NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2240 8.1633 120.2780 54.7201 33.3038 174.2644 2 K 4.0375 8.4980 126.2042 56.1287 32.5257 175.6890 3 G 3.9710 8.5540 113.6104 44.6920 0.0000 172.0897 4 D 4.5845 8.4473 119.5345 54.2953 41.9859 177.0768 5 T 3.8662 8.8787 122.8144 66.8638 68.5159 176.6465 6 K 3.8569 8.1700 120.9376 59.1469 32.2318 178.7942 7 V 3.8983 8.6950 119.0503 66.2085 31.3910 177.9353 8 I 3.7356 7.7675 119.3500 64.6896 36.8868 178.1693 9 N 4.2828 8.1735 117.1035 56.3222 38.2930 177.1169 10 Y 4.0641 8.0849 118.1769 61.1173 38.0247 178.4221 11 L 3.9175 8.6243 120.1244 58.1624 41.7009 179.5249 12 N 4.2978 8.4998 116.5373 56.0039 38.4038 177.4868 13 K 3.8654 8.2166 121.3930 59.3693 32.3425 178.8597 14 L 3.8008 8.1597 119.6441 57.6577 41.4098 179.0018 15 L 3.9488 7.9709 120.6068 58.2998 41.8554 179.2568 16 G 3.6142 8.1578 105.5690 47.8738 0.0000 175.3693 17 N 4.3468 8.0324 118.8035 56.1635 38.5921 177.3160 18 E 4.0870 8.3007 119.8936 59.6098 29.1273 179.5389 19 L 4.2643 8.2695 118.8275 57.4016 41.5278 180.0408 20 V 3.6432 7.7283 112.3375 64.1794 31.4474 178.1131 21 A 3.8539 8.1164 120.5705 55.2522 18.1987 179.5578 22 I 3.7578 8.2324 118.4994 64.8426 37.2119 178.4844 23 N 4.3995 7.8193 115.8710 56.4458 38.4580 177.4243 24 Q 3.8509 8.3986 121.3637 59.2387 29.0883 177.9457 25 Y 4.3249 8.2287 118.0193 60.9391 37.9721 177.7315 26 F 3.7788 8.4581 121.6345 61.1357 39.4471 176.8732 27 L 3.9069 8.2254 119.8219 58.4977 41.8796 178.3367 28 H 3.7528 8.1175 115.8272 58.8761 28.5994 177.0790 29 A 4.1441 8.3753 122.5618 55.8562 18.1116 180.0099 30 R 3.7730 7.7055 115.3758 58.7066 30.1070 179.3245 31 M 3.3964 7.8850 119.4722 58.1663 31.8900 178.4944 32 F 4.6318 7.6106 118.2099 60.5565 39.0464 177.7151 33 K 3.9451 8.3339 119.3569 59.4731 31.8232 178.0367 34 N 4.2287 7.8683 116.0789 56.7742 38.9247 176.2785 35 W 4.7585 7.8383 116.5693 57.4651 29.2842 177.2849 36 G 4.0250 8.3352 108.0036 45.8187 0.0000 175.2159 37 L 4.4793 8.0222 121.8594 53.1752 38.0618 177.1129 38 K 3.8650 7.9637 122.6508 59.7664 32.5859 177.5899 39 R 3.9277 8.3058 119.1639 59.2806 29.9810 178.4491 40 L 4.1327 7.7653 118.3316 57.2980 41.5610 178.7868 41 N 4.4340 8.1073 116.8856 56.7549 38.9703 176.5160 42 D 4.3199 8.0201 120.2886 57.4361 40.9578 179.1468 43 V 3.3301 7.6219 118.2842 66.0819 31.5008 177.9507 44 E 3.7341 8.3277 118.4551 59.2784 29.2684 178.5975 45 Y 3.9060 8.1538 119.7566 61.2209 38.8733 178.1826 46 H 4.2033 8.2445 116.4204 58.3363 28.6488 177.6126 47 E 3.6702 7.8224 120.9508 58.6590 29.1629 178.7320 48 S 4.0973 8.0008 113.7851 61.6194 62.3440 176.2728 49 I 3.5516 7.2661 122.0966 64.4739 36.8513 177.8500 50 D 4.2745 7.7991 119.4897 57.7755 40.6392 179.1521 51 E 4.1980 8.3415 118.6723 59.4691 29.3768 179.3808 52 M 4.0674 8.0665 119.0429 58.2939 31.9948 178.8293 53 K 3.9555 8.1392 118.7864 59.6494 32.1802 179.1000 54 H 4.0805 8.2428 116.1800 58.7998 28.6188 177.4690 55 A 4.2509 8.3232 122.7775 55.4460 18.1643 178.9762 56 D 4.3112 8.2292 116.3263 57.7222 41.2441 178.7882 57 R 3.8546 7.9126 118.3141 59.4461 30.0516 178.5458 58 Y 4.3335 7.7899 116.4050 61.3181 37.8996 178.9271 59 I 3.7968 8.2621 120.9297 64.6178 37.2331 178.4652 60 E 4.0704 8.4987 119.4786 59.0230 29.1883 179.4846 61 R 4.0040 8.0473 118.9788 59.5372 30.2128 178.2661 62 I 3.7489 8.3890 119.9447 64.7377 37.1689 178.3379 63 L 4.0227 8.1358 119.4384 57.7301 41.2033 179.4602 64 F 4.3644 8.1431 119.6434 61.2793 39.7220 176.6776 65 L 4.2933 8.4584 117.2563 54.0456 40.9391 177.1745 66 E 3.5885 7.9979 117.4893 57.4531 27.2325 174.4374 67 G 3.9934 8.1660 108.6765 43.9616 0.0000 173.4534 68 L 4.5310 8.0448 119.1876 52.0409 42.1174 175.1592 69 P 4.3799 0.0000 0.0000 62.5844 31.7626 175.9474 70 N 4.7126 9.5541 122.1732 52.4040 38.7234 173.8702 71 L 4.5953 8.2898 124.1818 