NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.4010 8.2644 122.4750 52.1082 20.8705 178.3180 2 T 4.1285 5.7900 113.3655 60.4348 69.6385 171.8392 3 K 5.3777 8.9836 127.3420 54.8768 37.1759 174.3652 4 A 5.3487 9.1063 123.5426 50.8501 23.4068 175.2192 5 V 5.0176 8.8653 117.5739 60.6992 35.5464 173.5766 6 C 4.9704 9.1738 122.0626 57.9509 35.1999 172.6018 7 V 4.5368 8.4672 126.2051 61.6355 32.9859 174.1310 8 L 4.9253 8.9676 129.0416 53.6180 43.2588 176.0534 9 K 4.8438 9.0089 122.2059 55.3691 36.9581 176.4191 10 G 4.3225 7.9384 108.4341 45.7444 0.0000 172.3209 11 D 4.5135 8.9112 118.4573 56.2372 41.7806 176.8737 12 G 4.3253 7.6567 109.0254 44.5403 0.0000 171.7111 13 P 4.5018 0.0000 0.0000 63.1380 32.0281 176.3506 14 V 4.2245 7.5276 120.5192 63.1169 32.1855 174.9683 15 Q 4.8155 8.5263 124.2037 55.6284 32.4519 173.3374 16 G 4.2624 8.2753 107.0337 46.2191 0.0000 171.9274 17 I 5.1879 8.1036 119.4024 59.4403 41.0323 175.0668 18 I 4.5585 8.8204 127.3973 59.4615 40.4966 174.3195 19 N 4.9458 8.3753 123.9896 51.4368 41.0421 173.9451 20 F 5.4754 9.0989 120.2830 55.8264 43.2326 173.8155 21 E 5.2172 9.5802 122.6099 54.7945 33.6190 173.7921 22 Q 4.8273 9.4207 127.5733 54.4017 31.3692 175.8127 23 K 4.1565 9.0826 127.1851 58.6222 32.6692 177.5743 24 E 4.7996 7.8060 117.0124 53.6955 32.5303 175.4540 25 S 4.3171 8.6010 116.6848 59.9426 63.3418 174.0020 26 N 4.1066 8.9700 118.6580 53.8314 36.3723 174.4069 27 G 3.9622 7.9800 108.1058 43.8660 0.0000 171.7798 28 P 4.6288 0.0000 0.0000 62.6512 32.2703 176.4359 29 V 4.6330 8.9590 122.8767 61.2274 33.8264 174.8288 30 K 4.8552 9.0697 128.0064 56.1497 33.8275 176.4174 31 V 5.0583 9.2498 117.7488 59.4177 35.2262 174.6792 32 W 5.7268 7.6126 121.2613 55.4607 32.0504 174.9514 33 G 4.0580 7.5842 107.5298 45.2558 0.0000 170.4783 34 S 5.1508 7.8407 113.2427 56.3829 65.5702 172.9613 35 I 5.0357 8.7484 127.4388 59.3236 40.1769 174.8698 36 K 4.8195 9.3499 125.6305 55.6646 36.0789 177.0594 37 G 3.8297 8.8968 106.6242 45.5822 0.0000 173.5997 38 L 4.4007 7.5809 120.0443 53.3329 42.8593 176.5566 39 T 4.2897 8.1361 110.8763 61.0610 69.5515 174.1194 40 E 4.1701 8.5324 124.4583 57.6476 30.5861 175.3225 41 G 3.8307 8.5239 110.1405 43.9358 0.0000 172.4175 42 L 4.7605 8.2256 119.1264 54.8976 42.8915 176.5565 43 H 5.0269 9.2671 119.3837 53.7400 33.0320 173.4222 44 G 4.1006 9.1041 110.9273 46.8400 0.0000 172.6204 45 F 5.3409 8.8994 124.7311 57.3031 42.4235 172.8730 46 H 5.1791 8.9067 122.6609 54.2029 33.9302 172.6552 47 V 4.5147 8.5801 121.0809 62.2084 32.7413 175.2470 48 H 5.0416 9.4521 125.7709 54.6002 30.6005 176.0707 49 E 3.7236 8.7877 121.5650 58.5060 29.9580 176.9338 50 F 4.9406 8.0388 118.2853 54.7937 41.6190 177.0091 51 G 4.3150 8.3615 112.5553 44.4608 0.0000 174.1073 52 D 4.7524 7.9431 117.8191 52.6667 42.5994 174.2866 53 N 5.1594 8.8270 123.8106 52.6705 39.2020 175.4672 54 T 3.9267 8.4939 109.5224 63.5744 69.4785 174.3657 55 A 4.7140 8.1634 125.4273 51.3916 19.8742 175.8629 56 G 3.6761 7.8973 112.6176 47.0979 0.0000 175.9886 57 C 4.4985 8.6006 115.5057 59.6415 36.3530 175.9082 58 T 3.8703 7.6381 116.3892 66.4062 67.7371 175.7606 59 S 4.5199 7.8785 112.2986 59.2033 63.6420 175.1984 60 A 4.5848 7.5509 126.2365 54.0778 18.3699 178.7869 61 G 4.2142 8.0631 106.2675 44.3150 0.0000 170.4009 62 