NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.3562 8.0327 117.3826 63.0797 70.2962 174.4326 6 E 3.8466 8.7741 122.9279 59.4377 29.4368 176.0599 *7 E 4.0305 9.0202 119.1827 61.2384 30.0584 180.0351 8 Q 4.3252 8.0989 118.3492 59.2223 28.7988 179.0203 9 I 4.1562 7.8272 119.9538 64.5985 37.1934 178.4523 10 A 3.9992 8.4935 122.0035 55.3070 18.2430 179.6192 11 E 4.8621 8.9205 119.5148 58.9897 29.3517 179.5893 12 F 4.7010 8.5305 118.5591 60.2561 39.0103 177.7715 13 K 3.4113 8.4262 119.7295 59.3765 32.0183 178.7798 14 E 4.0046 8.8352 119.0230 59.2757 29.3183 179.3340 15 A 4.1432 8.3067 120.9325 55.2023 18.4770 179.1650 16 F 3.3204 8.4614 119.4856 61.7051 39.0782 177.6110 17 S 4.1640 8.0802 113.4267 61.4827 62.6169 176.3526 18 L 4.0988 7.9196 121.1877 57.4595 41.3115 179.1854 19 F 4.1385 8.0831 116.6513 59.6886 40.9309 177.1877 20 D 4.9457 7.9571 118.7345 53.9614 36.7798 176.7730 21 K 3.9634 8.2229 121.5559 59.0243 32.7658 178.3416 22 D 4.4471 8.3518 115.8021 53.0110 39.9029 176.7553 23 G 4.0088 8.2021 107.8150 46.3361 0.0000 174.6322 24 D 4.3447 8.3956 120.4785 54.7693 39.3214 177.5711 25 G 4.1523 9.3380 107.4472 45.0325 0.0000 172.5813 26 T 5.1797 8.1037 107.8735 60.1663 72.7779 173.3108 27 I 4.6717 9.1999 123.0284 59.8901 39.9051 175.9896 28 T 4.8875 8.3603 117.8150 60.3139 71.2164 175.9323 29 T 3.9192 8.4806 111.5866 64.6491 68.5722 176.6698 30 K 3.9610 7.9729 121.0469 59.3996 32.1723 178.9523 31 E 3.9361 7.8003 117.3867 59.4788 29.4253 178.7054 32 L 4.0975 8.2545 120.5268 58.0152 42.0249 178.8482 33 G 3.8979 8.6044 105.7041 48.4698 0.0000 174.9924 34 T 3.9737 7.8150 118.4931 66.3699 68.3085 176.4463 35 V 3.4196 7.3816 118.2862 66.3262 31.8192 177.6183 36 M 4.1714 8.4418 118.3989 58.6236 31.7802 178.9553 37 R 4.6277 8.6374 120.1427 58.9414 29.9992 179.0879 38 S 4.1143 7.9482 113.9357 61.3822 62.9106 175.6004 39 L 4.4408 7.7468 120.5244 54.6933 42.0604 179.0779 40 G 3.8805 8.1958 107.5912 45.8699 0.0000 174.5369 41 Q 4.1414 7.6158 120.2912 54.9953 28.6531 174.5547 42 N 5.0812 8.6275 123.1861 51.0132 39.0426 171.1973 43 P 4.9938 0.0000 0.0000 60.6861 33.8133 175.2764 44 T 4.2786 8.3077 115.4472 61.0149 68.2057 175.0756 45 E 4.0287 8.7968 122.8877 59.4420 29.4694 179.0379 46 A 4.1055 7.8832 121.5104 54.4942 18.4558 178.9946 47 E 3.8928 8.1231 115.0776 59.6412 29.5483 179.6245 48 L 3.9968 7.9505 116.6647 57.9300 42.0775 178.9858 49 Q 4.1112 7.9888 119.1538 59.5768 28.9755 178.3347 50 D 4.4707 8.0656 118.9018 57.2212 41.0065 178.5485 51 M 4.1152 8.0180 119.8259 58.3829 31.8405 178.7140 52 I 3.9017 7.7525 119.5562 64.3086 35.6877 178.2284 53 N 4.4003 7.9484 117.8903 56.0019 38.1041 177.1416 54 E 4.1514 7.8023 117.0126 58.3168 29.6894 177.7312 55 V 4.0311 6.8860 117.6840 64.2760 32.9896 174.6117 56 D 4.7575 8.1780 122.6654 54.4892 39.6211 176.3563 57 A 3.9944 8.9689 127.7457 54.4783 18.7495 178.6079 58 D 4.5140 8.4758 113.1218 53.0166 39.8725 177.0869 59 G 4.1420 7.6515 107.5170 46.8119 0.0000 173.7893 60 N 4.6008 8.1622 114.9629 52.2132 37.1358 177.0174 61 G 4.0188 8.8816 106.1714 46.6410 0.0000 173.7127 62 T 4.8637 7.6680 113.0426 60.2897 71.1497 172.9178 63 I 4.6546 8.7360 127.7810 60.3694 38.8482 175.1718 64 D 5.2496 8.7108 126.9911 51.5529 42.1631 177.2503 65 F 3.7266 8.6404 120.1681 61.1267 38.9610 175.3108 66 P 3.9722 0.0000 0.0000 65.3048 31.1509 178.5103 67 E 3.8744 8.0074 117.0192 59.4242 29.5577 178.9524 68 F 4.0697 8.7499 121.0813 60.9882 39.3317 176.9603 69 L 3.3946 7.8530 120.3790 58.2701 41.8648 178.9548 70 T 3.6494 7.7353 115.8268 66.6932 68.1243 175.9983 71 M 3.8176 7.5070 118.7221 59.1743 32.3348 178.1466 72 M 3.9269 7.3421 116.4893 57.4269 32.0634 177.7771 73 A 4.4598 7.4875 119.2992 51.5759 19.4020 176.8523 74 R 3.7190 7.5058 120.0974 56.8218 29.9399 176.8764 *75 K 4.2165 8.4353 127.6102 54.5009 32.4395 172.7849 76 M 4.8094 8.2794 124.3063 52.6736 35.3937 176.1417 *77 K 4.2427 8.2147 120.3992 54.4816 32.6909 174.7791 78 D 4.4771 8.9290 122.0679 57.7861 40.5052 179.7344 79 T 3.9881 7.8583 109.5934 64.7633 68.9322 176.4270 80 D 4.3783 8.3588 122.1121 57.0802 40.8704 178.8253 81 S 4.1434 8.0083 