5490 175.3435 53 R 4.2955 9.4272 127.1857 55.9930 31.5749 176.6732 54 R 4.6199 8.4276 119.9927 54.8603 33.4540 175.8688 55 N 5.0201 8.4008 123.1476 53.1202 39.6849 174.6777 56 G 3.7589 7.6424 117.0905 46.3418 0.0000 173.6720 57 F 4.2895 9.0306 123.9320 61.2771 39.6610 175.8336 58 N 4.4895 7.7121 118.3059 51.6919 36.4248 174.9247 59 T 4.5920 7.5675 108.1395 61.9020 70.7757 176.1421 60 T 5.2421 8.4936 113.3797 60.0513 72.5721 172.5854 61 F 5.7124 9.7468 117.6639 55.3936 41.9853 173.7373 62 T 4.7614 8.7197 108.6009 59.9406 72.1502 172.9335 63 V 4.9371 8.6530 123.5054 61.2714 35.3938 173.8951 64 R 5.1452 9.4627 128.2544 54.5557 32.1117 174.4336 65 K 4.7188 9.4812 126.9585 54.8307 36.3654 175.4227 66 V 4.6927 8.1519 117.1969 58.4252 31.6912 173.4548 67 S 4.0056 8.0901 116.5522 57.1786 62.5327 169.2304 68 Y 3.4071 7.3317 134.5416 59.5002 37.7787 172.9204 69 G 3.4734 8.5538 110.7225 47.9607 0.0000 175.5323 70 V 3.6808 8.3296 125.8867 62.3252 32.1363 174.8599 71 G 4.2984 8.3762 113.1745 45.0802 0.0000 172.9730 72 V 4.7862 10.1327 121.8417 61.0189 35.6645 174.0828 73 E 5.3081 8.7020 123.5719 54.9320 33.4726 174.7720 74 R 4.2382 8.8770 123.2772 54.1166 33.0523 174.8588 75 I 4.4074 7.6210 123.4433 59.3994 39.3102 174.9188 76 F 5.1953 8.5380 125.7470 55.2225 41.7518 174.9367 77 P 4.4045 0.0000 0.0000 62.9977 31.6652 177.3363 78 L 3.9290 8.9968 118.3237 55.5103 40.3276 173.3157 79 H 4.7504 7.9466 112.3214 56.0634 34.6897 171.1300 80 S 4.6021 9.4733 118.9178 56.4782 58.7125 169.4845 81 P 4.1787 0.0000 0.0000 64.0311 31.4036 175.7279 82 L 4.6502 6.9757 119.8991 53.6791 39.2358 178.2603 83 I 3.9900 7.8073 117.9311 62.3675 37.8099 175.7347 84 Q 3.7948 7.7263 117.2788 54.4956 30.8014 176.8553 85 K 4.6928 8.0916 117.7759 55.0891 33.3633 176.6501 86 I 3.6809 7.9636 117.6895 61.7200 38.4740 173.7155 87 D 5.0832 8.3132 125.4944 51.1161 41.7169 174.7781 88 I 4.2157 8.3092 123.6577 61.6872 38.2528 179.2108 89 V 4.0567 8.7333 130.6122 62.3825 31.7643 174.1278 90 Q 4.0710 9.1441 129.3444 58.9314 30.9511 180.5887 91 R 3.3716 9.3588 111.4348 55.7175 30.5964 177.0507 92 G 3.7136 9.1953 119.3541 43.5989 0.0000 173.5105 93 R 3.6104 8.3579 115.9792 56.2858 28.7671 176.1795 94 A 4.3698 7.9785 121.0557 51.9280 19.2991 178.1682 95 R 4.4941 8.5631 121.6653 55.8810 30.3274 176.0231 96 R 4.5798 7.4173 116.3924 54.5688 32.7389 173.3302 97 A 4.1249 7.8852 124.4590 53.7676 18.9356 177.6844 98 K 4.1881 7.9362 114.7220 55.0557 34.1143 178.0714 99 L 5.0484 8.2097 124.0807 54.1328 40.0933 176.8237 100 Y 4.4165 7.6520 119.2492 60.1038 38.3282 176.9838 101 F 4.5709 8.7035 116.4316 59.8336 37.5095 176.5574 102 I 3.3675 6.0649 109.8784 61.9792 37.4169 177.9777 103 R 3.9915 8.0260 120.8912 59.6594 30.1873 177.7587 104 N 4.5284 8.0415 114.7173 55.5495 38.8771 175.8157 105 L 4.6533 7.2834 117.5027 52.5334 42.8603 175.3085 106 S 4.8813 9.2884 116.4257 55.9455 65.6582 174.2592 107 D 5.1849 7.7766 121.9570 52.6092 37.2172 180.2403 108 R 4.2687 8.6021 116.0860 58.6979 29.2955 177.6726 109 E 4.0446 8.4502 119.0096 59.7150 29.4205 178.6741 110 I 3.6691 7.1965 118.6367 64.9538 37.0436 177.7021 111 R 4.2559 7.6534 113.4176 57.5158 29.5418 177.6199 112 R 4.3959 8.4904 117.0908 57.1103 30.3731 177.0276 113 K 4.5690 7.5810 116.4086 56.0676 32.6921 176.5995 114 L 4.8659 7.4009 117.7248 53.5239 42.4638 176.6494 115 R 4.0415 7.9324 116.4896 55.8419 31.1015 177.2363 116 A 4.0390 8.4247 122.9089 52.8786 19.1327 177.7606 117 D 4.7529 8.2670 121.5989 52.2908 40.0379 176.8979 118 R 4.1439 8.1738 121.1916 56.9738 30.0497 177.5517 119 K 4.0283 8.0894 120.5984 59.3260 32.3652 178.2447 120 R 4.4676 7.9408 114.2360 57.0028 30.5028 177.2711 121 I 4.1659 7.3919 118.9755 63.1963 38.9318 176.9194 122 D 4.5568 7.7231 119.0887 57.0456 40.3827 177.8062 123 Q 4.4746 7.6341 115.3379 56.7812 28.7462 176.4544 124 D 4.7165 8.3591 122.1978 56.5652 41.9102 178.2676 125 R 4.1786 7.9484 114.5740 57.3774 30.5031 177.2886 126 A 4.5827 7.7362 119.3310 52.9199 20.1325 177.3074 127 A 4.2330 7.4535 117.8968 52.7690 19.5182 178.0768 128 E 4.0283 8.1288 120.8576 58.7120 30.7726 177.9793 129 R 3.3355 6.7621 113.3086 57.4861 27.2083 174.2210 130 A 4.5020 8.4286 130.1205 49.8254 18.5919 175.7855 131 A 4.3813 7.6139 123.1120 50.2537 18.0539 178.6976 132 K 4.4272 8.2932 120.2723 57.5110 31.5956 179.1313 133 E 3.9295 8.4331 121.3464 57.5944 29.5618 175.9974 134 E 3.6466 7.4015 118.7502 59.3083 