NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.4064 8.1233 123.5987 52.3080 21.0243 179.0748 3 D 4.1483 8.0101 115.6336 56.8099 40.6545 177.8566 4 F 3.9505 8.9799 119.3617 60.6571 39.4427 176.9229 5 D 4.4009 8.2852 117.8223 57.2142 40.4111 178.5038 6 A 4.0107 8.0000 120.6796 55.1642 18.6072 179.5925 7 V 3.7307 7.7368 116.6116 66.1928 31.7630 178.3445 8 L 4.1011 8.1795 118.5834 57.4197 41.2095 179.1218 9 K 4.3653 8.0755 117.0213 58.0691 31.9525 177.1702 10 C 4.8808 7.9687 115.5644 58.8506 29.3379 175.1677 11 W 4.5668 8.3616 130.7670 58.7909 30.2230 178.1396 12 G 3.7685 8.2301 105.7836 48.1029 0.0000 173.7952 13 P 4.1719 0.0000 0.0000 64.4311 31.5679 178.8459 14 V 3.3026 7.0104 117.1053 65.8180 31.3119 177.6317 15 E 2.5400 7.1393 117.3327 58.1442 29.4273 178.2399 16 A 4.0605 7.4507 120.3469 54.2151 19.8414 177.6353 17 D 4.6487 7.5090 115.9293 52.4305 42.7975 175.0346 18 Y 4.2782 7.8875 121.2995 60.8875 38.2042 178.1004 19 T 3.8713 7.8987 116.2670 66.9728 68.7018 176.6872 20 T 3.8218 8.2775 117.5005 66.8307 68.4598 177.0506 21 I 3.8006 8.0179 122.0256 64.0694 37.0771 178.7422 22 G 3.6703 8.4573 107.2932 47.7649 0.0000 175.9797 23 G 3.6242 8.2026 109.8949 46.7699 0.0000 175.6928 24 L 3.9070 7.9561 121.3846 57.4963 41.5697 179.7830 25 V 3.4883 7.8219 118.0674 66.1313 31.4407 178.1554 26 L 3.3914 7.7276 118.6063 57.6297 40.9078 179.5549 27 T 3.7070 7.8924 116.1096 66.6335 68.3142 176.6242 28 R 3.8458 7.9770 120.5613 59.0847 30.0678 178.1008 29 L 3.9670 7.9426 120.4805 58.5030 41.9497 179.1887 30 F 4.6177 8.0397 117.7098 60.2527 38.5383 177.8027 31 K 4.0761 8.0910 118.8470 59.6066 32.1865 178.4359 32 E 4.2548 8.3440 117.3040 57.7513 31.0657 176.8576 33 H 5.0310 8.2837 115.8951 52.4372 29.6903 172.1190 34 P 4.6647 0.0000 0.0000 65.0004 31.5375 178.4153 35 E 4.0898 8.2976 117.3040 59.2910 29.4545 179.0104 36 T 4.1304 8.2763 111.4188 64.7011 68.8655 176.3901 37 Q 3.2828 8.0557 122.1010 58.6733 28.7275 178.2417 38 K 4.1260 7.5241 116.9567 58.5276 32.1499 178.3479 39 L 4.4142 7.7112 117.6320 54.6426 42.5174 177.0686 40 F 4.4704 7.8595 119.4371 54.5385 38.5999 174.1468 41 P 4.2130 0.0000 0.0000 65.1564 31.4798 178.5130 42 K 4.0560 7.8381 116.4636 58.3765 32.2929 177.4922 43 F 4.9983 8.0752 116.0839 57.2973 40.7107 175.6154 44 A 4.0862 7.8894 123.7762 53.6602 18.4493 177.7315 45 G 3.9623 8.8199 111.0322 45.1050 0.0000 173.7601 46 I 3.7681 7.3197 121.1270 60.6002 37.5626 175.8606 47 A 4.0038 8.6854 128.0964 52.6753 18.9587 177.7853 48 Q 3.9609 8.9485 122.4770 59.3780 28.8845 178.8344 49 A 4.1258 8.0182 119.8099 54.2741 18.5057 177.9825 50 D 4.6879 7.9171 115.7230 54.5469 41.5386 178.1234 51 I 3.8853 7.7242 122.1861 64.0901 37.1032 177.9045 52 A 3.9241 7.4740 120.6279 54.2574 18.3159 178.1480 53 G 3.8015 7.8755 101.7103 45.6575 0.0000 173.3313 54 N 4.5479 8.1240 120.0015 52.3461 39.6091 175.3442 55 A 3.9895 8.5745 130.5100 55.1724 18.6204 178.9414 56 A 4.0028 8.0378 118.9654 55.1148 18.4679 179.8276 57 V 2.8374 8.1431 117.0999 66.1313 31.1455 178.4869 58 S 4.0937 8.0070 114.6124 61.4783 62.6129 176.5597 59 A 4.0328 8.3455 123.8356 55.4530 18.1509 179.2188 60 H 4.3288 8.6051 116.9665 59.2963 29.9316 177.6572 61 G 3.5955 8.4608 107.7167 47.7272 0.0000 175.4474 62 A 4.0555 8.2807 123.1940 55.2207 18.3702 179.7634 63 T 3.7322 7.7367 114.2253 66.6983 68.5007 176.8784 64 V 3.5682 7.6901 119.8978 66.2182 31.5578 178.1805 65 L 4.1810 8.0290 118.7007 57.5759 41.3253 179.6324 66 K 3.5072 7.8420 118.9621 59.0685 31.9312 