54.5473 42.3719 177.5999 72 Q 4.1111 8.6191 122.2877 58.2782 29.3019 175.9571 73 D 4.7063 8.0285 116.6260 52.8079 42.0510 175.2972 74 L 4.5829 8.2559 125.0826 52.7273 44.0999 176.5681 75 G 3.8068 8.4676 115.3777 44.8534 0.0000 171.7761 76 K 4.1045 8.3091 120.6817 55.7344 32.4648 176.5903 77 L 4.0926 8.3799 126.8468 54.3952 42.2679 176.0852 78 N 4.8218 8.6862 121.6033 51.9782 39.9224 174.2216 79 I 3.8816 8.5174 126.6347 63.9229 37.7737 177.8601 80 G 4.3573 8.1514 103.2433 45.4451 0.0000 172.8789 81 E 4.7298 8.7701 117.5715 56.0276 31.1801 176.0845 82 D 4.9176 7.6697 118.1419 50.3253 43.9868 175.8761 83 V 4.0327 8.5686 119.4044 66.6084 31.3500 177.6204 84 E 3.8347 8.1759 117.9442 59.4553 29.4395 178.0633 85 E 4.0219 8.4891 119.4915 59.5486 29.5825 178.7036 86 M 4.1142 8.2928 116.9967 58.1770 31.4892 178.5241 87 L 4.1616 8.5115 120.5750 57.6842 41.8176 179.5317 88 R 3.9012 8.5469 119.0216 59.2782 30.0281 178.5935 89 S 4.1247 8.1279 113.2694 61.2489 62.3732 175.6915 90 D 4.2312 8.1820 121.7054 57.2899 40.5400 178.4513 91 L 3.9996 8.2263 120.5700 58.3802 42.0415 178.9814 92 A 3.9928 8.0734 120.5225 54.9275 18.2437 179.4150 93 L 3.8875 7.8034 118.8868 58.2661 42.0858 179.1070 94 E 4.0425 8.4149 118.6038 59.5065 29.6083 179.1995 95 L 4.0164 8.1837 119.1686 58.1227 41.7251 179.4694 96 D 4.5194 8.5031 118.9994 57.2220 40.6519 179.0888 97 G 3.6333 8.3225 106.2372 47.6195 0.0000 175.7237 98 A 4.0257 8.3656 123.4112 54.6433 18.4976 179.4096 99 K 3.8208 7.9648 117.8224 60.0141 32.3312 178.5770 100 N 4.3826 8.1240 116.3762 56.3898 38.4406 177.4089 101 L 3.9991 8.1112 120.3396 57.9314 41.6222 179.6868 102 R 3.9092 8.3302 118.3570 59.2346 30.1020 178.8024 103 E 3.8650 8.0896 118.3556 59.2557 29.6711 178.7620 104 A 2.8541 7.7470 120.7543 54.7193 18.3910 179.7236 105 I 3.7507 7.8962 118.6391 64.4133 36.9478 178.8760 106 G 3.6014 7.5877 105.5184 47.8814 0.0000 174.8881 107 Y 4.0974 7.7548 121.2568 60.2323 38.8728 177.2392 108 A 3.7951 8.3060 122.2279 55.4542 18.5268 179.0884 109 D 4.0731 7.8932 116.2514 57.3011 41.0784 178.3386 110 S 4.1859 7.4558 113.0331 59.9728 63.3529 175.7017 111 V 3.9708 6.8524 113.9869 60.7577 31.5779 175.5769 112 H 2.8091 6.9765 113.8709 56.6975 26.9079 176.4406 113 D 4.5211 7.3566 121.3546 53.4965 37.7995 176.2140 114 Y 4.2749 7.4330 121.1096 60.5836 38.3802 178.0141 115 V 3.7770 7.8716 113.1859 64.1009 31.8399 178.3765 116 S 4.1630 8.2994 114.8896 61.5911 62.6072 176.6290 117 R 3.8803 8.1492 121.2606 59.5052 29.8340 177.9604 118 D 4.3023 8.4396 117.9960 57.6794 41.3704 177.6837 119 M 3.9649 8.2651 118.8358 59.1679 32.0474 178.1512 120 M 4.1349 8.2105 118.7253 58.3736 32.1538 178.7876 121 I 3.7210 8.1149 120.3485 64.2862 37.3560 178.3079 122 E 3.9635 8.1616 119.4466 59.4663 29.2865 179.4462 123 I 3.5578 7.5659 119.5172 64.2230 37.0577 178.1341 124 L 3.9386 8.1938 121.4804 58.2494 41.9986 178.8945 125 R 3.8758 8.0868 118.5061 59.6959 29.9690 178.2562 126 D 4.3558 7.9528 118.2606 57.3203 40.7459 178.6091 127 E 3.9955 8.2684 119.2988 59.3147 29.3722 178.9967 128 E 4.1126 8.6240 119.9095 59.0186 29.6937 178.9806 129 G 3.7051 7.9889 105.4173 48.2575 0.0000 175.2477 130 H 4.4310 8.2002 118.8920 58.6997 28.6775 177.8724 131 I 3.8135 8.3421 121.9519 64.4903 36.9666 177.7941 132 D 4.3837 8.4782 119.0371 57.2138 41.0230 178.2953 133 W 4.1196 8.4244 128.6489 60.4192 30.7236 177.8723 134 L 3.7473 8.4309 119.0474 57.9243 41.1570 179.3318 135 E 3.9086 8.4838 118.6889 59.7101 29.2982 179.6751 136 T 3.7850 7.9129 115.5582 66.5572 68.5376 176.4140 137 E 3.7588 7.6249 120.3270 59.4961 29.2510 179.3588 138 L 3.7764 7.7854 118.8807 58.0525 41.5670 179.5333 139 D 4.3753 8.0911 118.6015 57.2230 40.6667 178.6772 140 L 3.9625 8.1549 119.8968 57.8503 41.5883 179.5342 141 I 3.4306 7.4289 119.6560 64.4566 36.7311 178.5449 