29.9838 176.2950 135 A 3.7339 10.2414 129.6991 52.0262 14.4069 176.9658 136 Q 4.6434 7.3376 116.8532 55.6244 34.5539 174.2040 137 K 4.1914 7.8197 121.3102 56.9336 33.2273 175.7953 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 8.30 4.45 0.00 1.98 2.12 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.63 0.00 2 N 7.24 4.76 0.00 2.81 2.60 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 3 R 8.27 3.84 0.00 1.84 1.96 0.00 3.43 0.00 0.00 3.34 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.57 0.00 4 G 7.93 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 5 A 8.63 4.03 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 6 L 8.46 4.17 0.00 1.71 1.74 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 7 I 7.35 4.09 2.12 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.89 0.97 0.00 0.00 8 K 7.64 4.90 0.00 1.93 1.92 0.00 1.68 0.00 0.00 1.58 0.00 0.00 3.08 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.38 7.81 9 L 7.27 4.49 0.00 1.64 1.70 0.93 0.91 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 10 V 8.95 3.70 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 1.01 0.00 0.00 0.92 0.00 0.00 11 E 8.24 4.08 0.00 2.18 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 2.45 2.52 0.00 12 S 7.72 4.45 0.00 3.86 3.42 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 13 R 8.23 4.01 0.00 1.47 1.69 0.00 3.19 0.00 0.00 3.11 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.63 0.00 14 Y 7.48 4.44 0.00 2.56 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 15 V 6.72 3.32 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 0.62 0.00 0.00 0.94 0.00 0.00 16 R 8.52 4.65 0.00 1.93 2.14 0.00 3.35 0.00 0.00 3.21 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.70 0.00 17 T 8.17 4.60 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 18 D 8.12 4.71 0.00 2.82 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 19 L 7.51 4.35 0.00 1.55 1.55 0.84 1.05 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 20 P 0.00 4.33 0.00 2.17 2.05 0.00 3.72 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.11 0.00 21 E 8.48 4.14 0.00 1.83 1.82 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 2.21 2.25 0.00 22 F 7.58 5.09 0.00 3.03 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 23 R 8.75 4.82 0.00 2.02 2.06 0.00 3.01 0.00 0.00 3.36 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 24 P 0.00 4.66 0.00 2.14 2.15 0.00 3.74 0.00 0.00 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 25 G 8.81 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 26 D 8.59 5.38 0.00 2.69 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 27 T 7.81 4.38 3.60 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 1.13 0.00 0.00 28 V 8.99 4.80 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.06 0.00 0.00 29 R 8.45 4.49 0.00 1.92 1.97 0.00 3.39 0.00 0.00 3.27 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.53 0.00 30 V 7.68 4.51 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 0.92 0.00 0.00 1.00 0.00 0.00 31 S 9.02 5.01 0.00 4.23 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 9.57 3.77 0.00 3.07 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 33 K 9.11 3.60 0.00 2.03 2.08 0.00 1.66 0.00 0.00 1.42 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.13 1.29 7.81 34 V 7.46 3.90 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 0.84 0.00 0.00 1.04 0.00 0.00 35 K 8.56 4.36 0.00 1.85 1.71 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.47 1.45 7.81 36 E 8.77 3.44 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.29 0.00 37 G 7.88 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 N 7.46 4.33 0.00 2.81 2.82 0.00 0.00 6.34 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 39 R 8.70 4.33 0.00 1.84 2.02 0.00 3.22 0.00 0.00 3.31 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 40 T 7.11 4.57 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 1.23 0.00 0.00 41 R 8.61 3.66 0.00 1.96 1.96 0.00 3.37 0.00 0.00 3.29 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 42 I 8.25 5.29 1.93 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 1.24 1.99 0.97 0.00 0.00 43 Q 8.90 4.50 0.00 2.24 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.53 0.00 0.00 0.00 0.00 0.00 2.40 2.50 0.00 44 D 7.99 5.06 0.00 2.61 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 45 F 8.02 4.43 0.00 3.20 3.04 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 46 E 8.15 4.47 0.00 1.88 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 0.00 2.22 2.30 0.00 47 G 7.56 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 I 8.11 4.75 1.84 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.84 0.88 0.00 0.00 49 V 8.31 4.47 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 0.83 0.00 0.00 1.25 0.00 0.00 50 I 8.59 4.13 1.80 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 1.24 0.40 0.73 0.00 0.00 51 R 7.59 4.84 0.00 1.75 1.78 0.00 2.84 0.00 0.00 3.