NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.0910 8.1727 122.0318 56.3394 33.7870 173.8581 2 Q 4.7484 8.3638 129.3247 53.8810 30.7444 174.3203 3 F 4.8094 8.8206 126.3166 57.0679 41.2681 174.9669 4 T 4.5646 8.4709 110.8251 60.4192 70.9822 175.6777 5 K 3.4408 8.9584 122.6526 60.2172 31.9717 179.3830 6 C 4.2860 8.0648 115.8703 59.7779 35.4850 175.5690 7 E 3.8847 7.8382 120.3123 59.5318 29.1731 179.2334 8 L 3.3880 7.5009 119.8505 57.8547 42.0074 178.8529 9 S 3.9860 7.7582 113.2119 61.4225 62.1079 176.2535 10 Q 3.9865 7.7897 119.0310 59.2713 28.3960 178.1846 11 L 4.0555 7.6114 119.9539 56.5919 41.8922 178.3202 12 L 4.4547 7.5924 116.7668 53.9894 42.0893 177.8547 13 K 3.7500 7.6410 121.5124 59.9320 31.8528 178.2157 14 D 4.3801 8.0840 116.3999 57.0510 41.2012 177.0373 15 I 4.0996 7.7331 117.7069 60.8104 38.1954 174.6953 16 D 4.5630 7.6493 119.5225 56.3665 41.5982 176.1575 17 G 3.9837 9.3637 115.5722 45.4370 0.0000 172.5963 18 Y 4.0299 7.8405 121.8352 58.6378 38.8432 176.3344 19 G 3.7967 8.6965 115.0325 45.6405 0.0000 173.9074 20 G 3.8939 8.2585 106.5939 45.3028 0.0000 173.8093 21 I 4.2380 7.4102 120.8793 60.0914 38.1348 174.9155 22 A 4.7351 8.9270 128.6329 51.1348 19.6776 177.5503 23 L 3.8977 9.5421 126.1072 58.0450 41.9900 177.8712 24 P 4.3148 0.0000 0.0000 65.9594 31.2311 178.1015 25 E 3.8868 8.1013 117.0321 58.8137 29.5618 178.8375 26 L 3.8523 7.6548 121.0451 57.6784 42.2091 178.6882 27 I 3.6509 7.7912 120.1825 64.3465 36.9669 177.4913 28 C 2.4500 7.7723 119.3506 59.2578 38.5856 175.7316 29 T 3.7253 7.4177 116.9291 66.9826 68.0161 176.5930 30 M 3.9166 7.8719 120.5119 57.9990 31.7740 178.4344 31 F 3.4406 8.1510 120.9395 61.5809 39.3380 176.7047 32 H 4.1225 7.5026 112.4112 57.5003 28.6656 177.4205 33 T 4.2587 7.1397 117.9635 65.4856 68.5751 175.7327 34 S 4.4506 7.8120 110.9657 56.5471 64.8888 174.5332 35 G 3.2246 7.9124 108.9897 46.7047 0.0000 173.2025 36 Y 3.7441 7.3184 113.0919 58.7598 36.2031 169.2237 37 D 5.1094 7.6125 119.4552 52.6564 42.0533 176.7123 38 T 4.2078 9.0016 118.3895 63.7262 69.4537 175.4087 39 Q 4.7411 8.2258 119.9165 55.5048 29.8940 175.7407 40 A 4.1386 8.0218 123.1089 52.2998 19.5054 176.9161 41 I 4.7754 8.3554 122.7277 59.4667 40.7014 175.0286 42 V 4.4218 8.5404 127.6213 60.9234 33.7865 174.0470 43 E 5.1720 8.8075 125.5209 55.0223 32.4167 174.8203 44 N 5.0225 9.1454 118.7385 54.2336 38.2020 175.0084 45 N 4.3839 8.9069 115.8559 54.7985 38.9395 174.9346 46 E 4.3093 8.4195 123.1239 56.8139 30.7244 175.6787 47 S 4.7486 7.3934 110.4651 58.8787 66.2539 174.0891 48 T 4.9957 7.9475 115.4287 61.9205 72.9522 172.9839 49 E 5.1793 8.6778 123.7403 54.7678 33.0613 174.5303 50 Y 5.1048 9.0670 121.3802 57.4053 41.3328 177.6288 51 G 4.3836 8.9931 111.6537 44.5490 0.0000 172.9153 52 L 3.7717 8.8979 119.9592 58.4842 41.7389 179.3207 53 F 4.6898 8.1836 112.7305 57.0018 39.7534 175.6621 54 Q 3.5307 7.8502 119.0880 57.0519 26.4571 173.6719 55 I 4.2620 8.0444 119.1239 60.7322 39.4135 176.8933 56 S 5.1942 9.3898 122.9051 57.8853 63.1185 174.3618 57 N 5.0200 9.2276 124.6125 54.1311 36.9194 176.2942 58 K 4.1560 8.3589 121.2514 59.0689 32.8225 176.8446 59 L 4.3936 7.6991 116.2694 55.2941 46.5533 177.3155 60 W 4.5511 8.3507 118.3967 58.1994 29.4330 173.2655 61 C 5.4592 7.9855 110.9790 53.6441 46.2289 172.6484 62 K 4.8245 8.6107 120.7660 55.0094 33.5463 175.0330 63 S 5.0524 8.3923 120.6863 56.4300 65.7540 174.8220 64 S 4.1937 8.9139 119.6090 60.8706 63.1106 175.4508 65 Q 4.0647 8.1183 122.4527 58.3138 29.1673 176.0344 66 V 4.3301 7.4460 119.3739 59.8564 31.3793 173.6533 67 P 4.3500 0.0000 0.0000 64.6267 31.6573 177.9234 68 Q 4.2542 