179.2450 67 K 3.9130 7.9817 119.9178 59.4327 32.1185 178.6036 68 L 4.0674 8.2905 120.8806 58.1233 42.0143 179.1488 69 G 3.4367 8.7653 106.1681 47.6650 0.0000 175.1225 70 E 3.9920 8.3013 120.9593 59.5726 29.8676 178.2237 71 L 3.9904 8.1323 118.8551 57.9505 41.3793 179.3107 72 L 4.0981 8.0258 119.7470 57.9233 41.8957 179.3437 73 K 4.3881 7.5248 115.2076 56.4039 32.2517 178.5507 74 A 4.1125 7.5616 123.6031 54.3485 19.6880 179.7162 75 K 4.1835 7.6526 117.5092 54.9212 30.4693 177.2517 76 G 4.0620 7.2590 114.3500 44.2892 0.0000 171.4134 77 S 4.2689 7.6606 112.5369 58.3953 63.7441 174.5005 78 H 4.5045 7.9836 122.7022 55.5226 27.9098 177.4836 79 A 4.2448 8.3043 123.9155 54.4938 19.7195 180.6479 80 A 4.2109 8.3466 117.2990 54.1324 17.0637 179.1455 81 I 3.8700 8.7875 123.6449 62.8545 38.0175 176.8188 82 L 4.2570 7.7555 118.2810 56.0247 41.5507 179.3163 83 K 3.9793 7.6472 119.6871 59.0654 32.0234 177.4332 84 P 4.2479 0.0000 0.0000 65.2925 31.1856 178.4785 85 L 4.0014 7.4815 115.8740 58.0199 41.9542 178.7976 86 A 4.1709 8.2257 120.8866 55.3193 18.3716 179.2608 87 N 4.2025 8.3648 115.2765 56.5705 38.5904 177.8673 88 S 4.0420 8.2524 115.6260 61.8179 63.0869 176.2309 89 H 4.1685 8.6639 119.7761 58.1645 28.4029 177.7645 90 A 3.0743 8.0782 123.3057 54.5977 17.9124 179.2677 91 T 4.0908 7.4114 105.8541 62.5499 69.6939 176.4422 92 K 4.1942 7.5301 119.2324 58.6376 33.3335 177.8232 93 H 4.3808 7.8983 114.1151 55.3227 29.8516 175.3044 94 K 3.7405 7.6646 117.5668 56.5946 28.7417 176.4044 95 I 4.2216 7.8767 119.3700 58.9047 38.2342 175.0658 96 P 4.5794 0.0000 0.0000 62.4055 32.1463 177.5529 97 I 3.8396 8.6833 122.5320 64.9223 37.0460 178.1114 98 N 4.3402 8.2698 117.0631 56.7912 38.6797 176.4111 99 N 4.3555 8.2273 117.8140 56.0508 38.4896 177.2860 100 F 4.2225 8.2386 119.5017 60.2700 38.8408 177.7784 101 K 4.0580 8.0239 117.9353 59.2789 31.8153 179.3867 102 L 3.8799 7.7042 118.7952 57.8994 41.5992 179.2983 103 I 3.7624 7.7942 118.5227 64.0793 37.8802 178.1188 104 S 4.1643 8.2360 116.3055 61.4077 62.4815 176.2525 105 E 3.9727 8.4327 121.5757 59.5160 29.1558 179.6776 106 V 3.5801 7.7691 118.0142 65.9332 31.5582 177.7841 107 L 3.9478 8.1719 120.2859 58.0565 41.8166 178.9757 108 V 3.6103 7.8607 118.1916 66.0681 31.4791 178.2285 109 K 3.9592 7.8419 118.0354 59.4459 31.8284 179.5418 110 V 3.5870 8.0921 118.8471 66.3635 31.4330 178.0600 111 M 4.0419 8.4844 118.8537 58.1524 31.5253 178.4300 112 Q 4.2246 8.0492 120.7388 58.8096 29.3091 178.0168 113 E 4.1861 8.1499 118.1927 58.0828 29.7221 177.6515 114 K 4.4567 8.3238 115.2071 55.9080 34.0416 176.4699 115 A 4.5218 8.0483 120.1521 51.0744 19.7842 176.7593 116 G 3.7813 8.2892 103.6956 46.7549 0.0000 173.8239 117 L 4.1132 7.3005 119.8753 54.1494 42.0504 176.6337 118 D 4.7763 8.3967 127.1685 52.0828 42.8200 176.3374 119 A 4.2253 8.5418 120.0880 55.7477 18.1905 180.0421 120 G 3.6698 8.1912 103.7390 47.8104 0.0000 176.0326 121 G 3.6121 8.7114 108.2285 47.5692 0.0000 175.8907 122 Q 4.0169 8.5545 120.7751 59.1496 28.6720 179.0041 123 T 3.8098 7.8674 116.3349 66.5065 68.3979 176.4709 124 A 3.8910 8.1277 122.7691 55.1364 18.3868 179.4807 125 L 3.7890 8.2321 119.1268 58.2711 42.0821 179.2234 126 R 3.9252 8.1707 118.2077 59.3710 30.0109 178.7958 127 N 4.2358 8.2983 116.2791 56.2377 38.5534 177.6128 128 V 3.1628 7.7199 119.7565 66.2558 31.5442 178.0162 129 M 4.1364 8.4496 118.9182 58.2020 31.6663 178.9960 130 G 3.6150 8.2597 106.3085 47.6976 0.0000 175.8111 131 I 3.6914 7.7726 122.1172 64.1920 