NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 L 4.3193 8.1801 120.6345 54.7554 41.8834 175.9236 23 A 4.0083 8.3574 127.0855 52.6870 19.2036 175.2950 24 D 4.6408 8.2518 114.2250 51.8314 42.8481 173.8949 25 S 4.1723 8.9299 114.2494 62.1220 62.6870 176.8043 26 K 3.9796 8.0658 120.5399 59.3181 31.8243 179.0826 27 A 3.9989 8.4276 121.0975 55.2005 18.3088 179.9354 28 V 3.6102 7.8424 116.7617 65.9600 31.5427 178.0279 29 L 4.2007 8.3686 119.1803 58.2094 41.5697 179.1936 30 N 4.2096 8.2858 116.6740 56.4345 38.6757 176.7056 31 Q 4.2175 8.2490 121.0311 59.2629 29.2377 178.1302 32 A 4.2278 8.7237 122.2930 55.0418 18.4654 179.5120 33 V 3.5373 8.2271 116.7796 66.2530 31.6291 177.9505 34 A 4.2231 8.4288 120.0973 55.7191 18.3666 179.4606 35 D 4.4335 8.6894 117.5641 57.4724 40.8106 179.1080 36 L 4.2804 8.7323 120.0328 57.6856 41.7058 179.6738 37 S 3.9103 7.8754 115.2323 61.5466 62.6138 176.9446 38 V 3.6296 7.7989 120.6433 65.6580 31.2002 177.7425 39 A 4.0034 8.5324 121.0716 55.5181 18.1461 178.8726 40 H 3.9553 8.5421 116.9403 59.6372 29.8098 177.2402 41 S 4.0921 8.0211 114.4001 61.4681 62.1633 176.2423 42 I 3.6682 7.9637 122.5130 64.4078 36.7865 178.4144 43 L 3.9542 8.0610 119.9596 58.0202 41.4939 179.1392 44 H 3.7177 8.2626 118.4644 58.8498 29.6164 176.9153 45 Q 4.1620 8.1644 121.7857 59.3732 28.7098 178.6392 46 V 3.6294 7.8898 119.0547 66.3388 31.3245 177.0913 47 H 4.1350 8.1623 116.8935 59.3863 29.6337 176.7257 48 W 4.7807 7.9340 118.4892 59.6281 29.3847 177.6069 49 Y 4.4644 8.5723 114.6436 57.4442 37.7575 175.2572 50 M 4.4369 7.6330 121.2817 55.7036 32.9753 175.6024 51 R 4.6605 8.9889 123.6031 54.9603 34.5654 173.8378 52 G 4.3136 8.9209 106.2250 42.6870 0.0000 173.1938 53 R 4.2468 8.2405 119.9579 57.4745 30.3616 177.3613 54 G 4.2926 9.5060 110.3649 45.5770 0.0000 175.0944 55 F 4.0887 8.7214 122.2701 62.0140 39.0203 176.8764 56 M 4.2726 8.2512 115.4682 58.3447 31.8022 177.7844 57 I 3.7112 7.5594 119.6079 63.8056 37.6020 177.8869 58 W 4.2632 8.2295 119.5129 59.0841 28.6328 177.8007 59 H 3.8173 8.2648 119.2069 59.0388 28.9505 175.4199 60 P 4.1284 0.0000 0.0000 65.5561 31.1532 178.1812 61 K 3.5704 7.4032 118.8068 59.4703 32.0060 178.5264 62 M 4.0960 7.9440 118.9952 58.4875 31.7605 178.3344 63 D 4.1917 7.3401 118.6482 57.3843 40.9843 178.7974 64 E 3.8752 7.6221 118.9002 59.6144 29.3702 179.0678 65 Y 4.4333 7.8434 116.7117 61.4243 37.8653 178.4066 66 M 4.1042 8.8142 122.4246 59.1713 32.0648 179.3319 67 E 3.9378 8.3657 118.4800 60.9298 29.8320 180.6400 68 E 3.8392 8.1238 120.1485 59.1193 29.6639 178.9578 69 I 3.7407 7.8939 120.0096 64.6221 37.2052 178.1364 70 D 4.4407 8.4240 120.0329 57.1219 40.5774 179.0027 71 G 3.5303 7.8939 106.1879 48.1240 0.0000 175.2558 72 Y 4.2589 7.3144 119.7444 60.4306 37.8110 178.1547 73 L 3.9416 8.2963 121.6891 58.6249 42.0672 178.7377 74 D 4.2825 8.2241 117.5173 57.1576 41.1876 177.7764 75 E 3.8702 8.2992 119.8511 59.6417 29.7151 178.7803 76 M 3.9066 8.5611 119.0343 58.2363 31.9206 178.7115 77 S 4.0819 8.2434 113.3945 61.6033 62.5627 176.2012 78 E 3.9687 8.3921 121.2011 59.0624 29.0759 179.3527 79 R 3.8136 8.0826 119.2170 59.1648 30.0728 178.2514 80 L 3.9162 7.8560 120.1738 58.1752 42.0863 178.9724 81 I 3.6813 7.9257 119.8092 64.8160 36.8425 178.4413 82 T 3.8976 7.8799 115.4078 66.5240 68.3727 175.7681 83 L 4.3556 7.7577 117.8177 54.9088 41.8286 177.7166 84 G 3.8553 8.1003 107.8386 45.2458 0.0000 174.1158 85 G 3.7727 8.0078 109.2430 44.1395 0.0000 173.5167 86 A 4.4699 8.0007 121.2955 49.1676 20.0766 174.1816 87 P 4.4564 0.0000 0.0000 63.0026 32.1756 176.8240 88 F 4.7410 8.3108 120.1708 58.9420 39.3057 176.5285 89 S 4.8472 8.8061 117.9883 57.3095 63.7532 174.6815 90 T 4.4859 6.8757 