142 Q 3.9323 7.3593 116.2350 58.8316 28.6534 178.5445 143 K 4.1316 8.1616 118.9583 59.0448 32.2626 178.5216 144 M 4.3810 8.4203 114.9170 54.1119 32.4382 177.4074 145 G 4.0862 7.5674 104.9782 45.8083 0.0000 174.4050 146 L 3.9683 8.3542 120.6783 57.9892 42.1564 179.2392 147 Q 3.9913 8.0249 117.4612 59.2615 28.7805 178.4253 148 N 4.3482 8.1831 116.8405 56.4081 38.3530 176.6522 149 Y 3.9360 7.8833 119.9625 60.6750 39.1427 177.8405 150 L 4.1004 8.3416 120.1784 57.9693 41.6141 179.2977 151 Q 3.9022 8.2009 119.1285 59.0521 28.7330 177.8474 152 A 4.0956 7.6714 119.9510 53.6217 18.6095 178.2442 153 Q 4.3282 7.8627 115.9684 55.6071 29.1909 177.5771 154 I 3.8879 7.3670 121.9282 63.3691 37.4311 176.6234 155 R 4.6528 7.5487 117.9903 53.7076 32.3235 175.6222 156 E 4.1260 8.7212 118.8264 56.6702 29.5859 176.6554 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 8.16 4.22 0.00 1.50 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 2.52 2.47 0.00 2 K 8.50 4.04 0.00 1.71 1.71 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.47 7.81 3 G 8.55 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 0.00 0.00 0.00 4 D 8.45 4.58 0.00 2.77 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 5 T 8.88 3.87 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 1.18 0.00 0.00 6 K 8.17 3.86 0.00 1.71 1.95 0.00 1.42 0.00 0.00 0.96 0.00 0.00 2.54 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.81 1.01 7.81 7 V 8.69 3.90 2.35 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 1.15 0.00 0.00 1.20 0.00 0.00 8 I 7.77 3.74 2.05 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 1.55 0.68 0.92 0.00 0.00 9 N 8.17 4.28 0.00 2.58 2.69 0.00 0.00 7.08 6.93 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 10 Y 8.08 4.06 0.00 3.31 2.93 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 11 L 8.62 3.92 0.00 2.02 1.80 1.14 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.50 4.30 0.00 2.78 2.82 0.00 0.00 6.70 7.88 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 13 K 8.22 3.87 0.00 1.81 1.98 0.00 1.59 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.43 1.45 7.81 14 L 8.16 3.80 0.00 0.98 1.13 0.94 0.51 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 15 L 7.97 3.95 0.00 1.67 1.84 1.02 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.16 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 17 N 8.03 4.35 0.00 2.98 2.91 0.00 0.00 7.04 7.80 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 18 E 8.30 4.09 0.00 2.26 2.28 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 2.75 2.89 0.00 19 L 8.27 4.26 0.00 1.66 1.73 0.94 1.09 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 20 V 7.73 3.64 2.06 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 0.87 0.00 0.00 0.89 0.00 0.00 21 A 8.12 3.85 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 8.23 3.76 2.04 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 1.55 1.06 0.90 0.00 0.00 23 N 7.82 4.40 0.00 2.80 2.86 0.00 0.00 6.74 7.83 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 24 Q 8.40 3.85 0.00 1.97 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.83 0.00 0.00 0.00 0.00 0.00 2.18 2.07 0.00 25 Y 8.23 4.32 0.00 3.22 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 26 F 8.46 3.78 0.00 3.42 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 27 L 8.23 3.91 0.00 1.96 1.58 0.89 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.12 3.75 0.00 3.54 3.20 0.00 5.72 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 29 A 8.38 4.14 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 30 R 7.71 3.77 0.00 1.71 1.87 0.00 3.24 0.00 0.00 3.06 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.58 0.00 31 M 7.88 3.40 0.00 0.88 1.63 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.12 0.00 32 F 7.61 4.63 0.00 3.31 