37.0726 178.5500 132 I 3.6590 7.7729 120.4920 64.5694 36.9208 178.6637 133 I 3.4549 8.1239 120.7691 64.1791 36.8495 178.4181 134 A 3.9659 8.1558 121.8382 55.0159 18.1213 179.2516 135 D 4.2086 8.1418 116.6269 57.3568 41.3474 178.2484 136 L 3.8488 7.9575 119.8587 57.9054 41.5830 179.2250 137 E 3.7501 8.3730 119.1879 59.1012 29.5300 178.6998 138 A 4.0371 8.1653 120.9192 55.2969 18.5112 179.4311 139 N 4.3831 8.4637 115.1263 56.5056 38.5174 177.0948 140 Y 4.1980 8.7817 118.6861 61.2277 38.0088 178.8373 141 K 4.0463 8.4207 120.3024 59.6716 32.0928 178.6559 142 E 4.0360 8.1370 117.8455 59.0146 29.4485 178.4543 143 L 4.4642 7.6934 116.2014 54.8757 42.0266 177.4534 144 G 3.6679 8.2558 107.4779 45.2887 0.0000 173.6837 145 F 4.6768 8.1678 118.9662 55.1792 39.5911 175.9184 146 S 4.4238 8.6071 120.6703 58.7502 62.6456 174.6950 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 8.12 4.41 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 3 D 8.01 4.15 0.00 2.58 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 4 F 8.98 3.95 0.00 3.03 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 5 D 8.29 4.40 0.00 2.89 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 6 A 8.00 4.01 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 7 V 7.74 3.73 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 1.15 0.00 0.00 0.90 0.00 0.00 8 L 8.18 4.10 0.00 1.89 1.75 0.96 0.34 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 9 K 8.08 4.37 0.00 1.94 1.90 0.00 1.66 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.68 7.81 10 C 7.97 4.88 0.00 3.00 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 11 W 8.36 4.57 0.00 3.44 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 12 G 8.23 3.77 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 0.00 0.00 0.00 13 P 0.00 4.17 0.00 1.91 2.03 0.00 3.84 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.08 0.00 14 V 7.01 3.30 0.67 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 0.11 0.00 0.00 0.48 0.00 0.00 15 E 7.14 2.54 0.00 1.66 1.71 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 2.15 1.82 0.00 16 A 7.45 4.06 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 17 D 7.51 4.65 0.00 2.57 2.40 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 18 Y 7.89 4.28 0.00 3.01 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 19 T 7.90 3.87 4.41 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 1.21 0.00 0.00 20 T 8.28 3.82 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 1.17 0.00 0.00 21 I 8.02 3.80 1.79 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 1.51 0.70 0.80 0.00 0.00 22 G 8.46 3.67 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 0.00 0.00 0.00 23 G 8.20 3.62 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 0.00 0.00 0.00 0.00 24 L 7.96 3.91 0.00 1.84 1.67 0.87 0.64 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 25 V 7.82 3.49 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 1.08 0.00 0.00 0.97 0.00 0.00 26 L 7.73 3.39 0.00 1.33 0.75 0.88 0.29 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 27 T 7.89 3.71 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 28 R 7.98 3.85 0.00 1.91 2.01 0.00 3.08 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 29 L 7.94 3.97 0.00 1.74 1.42 0.98 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 30 F 8.04 4.62 0.00 3.02 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 31 K 8.09 4.08 0.00 1.83 2.04 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.52 