110.1405 59.6913 72.8014 173.6804 91 L 4.0655 8.3274 122.7934 57.8862 41.6163 179.4939 92 K 3.7591 7.9533 118.9266 59.8304 32.0428 178.3053 93 E 3.6119 7.5926 118.0306 59.2530 29.3055 179.5137 94 F 4.4098 7.5825 117.6300 60.7930 38.8254 177.7643 95 S 4.1500 8.1919 111.6898 61.4339 62.2669 175.7035 96 E 4.0776 8.1878 120.6946 59.2281 29.3236 178.5178 97 N 4.4720 7.8124 115.0568 54.1421 39.1821 175.8289 98 S 4.5045 7.3639 114.9696 58.2734 62.9705 173.8423 99 Q 4.2552 8.9083 124.7059 56.2417 29.0651 176.2116 100 L 4.1122 7.2880 118.7625 53.6754 42.5899 176.1798 101 K 4.5485 8.2601 121.1178 54.6165 34.4001 175.5752 102 E 4.6231 8.5110 122.3730 54.8314 31.3936 175.5933 103 V 4.5136 7.7254 113.8676 58.9192 35.3659 175.6958 104 L 4.0672 8.2071 121.1693 54.4653 42.0632 177.6973 105 G 2.4294 7.9816 110.5008 45.1097 0.0000 172.9471 106 D 4.4552 7.5692 121.6791 52.2932 43.2209 175.6042 107 Y 4.8235 8.5996 124.3865 60.1042 38.0727 176.8293 108 N 4.7142 8.4830 115.7705 53.4292 39.1816 175.7191 109 V 3.8244 7.2785 119.2893 62.8781 32.2805 176.4206 110 T 4.2901 8.7862 117.6827 61.1664 70.9852 175.6833 111 I 3.7255 8.2476 121.3613 64.4297 37.9168 177.9586 112 E 3.8619 8.0479 118.9767 59.2453 29.3211 178.9471 113 E 3.8946 8.1626 118.7578 59.3695 29.5104 179.2841 114 Q 3.9323 8.4351 118.4793 59.0722 28.7321 179.1135 115 L 3.6787 7.8439 119.6128 57.5168 41.5711 179.2731 116 A 3.8703 8.0428 120.9633 55.1938 18.2298 179.6838 117 R 3.7468 7.9639 117.2064 59.4497 30.0460 178.9747 118 V 3.2247 7.5179 118.1503 65.6573 31.3467 178.1535 119 V 3.3608 7.7878 118.3771 65.8599 31.3500 177.6729 120 E 3.9248 8.0948 118.2698 59.5322 29.3009 179.5529 121 V 3.6291 7.6064 117.9511 66.2362 31.5271 178.0905 122 F 4.3986 8.4217 117.6465 60.7024 38.7944 177.9333 123 R 3.9449 8.5322 118.2548 59.1405 29.8126 178.4818 124 Y 3.9493 8.0264 119.3561 60.7289 38.8591 178.0163 125 L 3.3684 8.1258 119.7678 57.4956 41.6392 179.3584 126 A 3.8449 8.0547 120.7399 55.0556 18.2527 179.5940 127 A 3.8352 7.5202 118.9260 54.8511 18.3795 179.5690 128 L 3.5972 7.6087 119.2771 58.3464 42.0491 179.3627 129 F 4.3890 8.1388 118.0944 60.4266 38.7010 177.5139 130 Q 3.9581 8.1380 119.4254 59.1876 28.8925 178.4637 131 K 4.0196 8.0203 119.6652 59.2992 31.9873 179.6380 132 G 2.3795 7.7487 106.3045 46.9915 0.0000 175.6261 133 F 4.0411 8.2123 123.4057 61.1205 39.3670 176.9278 134 D 4.3428 8.4999 118.7817 57.4733 40.6977 178.8212 135 V 3.5467 7.6788 118.8435 66.2011 31.3589 178.1923 136 S 4.4367 7.9577 114.9852 60.3389 63.0675 176.0494 137 D 4.0768 7.8426 121.9199 57.2121 40.7932 177.6030 138 E 3.8999 8.0637 118.6522 59.3688 29.7145 178.1010 139 E 4.2549 8.1075 116.0549 56.3292 29.7540 177.3585 140 G 3.8134 7.5385 106.6265 46.8785 0.0000 175.0542 141 D 4.6050 8.0299 122.0074 52.6786 38.9773 176.3510 142 S 4.0794 7.9722 119.6424 60.6407 63.6434 176.6426 143 V 3.4989 7.6686 121.3977 66.1660 31.4032 177.9376 144 T 3.7217 7.7410 115.4104 66.4905 68.2751 175.8148 145 N 4.3645 8.1166 120.3071 56.1895 38.7850 176.2893 146 D 4.3881 8.0279 119.0317 57.2847 41.4162 178.0505 147 I 3.5195 7.4901 119.9091 64.6183 37.0373 178.4855 148 F 3.9740 7.9103 118.2984 60.2522 38.6434 177.4092 149 N 4.3157 8.3419 117.0104 56.5638 38.6870 177.1128 150 V 3.5263 8.0750 119.7939 65.9195 31.6079 177.9071 151 A 3.2881 7.4392 119.9528 54.7392 17.9365 179.2944 152 K 3.9521 8.1644 118.2146 59.7251 32.2224 178.6138 153 A 3.9580 7.9386 120.8401 55.3228 18.3096 179.6490 154 S 4.0333 7.8556 111.6271 61.5355 62.4346 176.2896 155 I 3.5463 7.7785 122.5446 64.4891 36.8301 178.2816 156 E 4.0150 8.4980 119.6233 59.2497 29.2694 179.3036 157 K 4.2771 8.1369 119.6408 59.9740 32.1908 178.5813 158 H 4.4183 8.4471 