7.9232 115.0764 55.9427 29.0106 175.7979 69 S 4.0985 7.6097 113.7573 58.9967 62.6778 174.7789 70 R 3.8260 8.4836 125.5242 57.2952 30.8510 175.9682 71 N 4.1187 8.2131 116.5869 54.4163 37.6042 174.7402 72 I 3.6739 7.8129 120.3293 64.7986 37.7986 177.2810 73 C 4.5889 8.5831 114.9383 56.2662 40.5791 173.2316 74 D 4.2250 7.9808 118.6600 54.0851 39.6742 172.8189 75 I 4.3222 6.7212 118.1772 59.9280 41.7158 173.2734 76 S 4.7614 8.1314 120.5665 57.7234 64.2073 176.0170 77 C 3.8242 8.4129 120.1655 59.5829 39.2705 176.1952 78 D 4.0885 7.7027 120.4733 55.9962 38.7502 178.0156 79 K 4.1626 7.4126 117.8691 57.7818 32.1569 177.8516 80 F 5.3913 7.8035 119.2429 56.8088 39.1564 176.5028 81 L 5.1424 8.0474 117.6080 53.9418 42.6869 176.2663 82 D 4.7848 7.8292 118.1674 52.2065 40.8786 175.8750 83 D 4.3651 8.4715 117.9289 56.5386 40.9817 176.3841 84 D 4.6150 7.7279 117.6408 53.4999 40.3321 175.8977 85 I 4.7387 8.2383 121.6601 60.8756 37.8745 177.3375 86 T 3.8818 8.1591 119.5755 67.2848 68.3797 176.1744 87 D 4.5116 8.1881 120.3049 56.4144 38.9238 178.1038 88 D 4.1872 8.2806 120.0890 57.2974 40.8568 178.4985 89 I 3.3943 8.1378 120.5843 64.4555 36.9541 178.1335 90 M 3.8911 7.9815 119.0551 58.7647 31.9811 177.5156 91 C 4.2405 8.2527 118.4509 59.4823 44.9960 175.3008 92 A 3.4682 7.8105 122.7686 54.9792 17.7935 179.8054 93 K 3.7163 8.0367 117.1858 59.0111 31.9362 179.6226 94 K 3.9632 7.5660 120.3078 59.3857 32.0843 178.9038 95 I 2.8615 7.3923 120.1459 64.1200 36.8988 178.2169 96 L 4.0326 7.8919 119.7237 58.1687 41.2517 179.4998 97 D 4.4988 7.9956 117.5349 56.9167 40.8140 178.2522 98 I 4.1573 7.6265 118.8513 62.9919 37.9070 176.7111 99 K 4.1731 7.9170 118.7013 58.3428 32.9332 175.5262 100 G 3.8529 8.0654 102.6875 44.8097 0.0000 173.8773 101 I 4.0097 8.5087 117.8106 63.8356 37.9401 176.8788 102 D 4.6951 8.1377 117.1056 54.5297 39.2265 176.4101 103 Y 3.8138 7.6236 122.0813 59.7367 38.9364 175.7291 104 W 4.5043 8.0051 120.7012 54.8280 29.8828 176.5181 105 L 3.9594 8.6329 126.1196 58.2454 41.4758 178.6232 106 A 4.1106 8.1272 119.9214 54.9012 18.2507 178.9159 107 H 4.0286 8.1262 116.8981 59.6581 29.8375 177.7262 108 K 4.0373 8.0489 117.8447 58.8742 32.0188 178.7305 109 A 4.2799 7.4197 119.6899 54.0082 18.7692 177.9436 110 L 4.7841 7.9429 112.3141 54.3562 43.9940 176.2460 111 C 5.0285 8.1625 116.5518 57.0594 40.7444 174.4585 112 T 4.4278 7.8131 106.8810 61.1898 67.8951 172.7728 113 E 4.6322 8.0231 120.3567 56.5793 33.1878 174.6458 114 K 4.1813 8.4787 115.0684 56.8778 29.7205 177.7917 115 L 4.5322 7.4404 116.6384 56.8639 41.6993 179.4503 116 E 4.0296 7.8372 119.7794 59.2731 29.5071 179.3168 117 Q 3.7971 7.7742 115.3609 58.4039 28.6458 176.8333 118 W 4.6749 7.6500 117.1870 56.5539 29.0683 175.6537 119 L 4.4787 7.3428 120.7996 53.7816 42.5936 175.3107 120 C 4.5814 8.4893 125.0113 55.7043 46.0242 171.1349 121 E 4.1185 9.2042 127.9976 56.1528 28.0928 178.9311 122 K 4.3103 8.6891 107.1606 55.9491 35.5937 175.4505 123 L 4.2849 8.5669 123.7276 55.1391 42.2615 175.6978 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 K 8.17 4.09 0.00 1.74 1.54 0.00 1.26 0.00 0.00 1.64 0.00 0.00 2.73 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.96 0.34 7.81 2 Q 8.36 4.75 0.00 2.10 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.84 0.00 0.00 0.00 0.00 0.00 2.30 2.60 0.00 3 F 8.82 4.81 0.00 2.92 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 4 T 8.47 4.56 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 5 K 8.96 3.44 0.00 1.97 1.89 0.00 1.84 0.00 0.00 1.86 0.00 0.00 2.92 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.56 1.79 7.81 6 C 8.06 4.29 0.00 2.99 