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.66 0.00 52 I 8.19 4.84 1.94 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 1.65 0.83 0.96 0.00 0.00 53 R 9.43 4.30 0.00 1.92 1.88 0.00 3.10 0.00 0.00 3.20 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 54 R 8.43 4.62 0.00 1.75 1.82 0.00 3.15 0.00 0.00 3.13 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 55 N 8.40 5.02 0.00 2.61 2.84 0.00 0.00 7.31 7.98 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 56 G 7.64 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 57 F 9.03 4.29 0.00 2.88 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 N 7.71 4.49 0.00 2.67 2.32 0.00 0.00 6.01 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 T 7.57 4.59 4.50 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 1.27 0.00 0.00 60 T 8.49 5.24 4.45 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 1.26 0.00 0.00 61 F 9.75 5.71 0.00 3.44 3.27 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 62 T 8.72 4.76 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 1.17 0.00 0.00 63 V 8.65 4.94 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.95 0.00 0.00 64 R 9.46 5.15 0.00 1.86 1.73 0.00 3.39 0.00 0.00 3.07 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.69 0.00 65 K 9.48 4.72 0.00 1.51 1.18 0.00 1.65 0.00 0.00 1.46 0.00 0.00 2.82 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.96 1.20 7.81 66 V 8.15 4.69 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 1.12 0.00 0.00 0.85 0.00 0.00 67 S 8.09 4.01 0.00 3.65 3.74 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 68 Y 7.33 3.41 0.00 3.27 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 69 G 8.55 3.47 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 0.00 70 V 8.33 3.68 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 0.94 0.00 0.00 0.96 0.00 0.00 71 G 8.38 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 V 10.13 4.79 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 0.92 0.00 0.00 0.95 0.00 0.00 73 E 8.70 5.31 0.00 1.81 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 0.00 2.22 2.34 0.00 74 R 8.88 4.24 0.00 0.67 0.66 0.00 2.36 0.00 0.00 2.72 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.50 0.00 75 I 7.62 4.41 1.67 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.30 0.84 0.00 0.00 76 F 8.54 5.20 0.00 2.32 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 77 P 0.00 4.40 0.00 2.22 2.06 0.00 3.88 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 2.15 2.10 0.00 78 L 9.00 3.93 0.00 2.03 1.65 0.71 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 79 H 7.95 4.75 0.00 3.30 3.33 0.00 5.87 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 80 S 9.47 4.60 0.00 3.95 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 81 P 0.00 4.18 0.00 0.49 1.43 0.00 3.25 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.82 0.00 82 L 6.98 4.65 0.00 1.59 1.46 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.81 3.99 1.88 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 1.37 0.61 0.99 0.00 0.00 84 Q 7.73 3.79 0.00 2.21 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 7.57 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 85 K 8.09 4.69 0.00 1.77 1.86 0.00 1.87 0.00 0.00 1.70 0.00 0.00 3.30 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.36 1.58 7.81 86 I 7.96 3.68 1.89 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 1.49 0.76 0.93 0.00 0.00 87 D 8.31 5.08 0.00 2.68 2.64 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 88 I 8.31 4.22 1.86 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 1.32 1.03 0.90 0.00 0.00 89 V 8.73 4.06 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 0.78 0.00 0.00 0.93 0.00 0.00 90 Q 9.14 4.07 0.00 2.