7.81 32 E 8.34 4.25 0.00 1.92 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.45 0.00 33 H 8.28 5.03 0.00 3.36 3.22 0.00 5.62 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 4.66 0.00 2.28 2.34 0.00 3.90 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.90 0.00 35 E 8.30 4.09 0.00 2.21 2.29 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 2.41 2.35 0.00 36 T 8.28 4.13 4.53 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 1.31 0.00 0.00 37 Q 8.06 3.28 0.00 1.66 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.85 0.00 0.00 0.00 0.00 0.00 1.91 1.16 0.00 38 K 7.52 4.13 0.00 1.98 1.85 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.46 7.81 39 L 7.71 4.41 0.00 1.68 1.48 0.88 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 40 F 7.86 4.47 0.00 3.20 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 41 P 0.00 4.21 0.00 1.97 2.08 0.00 3.55 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.05 0.00 42 K 7.84 4.06 0.00 1.03 1.63 0.00 1.44 0.00 0.00 1.56 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.28 7.81 43 F 8.08 5.00 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 44 A 7.89 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 45 G 8.82 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 0.00 0.00 0.00 46 I 7.32 3.77 1.85 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 1.26 0.73 0.90 0.00 0.00 47 A 8.69 4.00 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 48 Q 8.95 3.96 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.45 2.51 0.00 49 A 8.02 4.13 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 50 D 7.92 4.69 0.00 2.74 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 51 I 7.72 3.89 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 1.45 0.77 0.92 0.00 0.00 52 A 7.47 3.92 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 53 G 7.88 3.80 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 0.00 0.00 0.00 54 N 8.12 4.55 0.00 2.88 2.67 0.00 0.00 7.06 7.95 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 55 A 8.57 3.99 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 56 A 8.04 4.00 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 57 V 8.14 2.84 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 0.77 0.00 0.00 -0.10 0.00 0.00 58 S 8.01 4.09 0.00 4.01 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 A 8.35 4.03 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 H 8.61 4.33 0.00 3.60 3.72 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 G 8.46 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 0.00 0.00 0.00 0.00 62 A 8.28 4.06 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 63 T 7.74 3.73 4.37 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 1.25 0.00 0.00 64 V 7.69 3.57 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 1.10 0.00 0.00 1.00 0.00 0.00 65 L 8.03 4.18 0.00 1.58 1.84 0.98 0.96 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 66 K 7.84 3.51 0.00 1.75 1.73 0.00 1.57 0.00 0.00 1.55 0.00 0.00 3.08 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.01 0.63 7.81 67 K 7.98 3.91 0.00 1.90 2.01 0.00 1.54 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.51 7.81 68 L 8.29 4.07 0.00 1.90 2.03 0.91 1.09 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 69 G 8.77 3.44 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 0.00 0.00 0.00 70 E 8.30 3.99 0.00 1.98 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 2.32 2.36 0.00 71 L 8.13 3.99 0.00 