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 E 7.84 3.88 0.00 2.21 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 2.40 2.37 0.00 8 L 7.50 3.39 0.00 1.41 1.20 0.58 0.18 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 9 S 7.76 3.99 0.00 4.01 3.93 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 10 Q 7.79 3.99 0.00 2.22 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.77 0.00 0.00 0.00 0.00 0.00 2.53 2.34 0.00 11 L 7.61 4.06 0.00 1.54 1.58 0.56 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 12 L 7.59 4.45 0.00 1.64 1.60 0.83 0.42 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 13 K 7.64 3.75 0.00 2.07 1.85 0.00 1.51 0.00 0.00 1.62 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.54 7.81 14 D 8.08 4.38 0.00 2.68 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 15 I 7.73 4.10 1.79 0.00 0.00 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 1.06 1.17 0.88 0.00 0.00 16 D 7.65 4.56 0.00 2.69 2.57 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 17 G 9.36 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 Y 7.84 4.03 0.00 3.08 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 19 G 8.70 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 20 G 8.26 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 21 I 7.41 4.24 2.12 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.50 0.89 0.00 0.00 22 A 8.93 4.74 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 23 L 9.54 3.90 0.00 1.83 1.71 0.90 0.77 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 24 P 0.00 4.31 0.00 2.43 2.41 0.00 3.66 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.08 0.00 25 E 8.10 3.89 0.00 2.39 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 2.61 2.35 0.00 26 L 7.65 3.85 0.00 1.68 1.79 0.56 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 27 I 7.79 3.65 2.05 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.69 1.06 0.00 0.00 28 C 7.77 2.45 0.00 1.23 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 29 T 7.42 3.73 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 1.04 0.00 0.00 30 M 7.87 3.92 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.64 0.00 31 F 8.15 3.44 0.00 2.85 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 32 H 7.50 4.12 0.00 3.06 3.27 0.00 5.89 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 T 7.14 4.26 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 1.39 0.00 0.00 34 S 7.81 4.45 0.00 3.93 4.05 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 35 G 7.91 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 Y 7.32 3.74 0.00 3.47 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 37 D 7.61 5.11 0.00 2.72 2.62 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 38 T 9.00 4.21 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 1.27 0.00 0.00 39 Q 8.23 4.74 0.00 2.07 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.84 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 40 A 8.02 4.14 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 41 I 8.36 4.78 1.88 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.02 0.85 0.00 0.00 42 V 8.54 4.42 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 0.96 0.00 0.00 0.99 0.00 0.00 43 E 8.81 5.17 0.00 1.95 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 2.13 2.24 0.00 44 N 9.15 5.02 0.00 2.62 2.07 0.00 0.00 7.13 7.61 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 45 N 8.91 4.38 0.00 2.86 2.63 0.00 0.00 6.47 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 46 E 8.42 4.31 0.00 1.91 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 2.29 2.37 0.00 47 S 7.39 