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 33 K 8.33 3.95 0.00 1.97 1.87 0.00 1.57 0.00 0.00 1.61 0.00 0.00 2.82 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.42 7.81 34 N 7.87 4.23 0.00 2.68 2.69 0.00 0.00 7.35 7.99 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 35 W 7.84 4.76 0.00 3.75 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 36 G 8.34 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 37 L 8.02 4.48 0.00 2.20 1.67 1.06 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 38 K 7.96 3.87 0.00 1.99 1.82 0.00 1.59 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.57 7.81 39 R 8.31 3.93 0.00 2.00 2.01 0.00 3.47 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.79 0.00 40 L 7.77 4.13 0.00 1.69 1.11 1.10 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.11 4.43 0.00 3.12 2.99 0.00 0.00 7.10 9.11 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 42 D 8.02 4.32 0.00 2.87 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 43 V 7.62 3.33 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 -0.55 0.00 0.00 0.80 0.00 0.00 44 E 8.33 3.73 0.00 2.19 2.16 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 2.64 3.13 0.00 45 Y 8.15 3.91 0.00 2.95 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 46 H 8.24 4.20 0.00 3.23 3.22 0.00 5.66 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 7.82 3.67 0.00 1.16 1.12 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 1.93 2.03 0.00 48 S 8.00 4.10 0.00 3.96 3.84 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 49 I 7.27 3.55 1.85 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.53 0.85 0.00 0.00 50 D 7.80 4.27 0.00 2.84 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 E 8.34 4.20 0.00 2.17 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 2.69 2.80 0.00 52 M 8.07 4.07 0.00 2.04 2.23 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.55 0.00 53 K 8.14 3.96 0.00 1.88 1.82 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.64 7.81 54 H 8.24 4.08 0.00 3.56 3.47 0.00 5.65 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 55 A 8.32 4.25 1.45 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 0.00 0.00 0.00 56 D 8.23 4.31 0.00 2.93 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 57 R 7.91 3.85 0.00 1.81 1.76 0.00 3.14 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.71 0.00 58 Y 7.79 4.33 0.00 3.25 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 59 I 8.26 3.80 2.04 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 1.58 0.89 0.95 0.00 0.00 60 E 8.50 4.07 0.00 2.03 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 2.35 2.64 0.00 61 R 8.05 4.00 0.00 2.15 2.21 0.00 3.36 0.00 0.00 3.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.85 0.00 62 I 8.39 3.75 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.82 1.00 0.00 0.00 63 L 8.14 4.02 0.00 2.09 1.80 0.95 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.14 4.36 0.00 3.02 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 65 L 8.46 4.29 0.00 1.69 1.62 0.99 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.00 3.59 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 2.17 2.28 0.00 67 G 8.17 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 68 L 8.04 4.53 0.00 1.62 1.63 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.38 0.00 2.06 2.03 0.00 3.66 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.12 0.00 70 N 9.55 4.71 0.00 2.59 2.82 0.00 0.00 7.11 8.12 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 71 L 8.29 4.60 0.00 1.64 1.65 0.94 0.98 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 72 Q 8.62 4.11 0.00 1.97 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.55 6.71 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 73 D 8.03 4.71 0.00 2.68 