1.94 1.67 0.92 0.48 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 72 L 8.03 4.10 0.00 1.45 1.56 -0.24 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 73 K 7.52 4.39 0.00 1.71 1.79 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.13 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.41 1.47 7.81 74 A 7.56 4.11 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 75 K 7.65 4.18 0.00 1.70 1.72 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.33 1.32 7.81 76 G 7.26 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 S 7.66 4.27 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 H 7.98 4.50 0.00 3.22 3.27 0.00 5.68 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 A 8.30 4.24 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 80 A 8.35 4.21 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 8.79 3.87 1.99 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 1.62 0.80 0.91 0.00 0.00 82 L 7.76 4.26 0.00 1.98 1.65 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 83 K 7.65 3.98 0.00 1.75 1.86 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.73 7.81 84 P 0.00 4.25 0.00 2.17 2.11 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 2.12 2.14 0.00 85 L 7.48 4.00 0.00 1.81 1.77 1.01 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 86 A 8.23 4.17 1.48 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 0.00 0.00 87 N 8.36 4.20 0.00 2.94 2.86 0.00 0.00 6.83 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 88 S 8.25 4.04 0.00 3.94 4.11 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 89 H 8.66 4.17 0.00 3.69 3.82 0.00 5.81 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.08 3.07 -0.05 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 0.00 0.00 91 T 7.41 4.09 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 1.20 0.00 0.00 92 K 7.53 4.19 0.00 1.53 1.69 0.00 1.63 0.00 0.00 1.62 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.27 1.38 7.81 93 H 7.90 4.38 0.00 2.95 3.11 0.00 5.80 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 K 7.66 3.74 0.00 1.85 1.84 0.00 1.76 0.00 0.00 2.37 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.49 7.81 95 I 7.88 4.22 1.98 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.70 0.59 0.00 0.00 96 P 0.00 4.58 0.00 2.33 2.04 0.00 3.77 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.17 0.00 97 I 8.68 3.84 1.84 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.76 0.86 0.00 0.00 98 N 8.27 4.34 0.00 2.77 2.84 0.00 0.00 7.22 6.71 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 99 N 8.23 4.36 0.00 2.70 2.70 0.00 0.00 6.91 8.04 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 0.00 100 F 8.24 4.22 0.00 3.23 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 0.00 101 K 8.02 4.06 0.00 1.99 1.87 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.53 7.81 102 L 7.70 3.88 0.00 1.75 1.44 0.84 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.79 3.76 1.90 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 1.56 1.57 1.07 0.00 0.00 104 S 8.24 4.16 0.00 4.11 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 E 8.43 3.97 0.00 2.21 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 2.35 2.47 0.00 106 V 7.77 3.58 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 1.10 0.00 0.00 0.99 0.00 0.00 107 L 8.17 3.95 0.00 1.85 1.84 1.00 1.18 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 0.00 108 V 7.86 3.61 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 1.07 0.00 