115.2234 61.5781 62.9639 175.9226 82 E 4.0248 8.1989 121.9533 59.6125 29.2596 178.6039 83 E 4.0414 8.0704 119.0057 59.1703 29.6383 178.2891 84 E 4.0048 8.3204 119.5332 59.3271 29.5853 178.8971 85 I 4.1570 8.0001 119.7858 64.2310 37.3726 178.3538 86 R 3.9686 8.8119 119.3605 59.4235 29.9459 178.7558 87 E 3.9901 8.7373 119.1259 59.2249 29.1744 178.6544 88 A 4.2401 8.2061 120.9654 55.1113 18.4654 179.4395 89 F 3.2218 8.9183 119.9137 61.2623 39.2456 177.4434 90 R 3.8869 7.9192 116.5352 59.2353 29.9074 178.8437 91 V 3.6827 7.5338 116.7879 66.0452 31.6291 177.7068 92 F 4.1705 7.6145 114.7388 59.8640 40.4436 176.8127 93 D 4.7696 7.5347 120.2096 53.0931 38.3033 176.5382 94 K 4.0560 7.9967 122.1895 58.2456 32.8445 177.7032 95 D 4.6008 8.6481 117.4182 52.3578 39.4031 176.3937 96 G 4.0335 7.4581 107.0672 47.0354 0.0000 173.8284 97 N 4.6779 8.7646 113.8472 51.9811 37.9918 175.7933 98 G 3.9284 9.1257 108.1328 45.5961 0.0000 173.1466 99 Y 5.1874 7.8582 115.7037 56.2500 41.8774 175.1371 100 I 4.5657 9.1514 124.4597 59.9146 38.9078 175.9545 101 S 4.8908 8.5242 121.5179 57.2444 64.6833 175.3910 102 A 4.0032 8.7009 121.2267 55.0599 17.9366 179.8001 103 A 3.9811 7.9434 119.1772 55.2128 18.6266 179.5643 104 E 3.9348 8.2177 117.1104 59.4373 29.6014 179.2479 105 L 4.1631 8.1692 120.4360 58.3643 42.2422 178.8359 106 R 3.9087 8.0223 118.5721 59.9522 29.9524 178.1436 107 H 4.1532 8.3375 115.9580 58.6470 28.5596 178.0775 108 V 3.4120 7.8012 120.0037 66.2306 31.3301 177.9057 109 M 4.1608 8.0807 118.4137 58.8918 31.6011 178.9731 110 T 3.8372 7.7408 114.4314 66.7723 68.7035 176.3046 111 N 4.4303 7.9167 117.2003 56.0845 38.5284 177.1385 112 L 4.0895 7.8360 120.4762 56.5971 42.1150 177.5152 113 G 4.3273 8.1082 108.4071 46.2735 0.0000 173.2395 114 E 4.7469 7.7382 112.5949 56.2238 30.1018 175.5428 115 K 4.0719 7.7638 116.7145 57.1514 33.0524 175.9166 116 L 4.6475 7.9423 121.4214 53.3361 43.7194 175.9399 117 T 4.0915 8.1879 116.3044 63.4802 70.2046 175.7408 118 D 4.3141 8.4595 122.3564 57.8253 41.0088 178.7076 119 E 3.9450 8.2777 118.5781 59.5347 29.3848 178.9201 120 E 3.8970 8.0371 118.5165 59.6038 29.9626 179.1419 121 V 3.6895 7.7060 111.7928 64.4996 31.5584 178.5227 122 D 4.3813 8.2638 119.0739 57.2466 40.6891 178.5633 123 E 4.1626 8.6261 118.6013 59.6737 29.0909 179.1456 124 M 4.3452 8.1496 121.0477 57.6127 31.9692 178.7159 125 I 3.7625 7.6202 119.7400 64.6341 37.1911 178.6117 126 R 4.1827 8.3422 117.8314 59.4451 29.7136 178.7144 127 E 4.0835 8.4605 118.4511 58.8078 29.2181 178.5573 128 A 4.4946 7.4786 118.6744 52.9803 20.8879 178.1461 129 D 4.9746 8.3124 117.6682 54.4500 38.1683 175.8622 130 I 3.8541 7.8230 117.1547 63.5036 38.1578 178.3704 131 D 4.3729 7.8202 119.3761 53.7864 39.3221 177.2567 132 G 3.9872 8.4340 108.8450 45.0401 0.0000 174.0753 133 D 4.2656 7.7876 118.8726 54.9088 39.1826 178.0542 134 G 3.9813 9.5746 107.1325 45.1347 0.0000 172.8496 135 Q 4.6542 8.2829 117.0393 53.8477 32.9475 174.8953 136 V 5.1537 8.9610 120.3748 59.7602 32.5138 175.9351 137 N 5.2166 8.8692 123.9575 51.7134 40.4793 174.5946 138 Y 2.8641 7.9057 119.8140 60.7578 38.9257 177.6992 139 E 3.7562 7.9886 118.7348 59.3641 29.7922 178.6618 140 E 3.9123 8.2052 117.8600 59.8312 29.5273 179.3362 141 F 4.1437 8.2958 120.1594 61.1618 39.4155 177.2776 142 V 3.3509 7.5892 117.7997 66.1545 31.1496 178.0921 143 Q 4.0488 7.2112 115.9736 58.1754 28.4977 178.1464 144 M 4.1031 7.3072 118.1987 57.6529 32.3581 176.4379 145 M 4.2428 7.2873 116.6198 55.0508 32.1123 176.2158 146 T 4.1423 7.4526 115.6960 61.7028 69.0963 173.7723 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 5 T 8.03 4.36 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 1.22 0.00 0.00 6 E 8.77 3.85 0.00 2.13 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 2.40 2.46 0.00 *7 E 9.02 4.03 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 2.32 1.98 0.00 8 Q 8.10 4.33 0.00 2.39 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.85 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 9 I 7.83 4.16 2.13 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 1.67 0.96 1.21 0.00 0.00 10 A 8.49 4.00 