4.75 0.00 4.08 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 48 T 7.95 5.00 4.33 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 0.74 0.00 0.00 49 E 8.68 5.18 0.00 1.94 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 2.24 0.00 50 Y 9.07 5.10 0.00 3.23 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 51 G 8.99 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 0.00 0.00 0.00 0.00 52 L 8.90 3.77 0.00 1.56 1.47 0.97 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 53 F 8.18 4.69 0.00 3.06 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Q 7.85 3.53 0.00 2.40 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.84 6.79 0.00 0.00 0.00 0.00 0.00 2.54 2.66 0.00 55 I 8.04 4.26 1.95 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.73 1.12 0.00 0.00 56 S 9.39 5.19 0.00 4.36 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 57 N 9.23 5.02 0.00 2.94 3.30 0.00 0.00 6.88 7.21 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 58 K 8.36 4.16 0.00 1.82 1.97 0.00 1.81 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.39 7.81 59 L 7.70 4.39 0.00 1.46 1.09 0.53 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 60 W 8.35 4.55 0.00 3.66 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 61 C 7.99 5.46 0.00 3.01 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 62 K 8.61 4.82 0.00 2.03 1.64 0.00 1.57 0.00 0.00 1.55 0.00 0.00 2.77 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.32 1.34 7.81 63 S 8.39 5.05 0.00 3.84 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 S 8.91 4.19 0.00 4.02 3.99 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 65 Q 8.12 4.06 0.00 2.13 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.05 0.00 0.00 0.00 0.00 0.00 2.41 2.33 0.00 66 V 7.45 4.33 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 1.05 0.00 0.00 1.00 0.00 0.00 67 P 0.00 4.35 0.00 2.21 2.17 0.00 3.82 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 1.98 1.95 0.00 68 Q 7.92 4.25 0.00 2.16 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.90 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 69 S 7.61 4.10 0.00 4.09 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 70 R 8.48 3.83 0.00 1.64 1.84 0.00 3.26 0.00 0.00 3.02 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.51 0.00 71 N 8.21 4.12 0.00 2.83 2.72 0.00 0.00 7.02 7.50 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 72 I 7.81 3.67 1.88 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 1.05 -0.14 0.97 0.00 0.00 73 C 8.58 4.59 0.00 3.37 3.30 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 74 D 7.98 4.23 0.00 2.73 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 75 I 6.72 4.32 1.96 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 1.16 0.81 0.88 0.00 0.00 76 S 8.13 4.76 0.00 3.98 3.86 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 77 C 8.41 3.82 0.00 2.17 1.80 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 78 D 7.70 4.09 0.00 2.80 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 79 K 7.41 4.16 0.00 1.50 1.98 0.00 1.81 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.34 1.48 7.81 80 F 7.80 5.39 0.00 3.29 3.16 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 81 L 8.05 5.14 0.00 1.80 1.78 1.06 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 82 D 7.83 4.78 0.00 2.80 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 83 D 8.47 4.37 0.00 2.72 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 84 D 7.73 4.61 0.00 2.72 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 I 8.24 4.74 1.98 0.00 0.00 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 