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.26 4.58 0.00 1.52 1.50 0.95 1.04 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 75 G 8.47 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 0.00 0.00 0.00 76 K 8.31 4.10 0.00 1.72 1.73 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.45 7.81 77 L 8.38 4.09 0.00 1.64 1.56 0.90 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 78 N 8.69 4.82 0.00 2.63 2.70 0.00 0.00 7.23 8.03 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 79 I 8.52 3.88 1.89 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.92 0.93 0.00 0.00 80 G 8.15 4.36 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 0.00 81 E 8.77 4.73 0.00 2.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 82 D 7.67 4.92 0.00 2.77 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 83 V 8.57 4.03 2.19 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 1.22 0.00 0.00 1.22 0.00 0.00 84 E 8.18 3.83 0.00 2.02 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 2.32 2.26 0.00 85 E 8.49 4.02 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 86 M 8.29 4.11 0.00 2.35 1.75 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.95 0.00 87 L 8.51 4.16 0.00 2.01 1.78 1.25 0.65 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 88 R 8.55 3.90 0.00 2.10 1.94 0.00 3.09 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 89 S 8.13 4.12 0.00 4.07 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.18 4.23 0.00 3.13 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 91 L 8.23 4.00 0.00 1.81 1.90 0.98 0.99 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 92 A 8.07 3.99 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 93 L 7.80 3.89 0.00 1.90 1.81 0.90 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.41 4.04 0.00 2.28 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 2.61 2.72 0.00 95 L 8.18 4.02 0.00 2.03 1.75 0.96 1.29 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 96 D 8.50 4.52 0.00 2.70 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 97 G 8.32 3.63 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 0.00 0.00 0.00 98 A 8.37 4.03 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 K 7.96 3.82 0.00 2.05 2.03 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.51 7.81 100 N 8.12 4.38 0.00 2.99 2.92 0.00 0.00 7.14 6.73 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 0.00 101 L 8.11 4.00 0.00 2.00 1.74 0.98 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.33 3.91 0.00 1.95 1.99 0.00 3.14 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.97 0.00 103 E 8.09 3.87 0.00 2.08 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 2.37 2.38 0.00 104 A 7.75 2.85 1.01 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 0.00 105 I 7.90 3.75 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 1.46 1.12 0.91 0.00 0.00 106 G 7.59 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 0.00 107 Y 7.75 4.10 0.00 3.19 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 0.00 108 A 8.31 3.80 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 0.00 109 D 7.89 4.07 0.00 2.85 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 0.00 110 S 7.46 4.19 0.00 3.97 3.87 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 0.00 111 V 6.85 3.97 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 0.55 0.00 0.00 0.67 0.00 0.00 112 H 6.98 2.81 0.00 3.20 3.33 0.00 5.84 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.36 4.52 0.00 2.62 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 Y 7.43 4.27 0.00 3.10 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 0.00 115 V 7.87 3.78 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 0.93 0.00 0.00 0.97 0.00 0.00 116 S 8.30 4.16 0.00 4.17 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.15 3.88 0.00 1.89 