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 11 E 8.92 4.86 0.00 1.89 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 2.28 2.28 0.00 12 F 8.53 4.70 0.00 3.63 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 13 K 8.43 3.41 0.00 1.64 1.70 0.00 1.43 0.00 0.00 1.46 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.34 0.99 7.81 14 E 8.84 4.00 0.00 2.20 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.61 0.00 15 A 8.31 4.14 1.76 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 16 F 8.46 3.32 0.00 2.96 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 17 S 8.08 4.16 0.00 4.09 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 7.92 4.10 0.00 1.86 1.59 1.05 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 19 F 8.08 4.14 0.00 2.67 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 20 D 7.96 4.95 0.00 2.40 2.55 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 21 K 8.22 3.96 0.00 1.76 1.84 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.52 7.81 22 D 8.35 4.45 0.00 2.79 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 23 G 8.20 4.01 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 0.00 0.00 0.00 24 D 8.40 4.34 0.00 2.84 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 25 G 9.34 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 8.10 5.18 4.43 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 1.29 0.00 0.00 27 I 9.20 4.67 1.82 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.17 0.94 0.00 0.00 28 T 8.36 4.89 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 29 T 8.48 3.92 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 1.27 0.00 0.00 30 K 7.97 3.96 0.00 1.82 1.90 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.54 7.81 31 E 7.80 3.94 0.00 2.18 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 2.33 2.32 0.00 32 L 8.25 4.10 0.00 1.94 1.69 0.99 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.60 3.90 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 0.00 0.00 0.00 34 T 7.82 3.97 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 1.16 0.00 0.00 35 V 7.38 3.42 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 0.38 0.00 0.00 0.64 0.00 0.00 36 M 8.44 4.17 0.00 2.05 2.22 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.62 0.00 37 R 8.64 4.63 0.00 1.78 1.96 0.00 3.14 0.00 0.00 3.25 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.61 0.00 38 S 7.95 4.11 0.00 3.97 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 39 L 7.75 4.44 0.00 1.76 1.58 0.76 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 40 G 8.20 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 Q 7.62 4.14 0.00 2.22 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.70 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 42 N 8.63 5.08 0.00 2.61 2.71 0.00 0.00 7.08 7.69 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 43 P 0.00 4.99 0.00 2.17 2.03 0.00 3.55 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.03 0.00 44 T 8.31 4.28 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 1.31 0.00 0.00 45 E 8.80 4.03 0.00 1.98 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 2.33 2.35 0.00 46 A 7.88 4.11 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 47 E 8.12 3.89 0.00 2.07 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 0.00 2.42 2.50 0.00 48 L 7.95 4.00 0.00 1.77 1.77 1.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 49 Q 7.99 4.11 0.00 2.34 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 50 D 8.07 4.47 0.00 2.73 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 51 M 8.02 4.12 0.00 2.11 2.30 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.60 0.00 52 I 7.75 3.90 2.10 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 1.55 0.63 0.96 0.00 0.00 53 N 7.95 4.40 0.00 2.85 2.87 0.00 0.00 6.67 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 E 7.80 4.15 0.00 2.18 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 2.55 2.29 0.00 55 V 6.89 4.03 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 0.75 0.00 0.00 0.89 0.00 0.00 56 D 8.18 4.76 0.00 2.94 2.60 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 