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 5.61 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 91 R 9.36 3.37 0.00 1.93 1.72 0.00 3.29 0.00 0.00 3.23 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 92 G 9.20 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 R 8.36 3.61 0.00 2.07 2.05 0.00 3.38 0.00 0.00 3.32 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 94 A 7.98 4.37 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 R 8.56 4.49 0.00 1.77 1.93 0.00 3.34 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.53 0.00 96 R 7.42 4.58 0.00 1.65 1.76 0.00 3.18 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.62 0.00 97 A 7.89 4.12 1.24 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 98 K 7.94 4.19 0.00 1.73 1.27 0.00 1.57 0.00 0.00 1.78 0.00 0.00 3.20 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.53 1.30 7.81 99 L 8.21 5.05 0.00 2.18 2.07 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 100 Y 7.65 4.42 0.00 3.06 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 0.00 101 F 8.70 4.57 0.00 3.30 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 I 6.06 3.37 1.48 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.40 -0.22 0.00 0.00 103 R 8.03 3.99 0.00 1.83 2.02 0.00 3.26 0.00 0.00 3.51 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.93 0.00 104 N 8.04 4.53 0.00 2.75 2.91 0.00 0.00 6.65 7.85 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 0.00 105 L 7.28 4.65 0.00 1.54 1.59 0.96 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 106 S 9.29 4.88 0.00 3.89 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 D 7.78 5.18 0.00 2.93 2.34 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 0.00 108 R 8.60 4.27 0.00 2.06 2.22 0.00 2.98 0.00 0.00 3.33 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 109 E 8.45 4.04 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.55 0.00 110 I 7.20 3.67 2.02 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.50 0.86 0.00 0.00 111 R 7.65 4.26 0.00 2.01 2.04 0.00 3.04 0.00 0.00 3.26 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 112 R 8.49 4.40 0.00 1.96 2.10 0.00 3.06 0.00 0.00 3.24 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.68 0.00 113 K 7.58 4.57 0.00 2.00 2.05 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.64 7.81 114 L 7.40 4.87 0.00 1.79 1.59 0.89 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 115 R 7.93 4.04 0.00 1.81 1.89 0.00 3.39 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 116 A 8.42 4.04 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 D 8.27 4.75 0.00 2.82 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.17 4.14 0.00 1.90 2.11 0.00 3.17 0.00 0.00 3.27 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 119 K 8.09 4.03 0.00 1.87 1.91 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.47 7.81 120 R 7.94 4.47 0.00 1.84 1.97 0.00 3.26 0.00 0.00 3.17 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.82 0.00 121 I 7.39 4.17 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 1.65 1.00 0.92 0.00 0.00 122 D 7.72 4.56 0.00 2.83 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 0.00 123 Q 7.63 4.47 0.00 2.16 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.76 0.00 0.00 0.00 0.00 0.00 2.47 2.40 0.00 124 D 8.36 4.72 0.00 2.85 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 R 7.95 4.18 0.00 1.78 1.98 0.00 3.34 0.00 0.00 3.23 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 126 A 7.74 4.58 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 0.00 127 A 7.45 4.23 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 E 8.13 4.03 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.41 0.00 129 R 6.76 3.34 0.00 1.84 2.24 0.00 3.23 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.70 0.00 130 A 8.43 4.50 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 A 7.61 4.38 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 K 8.29 4.43 0.00 1.83 1.82 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.42 7.81 133 E 8.43 3.93 0.00 1.87 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 2.32 2.25 0.00 134 E 7.40 3.65 0.00 1.94 1.90 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 2.33 2.33 0.00 135 A 10.24 3.73 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 0.00 136 Q 7.34 4.64 0.00 1.99 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.86 6.80 0.00 0.00 0.00 0.00 0.00 2.24 2.44 0.00 137 K 7.82 4.19 0.00 1.71 1.61 0.00 1.83 0.00 0.00 1.74 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.33 1.41 7.81