2.20 0.00 3.33 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 118 D 8.44 4.30 0.00 2.95 2.81 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 0.00 119 M 8.27 3.96 0.00 2.23 2.03 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.45 0.00 120 M 8.21 4.13 0.00 2.15 2.26 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.78 0.00 121 I 8.11 3.72 2.00 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 1.53 1.02 0.91 0.00 0.00 122 E 8.16 3.96 0.00 2.14 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 2.34 0.00 123 I 7.57 3.56 1.94 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.49 0.71 0.00 0.00 124 L 8.19 3.94 0.00 1.84 1.86 1.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 125 R 8.09 3.88 0.00 2.03 2.15 0.00 3.15 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 1.63 1.68 0.00 126 D 7.95 4.36 0.00 3.03 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 0.00 127 E 8.27 4.00 0.00 2.15 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 2.57 2.53 0.00 128 E 8.62 4.11 0.00 2.26 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 2.34 2.36 0.00 129 G 7.99 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 0.00 130 H 8.20 4.43 0.00 3.65 3.59 0.00 5.65 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 0.00 131 I 8.34 3.81 2.12 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 1.50 0.95 0.97 0.00 0.00 132 D 8.48 4.38 0.00 2.96 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 0.00 133 W 8.42 4.12 0.00 3.56 3.48 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 0.00 134 L 8.43 3.75 0.00 1.97 1.74 1.31 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.48 3.91 0.00 2.18 1.99 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 2.33 2.48 0.00 136 T 7.91 3.79 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 1.17 0.00 0.00 137 E 7.62 3.76 0.00 1.54 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 138 L 7.79 3.78 0.00 1.70 1.63 0.89 1.23 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 0.00 139 D 8.09 4.38 0.00 2.79 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 0.00 140 L 8.15 3.96 0.00 1.89 1.85 0.96 0.81 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 0.00 141 I 7.43 3.43 1.71 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.17 0.68 0.00 0.00 142 Q 7.36 3.93 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.97 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 143 K 8.16 4.13 0.00 1.71 1.86 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.64 7.81 144 M 8.42 4.38 0.00 2.17 2.20 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 2.66 2.83 0.00 145 G 7.57 4.09 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 0.00 0.00 0.00 146 L 8.35 3.97 0.00 1.74 1.66 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 147 Q 8.02 3.99 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.66 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 148 N 8.18 4.35 0.00 2.98 2.89 0.00 0.00 6.66 7.48 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 0.00 149 Y 7.88 3.94 0.00 3.05 3.18 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 0.00 150 L 8.34 4.10 0.00 2.03 1.71 1.08 1.13 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 0.00 151 Q 8.20 3.90 0.00 2.12 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 152 A 7.67 4.10 1.21 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 0.00 0.00 0.00 153 Q 7.86 4.33 0.00 1.95 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.76 0.00 0.00 0.00 0.00 0.00 2.20 2.20 0.00 154 I 7.37 3.89 2.04 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 1.31 0.46 0.91 0.00 0.00 155 R 7.55 4.65 0.00 1.75 1.80 0.00 3.20 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 156 E 8.72 4.13 0.00 2.10 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 2.26 2.29 0.00