57 A 8.97 3.99 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 58 D 8.48 4.51 0.00 2.84 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 59 G 7.65 4.14 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 0.00 0.00 0.00 60 N 8.16 4.60 0.00 3.00 3.15 0.00 0.00 6.91 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 61 G 8.88 4.02 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 0.00 0.00 0.00 62 T 7.67 4.86 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 1.36 0.00 0.00 63 I 8.74 4.65 2.01 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 1.35 0.80 1.16 0.00 0.00 64 D 8.71 5.25 0.00 2.78 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 F 8.64 3.73 0.00 2.22 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 P 0.00 3.97 0.00 2.13 1.99 0.00 3.83 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.14 0.00 67 E 8.01 3.87 0.00 2.22 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 2.39 2.63 0.00 68 F 8.75 4.07 0.00 3.53 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 L 7.85 3.39 0.00 1.03 1.34 0.70 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 70 T 7.74 3.65 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 1.12 0.00 0.00 71 M 7.51 3.82 0.00 1.83 1.93 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.33 0.00 72 M 7.34 3.93 0.00 1.43 1.21 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.79 0.00 73 A 7.49 4.46 1.14 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 0.00 0.00 74 R 7.51 3.72 0.00 1.98 1.95 0.00 3.19 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.53 0.00 *75 K 8.44 4.22 0.00 1.82 1.58 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.36 1.03 7.81 76 M 8.28 4.81 0.00 1.96 2.01 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 2.48 2.47 0.00 *77 K 8.21 4.24 0.00 1.68 1.69 0.00 1.81 0.00 0.00 1.82 0.00 0.00 2.86 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.03 7.81 78 D 8.93 4.48 0.00 2.76 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 79 T 7.86 3.99 4.25 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 1.22 0.00 0.00 80 D 8.36 4.38 0.00 2.98 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 81 S 8.01 4.14 0.00 4.04 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 82 E 8.20 4.02 0.00 2.28 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 2.45 2.41 0.00 83 E 8.07 4.04 0.00 2.21 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 84 E 8.32 4.00 0.00 2.26 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 2.42 2.44 0.00 85 I 8.00 4.16 2.22 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 1.70 1.00 1.30 0.00 0.00 86 R 8.81 3.97 0.00 1.94 1.93 0.00 2.84 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.67 0.00 87 E 8.74 3.99 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 88 A 8.21 4.24 1.83 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 0.00 0.00 89 F 8.92 3.22 0.00 2.91 3.20 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 0.00 0.00 0.00 90 R 7.92 3.89 0.00 2.00 2.00 0.00 3.23 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 91 V 7.53 3.68 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.99 0.00 0.00 92 F 7.61 4.17 0.00 2.83 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 93 D 7.53 4.77 0.00 2.06 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 K 8.00 4.06 0.00 1.73 1.81 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.63 1.31 7.81 95 D 8.65 4.60 0.00 2.79 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 96 G 7.46 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 97 N 8.76 4.68 0.00 2.93 3.06 0.00 0.00 6.42 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 98 G 9.13 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 0.00 0.00 0.00 99 Y 7.86 5.19 0.00 2.92 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 I 9.15 4.57 1.92 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 0.67 1.00 1.01 0.00 0.00 101 S 8.52 4.89 0.00 4.03 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 0.00 102 A 8.70 4.00 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 0.00 103 A 7.94 3.98 