116.5362 58.9598 28.5437 177.7661 159 I 3.8006 8.2967 121.9421 64.1034 36.8795 178.0414 160 W 4.3882 8.3266 129.1367 61.1038 30.5448 177.9829 161 M 3.2374 7.7972 118.3197 58.0279 31.2969 178.8563 162 L 4.0766 8.3061 119.5211 57.8138 41.7052 179.4920 163 Q 3.9805 8.4321 118.1035 58.8383 28.5922 178.7237 164 A 4.0202 8.2495 122.0350 55.1754 18.2158 179.1211 165 E 3.9664 8.0421 116.6582 59.4202 29.7781 178.2804 166 L 4.3484 7.6523 115.8267 54.3470 41.8213 177.1057 167 G 3.9159 8.1553 107.0845 46.5335 0.0000 173.6325 168 Q 4.6337 8.1981 116.6370 53.1193 32.4736 175.4778 169 A 4.3653 8.3421 122.3595 51.4102 19.1516 176.3338 170 P 4.3829 0.0000 0.0000 63.8983 31.9305 177.1839 171 K 3.8326 8.0498 115.6064 57.3387 29.5571 174.8439 172 L 4.1882 7.8029 121.3794 55.1703 41.5628 177.6875 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 22 L 8.18 4.32 0.00 1.66 1.75 0.95 0.63 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 23 A 8.36 4.01 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 24 D 8.25 4.64 0.00 3.13 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 S 8.93 4.17 0.00 3.93 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 26 K 8.07 3.98 0.00 1.79 1.84 0.00 1.65 0.00 0.00 1.98 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.50 7.81 27 A 8.43 4.00 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 28 V 7.84 3.61 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 0.86 0.00 0.00 0.96 0.00 0.00 29 L 8.37 4.20 0.00 1.93 1.74 0.94 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 30 N 8.29 4.21 0.00 2.79 2.51 0.00 0.00 6.91 6.30 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 31 Q 8.25 4.22 0.00 2.48 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.47 2.74 0.00 32 A 8.72 4.23 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 V 8.23 3.54 2.43 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 1.25 0.00 0.00 1.01 0.00 0.00 34 A 8.43 4.22 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.69 4.43 0.00 2.90 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.73 4.28 0.00 1.80 1.80 1.21 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.88 3.91 0.00 3.53 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 38 V 7.80 3.63 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.98 0.00 0.00 39 A 8.53 4.00 1.53 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 0.00 0.00 0.00 40 H 8.54 3.96 0.00 3.31 3.52 0.00 5.79 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 S 8.02 4.09 0.00 4.02 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 0.00 42 I 7.96 3.67 1.98 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 1.48 0.52 0.85 0.00 0.00 43 L 8.06 3.95 0.00 1.77 1.68 1.08 1.03 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 44 H 8.26 3.72 0.00 2.98 2.69 0.00 5.62 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 45 Q 8.16 4.16 0.00 2.25 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.56 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 46 V 7.89 3.63 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 0.95 0.00 0.00 1.02 0.00 0.00 47 H 8.16 4.14 0.00 3.09 3.36 0.00 5.99 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 W 7.93 4.78 0.00 3.69 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 49 Y 8.57 4.46 0.00 3.14 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 50 M 7.63 4.44 0.00 2.25 2.29 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.94 0.00 51 R 8.99 4.66 0.00 1.88 1.78 0.00 3.31 0.00 0.00 3.17 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.76 0.00 52 G 8.92 4.31 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 0.00 53 R 8.24 4.25 0.00 1.87 1.96 0.00 3.38 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 