P 4.7468 0.0000 0.0000 61.8652 34.3643 174.9190 63 H 4.5172 8.3802 116.3013 55.8420 29.4934 175.5958 64 F 4.2543 8.9982 125.5235 58.1056 40.1827 175.2613 65 N 4.9364 7.8932 125.5236 51.9226 39.0812 173.0302 66 P 4.2401 0.0000 0.0000 64.9315 32.2359 177.8768 67 L 4.2316 7.6267 116.9938 53.9475 42.3056 176.2326 68 S 3.5982 7.4527 114.3428 59.8760 60.6128 171.0221 69 R 4.5460 8.2758 117.8093 54.2928 32.9368 176.4403 70 K 4.4622 8.9336 118.8974 55.6243 33.9056 176.4005 71 H 3.9701 8.5634 122.3058 56.9971 30.4069 174.8358 72 G 4.1358 7.4202 109.8393 45.9640 0.0000 172.2806 73 G 4.1390 9.1669 109.6469 43.3417 0.0000 173.2976 74 P 4.3069 0.0000 0.0000 65.4570 31.1907 177.7320 75 K 4.2016 7.9160 115.9934 57.4564 32.4788 176.6295 76 D 4.6572 7.7716 119.6682 53.2911 41.7239 176.3005 77 E 3.9077 8.7709 124.0367 59.0919 29.5075 176.7340 78 E 4.2359 7.9569 122.2488 55.2118 28.4183 174.8096 79 R 4.7467 7.5650 119.6583 55.2086 32.6574 174.7160 80 H 4.5453 9.0394 116.2792 55.0068 29.5576 177.0654 81 V 3.4426 8.2315 122.1881 66.3501 31.3915 177.1373 82 G 3.8985 8.3169 104.6788 47.0343 0.0000 173.6082 83 D 4.8956 8.0809 121.7970 53.3610 39.6672 175.7497 84 L 4.4431 8.4767 119.4629 53.4604 42.4912 178.3954 85 G 4.0287 8.4817 107.6726 46.4613 0.0000 173.3623 86 N 5.6638 8.6597 121.0315 51.4817 41.7371 174.0119 87 V 4.4145 8.7358 114.0034 59.8907 35.4561 174.7767 88 T 5.0037 8.2493 118.9544 61.8684 71.0385 173.2122 89 A 4.7165 8.9456 129.2057 50.9104 21.0314 177.2137 90 D 5.0578 8.8120 121.6649 51.9337 41.5236 177.1178 91 K 4.1528 8.4993 117.0609 59.3699 32.6279 177.0759 92 D 4.5859 8.7037 119.2402 54.0021 41.0704 177.0895 93 G 4.2445 8.5108 108.2370 44.7791 0.0000 172.7244 94 V 4.7079 7.8300 119.5457 60.8692 33.7437 174.2186 95 A 5.0669 8.8952 130.4159 49.9471 20.6652 175.4673 96 D 4.7925 8.5638 123.5989 53.3484 40.3980 176.0860 97 V 3.5865 8.6368 123.6594 62.9768 33.1021 175.1060 98 S 4.6095 8.3088 121.8692 57.8970 63.6539 172.9225 99 I 4.8462 9.3068 127.5733 59.1684 41.5553 174.0336 100 E 5.2406 8.7692 124.5462 54.6544 32.6225 174.3141 101 D 4.8955 9.3258 125.0235 53.0944 45.0241 175.5880 102 S 4.7128 8.9223 118.9332 58.4962 64.2215 175.1340 103 V 3.9535 8.0114 120.4551 64.8278 31.8530 176.1913 104 I 4.1206 7.8671 111.5328 61.1489 38.2935 174.3802 105 S 4.6160 8.3877 113.8759 57.7792 65.2880 174.1228 106 L 4.4030 8.9098 123.1650 54.1541 41.4916 176.2386 107 S 4.4354 7.8923 112.5777 58.3544 66.3052 175.4147 108 G 3.8848 8.4850 108.4041 45.0660 0.0000 173.7101 109 D 4.4789 8.7872 117.3815 57.2251 41.0526 176.7524 110 H 5.1611 8.0435 115.2163 55.5361 29.2885 173.8956 111 C 4.4668 7.9326 120.2894 59.6740 31.9151 173.2885 112 I 3.9593 8.1252 118.7155 60.2061 37.9660 175.5259 113 I 3.7110 7.3346 122.9358 63.0150 37.4881 176.3069 114 G 3.7896 9.2946 113.2957 45.5322 0.0000 173.0970 115 R 4.8253 7.4761 119.4527 54.8898 33.6212 174.6424 116 T 5.0018 7.9748 115.5136 62.0533 71.4374 173.6537 117 L 4.7712 8.5859 128.5027 53.9757 44.0909 175.3211 118 V 4.9050 8.7620 125.8137 60.9441 35.0124 174.2339 119 V 5.0857 8.6031 126.7311 60.4405 33.8774 174.6729 120 H 5.3096 8.8541 120.7816 53.8668 31.1023 174.3240 121 E 4.2229 9.1821 121.1725 59.0486 29.9844 176.4552 122 K 4.8280 8.3932 116.6150 53.8224 36.7273 175.9216 123 A 4.3639 8.4089 