1.71 1.69 1.11 0.00 0.00 86 T 8.16 3.88 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 1.23 0.00 0.00 87 D 8.19 4.51 0.00 3.08 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 D 8.28 4.19 0.00 3.22 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 89 I 8.14 3.39 2.01 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 1.59 1.13 0.77 0.00 0.00 90 M 7.98 3.89 0.00 2.22 2.04 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 2.59 2.56 0.00 91 C 8.25 4.24 0.00 3.21 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 A 7.81 3.47 0.38 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 93 K 8.04 3.72 0.00 1.73 1.62 0.00 1.38 0.00 0.00 1.14 0.00 0.00 2.30 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.30 1.06 7.81 94 K 7.57 3.96 0.00 1.91 1.88 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.61 1.55 7.81 95 I 7.39 2.86 1.32 0.00 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.31 0.00 0.00 96 L 7.89 4.03 0.00 1.93 1.90 1.18 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 97 D 8.00 4.50 0.00 2.91 2.78 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 98 I 7.63 4.16 2.12 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 1.49 0.78 1.04 0.00 0.00 99 K 7.92 4.17 0.00 1.90 2.03 0.00 1.84 0.00 0.00 1.82 0.00 0.00 3.27 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.46 7.81 100 G 8.07 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 0.00 0.00 0.00 0.00 101 I 8.51 4.01 1.92 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 1.16 1.07 0.96 0.00 0.00 102 D 8.14 4.70 0.00 2.86 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 0.00 103 Y 7.62 3.81 0.00 2.40 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 W 8.01 4.50 0.00 3.57 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 0.00 105 L 8.63 3.96 0.00 1.71 1.67 0.91 1.07 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 0.00 106 A 8.13 4.11 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 0.00 107 H 8.13 4.03 0.00 3.27 3.42 0.00 5.59 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 K 8.05 4.04 0.00 1.78 1.87 0.00 1.78 0.00 0.00 1.83 0.00 0.00 3.29 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.59 7.81 109 A 7.42 4.28 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 0.00 110 L 7.94 4.78 0.00 1.50 1.65 0.71 0.93 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 0.00 111 C 8.16 5.03 0.00 2.97 2.94 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 0.00 112 T 7.81 4.43 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 1.19 0.00 0.00 113 E 8.02 4.63 0.00 2.00 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 2.30 2.26 0.00 114 K 8.48 4.18 0.00 2.06 1.90 0.00 1.98 0.00 0.00 1.79 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.43 7.81 115 L 7.44 4.53 0.00 1.76 1.85 1.18 0.97 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 0.00 116 E 7.84 4.03 0.00 2.11 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 117 Q 7.77 3.80 0.00 1.59 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 7.30 0.00 0.00 0.00 0.00 0.00 1.87 1.16 0.00 118 W 7.65 4.67 0.00 3.45 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 0.00 119 L 7.34 4.48 0.00 1.76 1.54 0.96 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 120 C 8.49 4.58 0.00 2.95 2.94 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 0.00 121 E 9.20 4.12 0.00 1.92 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 2.27 2.34 0.00 122 K 8.69 4.31 0.00 1.83 1.70 0.00 1.55 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.24 1.35 7.81 123 L 8.57 4.28 0.00 1.57 1.52 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00