54 G 9.51 4.29 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 0.00 0.00 0.00 55 F 8.72 4.09 0.00 3.38 3.14 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 56 M 8.25 4.27 0.00 2.08 2.22 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.74 0.00 57 I 7.56 3.71 1.69 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.00 -0.06 0.00 0.00 58 W 8.23 4.26 0.00 3.45 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 59 H 8.26 3.82 0.00 1.69 2.67 0.00 5.78 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 P 0.00 4.13 0.00 2.16 2.21 0.00 3.65 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.97 0.00 61 K 7.40 3.57 0.00 1.64 1.83 0.00 1.12 0.00 0.00 1.11 0.00 0.00 2.80 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.91 0.57 7.81 62 M 7.94 4.10 0.00 2.06 2.22 0.00 0.00 0.00 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 3.06 0.00 63 D 7.34 4.19 0.00 2.64 2.61 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 64 E 7.62 3.88 0.00 1.83 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 0.00 2.22 2.34 0.00 65 Y 7.84 4.43 0.00 3.21 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 66 M 8.81 4.10 0.00 1.87 2.17 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.29 0.00 67 E 8.37 3.94 0.00 1.97 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 2.24 2.19 0.00 68 E 8.12 3.84 0.00 2.03 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 0.00 1.78 2.07 0.00 69 I 7.89 3.74 2.07 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.94 1.01 0.00 0.00 70 D 8.42 4.44 0.00 2.86 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 71 G 7.89 3.53 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 0.00 0.00 0.00 0.00 72 Y 7.31 4.26 0.00 3.04 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 73 L 8.30 3.94 0.00 1.86 1.89 0.86 0.92 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 74 D 8.22 4.28 0.00 2.93 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 75 E 8.30 3.87 0.00 2.18 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 2.23 2.31 0.00 76 M 8.56 3.91 0.00 1.95 2.12 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.05 0.00 77 S 8.24 4.08 0.00 3.95 3.91 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 78 E 8.39 3.97 0.00 2.13 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 2.39 0.00 79 R 8.08 3.81 0.00 1.96 2.01 0.00 3.10 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 80 L 7.86 3.92 0.00 1.78 1.85 0.93 0.77 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 81 I 7.93 3.68 2.01 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 1.52 0.79 0.91 0.00 0.00 82 T 7.88 3.90 4.40 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 1.19 0.00 0.00 83 L 7.76 4.36 0.00 1.74 1.69 0.96 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 84 G 8.10 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 0.00 0.00 0.00 85 G 8.01 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 86 A 8.00 4.47 1.20 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 0.00 0.00 87 P 0.00 4.46 0.00 2.26 2.07 0.00 3.79 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 2.02 2.00 0.00 88 F 8.31 4.74 0.00 3.40 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 89 S 8.81 4.85 0.00 4.02 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 90 T 6.88 4.49 4.08 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 1.13 0.00 0.00 91 L 8.33 4.07 0.00 1.72 1.84 1.00 1.05 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 92 K 7.95 3.76 0.00 1.75 1.71 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.50 7.81 93 E 7.59 3.61 0.00 1.74 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 2.16 2.19 0.00 94 F 7.58 4.41 0.00 