123.4121 52.3808 18.8659 176.1781 124 D 5.0239 9.5168 122.0881 53.5999 41.9152 176.2231 125 D 4.5630 9.3078 125.6230 53.2483 39.6562 176.9041 126 L 3.7679 9.8799 119.6311 56.0754 39.5481 175.9722 127 G 4.2607 8.7383 105.3488 45.6869 0.0000 174.6976 128 K 4.4584 7.8973 117.2366 56.1155 32.0833 177.3481 129 G 3.9645 7.8664 107.1599 44.8714 0.0000 175.2010 130 G 3.8866 8.8391 107.5228 45.6465 0.0000 172.5434 131 N 5.0226 7.6269 115.1166 49.7217 40.9409 174.4402 132 E 4.0370 8.8408 118.0717 59.5073 29.4781 178.1255 133 E 3.9251 8.1538 118.7945 59.2935 29.5705 178.4387 134 S 4.1284 8.7328 113.8750 61.4275 62.4612 175.5454 135 T 4.3064 7.8165 109.9484 62.5178 68.5954 175.6522 136 K 4.3367 7.6966 119.9796 57.7389 34.1375 176.6666 137 T 4.1470 7.8206 105.7920 60.1008 70.0587 174.8923 138 G 3.8899 8.2255 109.7720 45.8929 0.0000 173.6728 139 N 4.2612 7.7931 114.6978 54.0983 36.7168 175.6218 140 A 4.2715 7.0824 117.9492 51.6009 19.4319 180.0484 141 G 4.0246 7.3992 104.2580 44.9937 0.0000 173.6026 142 S 4.4169 8.8398 115.6423 58.5200 64.8602 174.2835 143 R 4.4245 8.3417 119.8118 55.0864 29.9129 176.5094 144 L 4.2992 8.9076 126.0239 57.4409 42.9730 177.2571 145 A 5.1204 7.7364 117.9626 51.3146 22.9336 173.9338 146 C 5.3317 8.6542 113.5552 55.8888 46.8330 172.6870 147 G 4.6840 8.0916 104.1159 46.2159 0.0000 172.4671 148 V 4.5174 8.2341 120.7970 62.0609 32.9057 175.5257 149 I 4.1127 8.8884 129.3230 61.0375 37.9488 175.3162 150 G 4.4373 9.0183 114.5309 43.8695 0.0000 172.0469 151 I 4.2876 8.3383 121.7134 61.1312 37.5996 175.5193 152 A 4.8044 8.4332 128.2452 49.7568 21.8566 176.3821 153 Q 4.0680 8.4995 119.0163 56.4225 29.2167 176.0155 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 A 8.26 4.40 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 2 T 5.79 4.13 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 1.24 0.00 0.00 3 K 8.98 5.38 0.00 1.75 1.71 0.00 1.91 0.00 0.00 1.94 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.64 7.81 4 A 9.11 5.35 1.09 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 5 V 8.87 5.02 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 0.82 0.00 0.00 0.88 0.00 0.00 6 C 9.17 4.97 0.00 3.18 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 7 V 8.47 4.54 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 0.93 0.00 0.00 0.92 0.00 0.00 8 L 8.97 4.93 0.00 1.68 1.58 1.02 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.01 4.84 0.00 1.62 1.62 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.34 1.51 7.81 10 G 7.94 4.32 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 0.00 11 D 8.91 4.51 0.00 2.68 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 G 7.66 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 13 P 0.00 4.50 0.00 2.18 2.16 0.00 3.77 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.94 0.00 14 V 7.53 4.22 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 0.80 0.00 0.00 0.97 0.00 0.00 15 Q 8.53 4.82 0.00 2.32 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.41 0.00 0.00 0.00 0.00 0.00 2.25 2.18 0.00 16 G 8.28 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 0.00 0.00 0.00 0.00 17 I 8.10 5.19 1.81 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.51 0.82 0.00 0.00 18 I 8.82 4.56 1.79 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.26 