0.00 1.03 0.00 0.00 109 K 7.84 3.96 0.00 1.91 1.84 0.00 1.74 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.64 1.59 7.81 110 V 8.09 3.59 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 1.06 0.00 0.00 0.93 0.00 0.00 111 M 8.48 4.04 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.54 0.00 112 Q 8.05 4.22 0.00 2.11 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.02 0.00 0.00 0.00 0.00 0.00 2.37 2.27 0.00 113 E 8.15 4.19 0.00 2.17 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 2.33 2.44 0.00 114 K 8.32 4.46 0.00 1.71 1.74 0.00 1.62 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.43 7.81 115 A 8.05 4.52 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 0.00 116 G 8.29 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 L 7.30 4.11 0.00 1.83 1.59 0.97 1.21 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 0.00 118 D 8.40 4.78 0.00 2.99 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 0.00 119 A 8.54 4.23 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 0.00 120 G 8.19 3.67 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 0.00 0.00 0.00 121 G 8.71 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 Q 8.55 4.02 0.00 2.24 2.16 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 2.39 2.51 0.00 123 T 7.87 3.81 4.38 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 1.19 0.00 0.00 124 A 8.13 3.89 1.43 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 0.00 0.00 125 L 8.23 3.79 0.00 1.75 1.81 0.93 0.96 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 0.00 126 R 8.17 3.93 0.00 2.02 1.95 0.00 3.17 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 127 N 8.30 4.24 0.00 2.83 2.76 0.00 0.00 6.67 8.40 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 0.00 128 V 7.72 3.16 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 0.69 0.00 0.00 -0.01 0.00 0.00 129 M 8.45 4.14 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.83 0.00 130 G 8.26 3.62 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 0.00 0.00 0.00 0.00 131 I 7.77 3.69 2.02 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 1.53 0.99 0.98 0.00 0.00 132 I 7.77 3.66 1.95 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 1.52 0.83 0.81 0.00 0.00 133 I 8.12 3.45 1.86 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 1.43 0.70 0.85 0.00 0.00 134 A 8.16 3.97 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 0.00 135 D 8.14 4.21 0.00 2.87 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 0.00 136 L 7.96 3.85 0.00 1.40 1.14 -0.16 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 137 E 8.37 3.75 0.00 1.92 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 2.30 2.30 0.00 138 A 8.17 4.04 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 0.00 139 N 8.46 4.38 0.00 2.99 2.95 0.00 0.00 7.03 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 Y 8.78 4.20 0.00 3.13 3.34 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 0.00 141 K 8.42 4.05 0.00 1.91 2.08 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.53 7.81 142 E 8.14 4.04 0.00 2.23 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 2.38 2.62 0.00 143 L 7.69 4.46 0.00 2.07 2.02 0.86 1.10 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 0.00 144 G 8.26 3.67 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 0.00 0.00 0.00 145 F 8.17 4.68 0.00 3.09 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 0.00 146 S 8.61 4.42 0.00 3.90 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00