3.22 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 95 S 8.19 4.15 0.00 3.94 3.91 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 96 E 8.19 4.08 0.00 1.90 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 2.30 2.43 0.00 97 N 7.81 4.47 0.00 2.47 2.86 0.00 0.00 7.01 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 S 7.36 4.50 0.00 4.12 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 99 Q 8.91 4.26 0.00 1.75 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.44 2.68 0.00 100 L 7.29 4.11 0.00 1.53 1.45 0.96 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.26 4.55 0.00 1.64 1.65 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.28 1.33 7.81 102 E 8.51 4.62 0.00 1.93 1.84 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 2.21 2.29 0.00 103 V 7.73 4.51 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 0.70 0.00 0.00 0.85 0.00 0.00 104 L 8.21 4.07 0.00 1.54 1.50 0.89 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 105 G 7.98 2.43 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 0.00 106 D 7.57 4.46 0.00 2.48 2.38 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 0.00 107 Y 8.60 4.82 0.00 3.15 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 0.00 108 N 8.48 4.71 0.00 2.93 2.90 0.00 0.00 6.91 7.25 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 0.00 109 V 7.28 3.82 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 0.81 0.00 0.00 0.95 0.00 0.00 110 T 8.79 4.29 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 1.27 0.00 0.00 111 I 8.25 3.73 1.94 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.28 0.95 0.00 0.00 112 E 8.05 3.86 0.00 2.01 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 2.32 2.34 0.00 113 E 8.16 3.89 0.00 2.17 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 2.30 2.32 0.00 114 Q 8.44 3.93 0.00 2.11 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.64 2.60 0.00 115 L 7.84 3.68 0.00 1.36 1.23 -0.33 0.01 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 0.00 116 A 8.04 3.87 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 0.00 117 R 7.96 3.75 0.00 1.93 2.04 0.00 3.17 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 118 V 7.52 3.22 1.85 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 -0.04 0.00 0.00 0.83 0.00 0.00 119 V 7.79 3.36 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 1.09 0.00 0.00 0.84 0.00 0.00 120 E 8.09 3.92 0.00 2.19 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 2.30 2.47 0.00 121 V 7.61 3.63 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 1.27 0.00 0.00 0.94 0.00 0.00 122 F 8.42 4.40 0.00 3.10 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.53 3.94 0.00 2.05 2.00 0.00 3.14 0.00 0.00 3.11 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.87 0.00 124 Y 8.03 3.95 0.00 3.10 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 0.00 125 L 8.13 3.37 0.00 1.58 0.83 0.99 0.86 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 0.00 126 A 8.05 3.84 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 0.00 127 A 7.52 3.84 1.23 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 0.00 0.00 128 L 7.61 3.60 0.00 0.98 1.26 0.88 1.12 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 0.00 129 F 8.14 4.39 0.00 3.10 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 0.00 130 Q 8.14 3.96 0.00 2.12 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 131 K 8.02 4.02 0.00 1.88 1.75 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.61 7.81 132 G 7.75 2.38 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 0.00 133 F 8.21 4.04 0.00 3.27 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 0.00 134 D 8.50 4.34 0.00 2.70 