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 0.00 104 E 8.22 3.93 0.00 2.27 2.30 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 2.35 2.35 0.00 105 L 8.17 4.16 0.00 1.90 1.76 1.23 0.94 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 0.00 106 R 8.02 3.91 0.00 2.19 1.98 0.00 3.13 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 107 H 8.34 4.15 0.00 3.50 3.29 0.00 5.67 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.80 3.41 1.93 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 0.50 0.00 0.00 0.77 0.00 0.00 109 M 8.08 4.16 0.00 2.12 2.12 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 2.90 2.67 0.00 110 T 7.74 3.84 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 0.00 111 N 7.92 4.43 0.00 2.88 2.80 0.00 0.00 7.12 7.35 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 0.00 112 L 7.84 4.09 0.00 1.76 1.63 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 113 G 8.11 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 0.00 0.00 0.00 0.00 114 E 7.74 4.75 0.00 2.03 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 2.33 2.31 0.00 115 K 7.76 4.07 0.00 1.76 1.78 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.47 7.81 116 L 7.94 4.65 0.00 1.80 1.63 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 117 T 8.19 4.09 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 1.23 0.00 0.00 118 D 8.46 4.31 0.00 2.72 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 0.00 119 E 8.28 3.95 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 120 E 8.04 3.90 0.00 2.03 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 2.39 2.41 0.00 121 V 7.71 3.69 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.99 0.00 0.00 122 D 8.26 4.38 0.00 2.89 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 E 8.63 4.16 0.00 2.16 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 124 M 8.15 4.35 0.00 2.13 2.35 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 2.78 2.45 0.00 125 I 7.62 3.76 2.09 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 1.82 0.89 0.96 0.00 0.00 126 R 8.34 4.18 0.00 1.89 2.02 0.00 3.17 0.00 0.00 3.31 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.87 0.00 127 E 8.46 4.08 0.00 2.23 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 2.57 0.00 128 A 7.48 4.49 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 0.00 129 D 8.31 4.97 0.00 2.68 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 0.00 130 I 7.82 3.85 1.87 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 1.68 0.72 0.94 0.00 0.00 131 D 7.82 4.37 0.00 2.80 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 G 8.43 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 0.00 0.00 0.00 133 D 7.79 4.27 0.00 2.63 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 0.00 134 G 9.57 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 0.00 135 Q 8.28 4.65 0.00 1.96 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.64 0.00 0.00 0.00 0.00 0.00 2.29 2.22 0.00 136 V 8.96 5.15 2.18 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 1.01 0.00 0.00 1.13 0.00 0.00 137 N 8.87 5.22 0.00 2.93 3.31 0.00 0.00 5.84 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 0.00 138 Y 7.91 2.86 0.00 1.98 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 0.00 139 E 7.99 3.76 0.00 2.05 1.91 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 2.40 2.45 0.00 140 E 8.21 3.91 0.00 2.21 2.25 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 2.43 2.44 0.00 141 F 8.30 4.14 0.00 3.30 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 0.00 142 V 7.59 3.35 1.94 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 0.86 0.00 0.00 0.25 0.00 0.00 143 Q 7.21 4.05 0.00 2.23 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.77 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 144 M 7.31 4.10 0.00 1.63 2.05 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.52 0.00 145 M 7.29 4.24 0.00 1.91 1.82 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.64 0.00 146 T 7.45 4.14 4.20 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 0.00 0.00 1.22 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.