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 0.00 135 V 7.68 3.55 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 1.07 0.00 0.00 0.91 0.00 0.00 136 S 7.96 4.44 0.00 4.30 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 0.00 137 D 7.84 4.08 0.00 2.65 2.65 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 0.00 0.00 0.00 138 E 8.06 3.90 0.00 2.00 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 2.31 2.34 0.00 139 E 8.11 4.25 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 2.31 2.50 0.00 140 G 7.54 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 0.00 141 D 8.03 4.60 0.00 2.68 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 0.00 142 S 7.97 4.08 0.00 4.05 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 0.00 143 V 7.67 3.50 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 1.01 0.00 0.00 0.90 0.00 0.00 144 T 7.74 3.72 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 1.32 0.00 0.00 145 N 8.12 4.36 0.00 2.69 2.93 0.00 0.00 6.40 8.07 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 0.00 146 D 8.03 4.39 0.00 2.86 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 0.00 147 I 7.49 3.52 1.61 0.00 0.00 0.70 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 0.94 0.52 0.00 0.00 148 F 7.91 3.97 0.00 3.30 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 0.00 149 N 8.34 4.32 0.00 3.35 3.01 0.00 0.00 6.77 7.82 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 0.00 150 V 8.08 3.53 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 0.98 0.00 0.00 1.03 0.00 0.00 151 A 7.44 3.29 -0.04 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 0.00 0.00 152 K 8.16 3.95 0.00 2.08 1.94 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.84 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.54 1.52 7.81 153 A 7.94 3.96 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 0.00 154 S 7.86 4.03 0.00 3.95 4.08 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 0.00 155 I 7.78 3.55 1.87 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.88 0.76 0.00 0.00 156 E 8.50 4.02 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 0.00 157 K 8.14 4.28 0.00 1.99 2.03 0.00 1.77 0.00 0.00 1.85 0.00 0.00 3.46 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.61 2.03 7.81 158 H 8.45 4.42 0.00 3.44 3.46 0.00 5.68 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 0.00 159 I 8.30 3.80 2.15 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 1.58 1.06 0.99 0.00 0.00 160 W 8.33 4.39 0.00 3.41 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 0.00 161 M 7.80 3.24 0.00 1.91 2.01 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 2.17 0.98 0.00 162 L 8.31 4.08 0.00 1.66 1.59 0.72 0.85 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 0.00 163 Q 8.43 3.98 0.00 2.37 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.50 2.74 0.00 164 A 8.25 4.02 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 0.00 165 E 8.04 3.97 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 2.36 2.45 0.00 166 L 7.65 4.35 0.00 1.78 1.64 0.79 0.92 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 0.00 167 G 8.16 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 0.00 0.00 0.00 168 Q 8.20 4.63 0.00 2.12 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.88 0.00 0.00 0.00 0.00 0.00 2.28 2.45 0.00 169 A 8.34 4.37 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 0.00 170 P 0.00 4.38 0.00 2.13 2.30 0.00 3.90 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 2.10 2.43 0.00 171 K 8.05 3.83 0.00 1.88 1.86 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.37 1.61 7.81 172 L 7.80 4.19 0.00 1.63 1.58 0.93 0.95 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