0.40 0.00 0.00 19 N 8.38 4.95 0.00 1.44 1.45 0.00 0.00 6.48 8.50 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 20 F 9.10 5.48 0.00 2.89 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 21 E 9.58 5.22 0.00 2.47 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 2.31 2.39 0.00 22 Q 9.42 4.83 0.00 2.18 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.59 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 23 K 9.08 4.16 0.00 1.81 1.87 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.46 1.49 7.81 24 E 7.81 4.80 0.00 2.04 1.81 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 2.28 2.32 0.00 25 S 8.60 4.32 0.00 3.98 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 26 N 8.97 4.11 0.00 2.90 2.96 0.00 0.00 7.00 7.65 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 27 G 7.98 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.63 0.00 1.99 2.04 0.00 3.67 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 29 V 8.96 4.63 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 1.32 0.00 0.00 1.03 0.00 0.00 30 K 9.07 4.86 0.00 1.94 1.79 0.00 1.55 0.00 0.00 1.46 0.00 0.00 2.78 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.46 1.46 7.81 31 V 9.25 5.06 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 0.92 0.00 0.00 0.80 0.00 0.00 32 W 7.61 5.73 0.00 3.49 3.19 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 33 G 7.58 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 S 7.84 5.15 0.00 4.02 3.66 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 35 I 8.75 5.04 1.82 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 1.29 0.55 0.94 0.00 0.00 36 K 9.35 4.82 0.00 1.72 1.88 0.00 1.34 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.34 7.81 37 G 8.90 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 7.58 4.40 0.00 1.82 1.43 0.82 0.44 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 39 T 8.14 4.29 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 1.24 0.00 0.00 40 E 8.53 4.17 0.00 1.96 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 2.48 0.00 41 G 8.52 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.23 4.76 0.00 1.51 1.59 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.27 5.03 0.00 3.02 3.29 0.00 5.62 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 44 G 9.10 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 0.00 0.00 0.00 45 F 8.90 5.34 0.00 3.01 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 46 H 8.91 5.18 0.00 3.13 2.98 0.00 5.67 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.58 4.51 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 0.94 0.00 0.00 0.91 0.00 0.00 48 H 9.45 5.04 0.00 3.18 3.38 0.00 5.69 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.79 3.72 0.00 1.70 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 1.47 2.08 0.00 50 F 8.04 4.94 0.00 3.04 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 51 G 8.36 4.32 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 0.00 52 D 7.94 4.75 0.00 2.64 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 53 N 8.83 5.16 0.00 2.69 2.74 0.00 0.00 7.36 7.70 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 54 T 8.49 3.93 4.23 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 1.23 0.00 0.00 55 A 8.16 4.71 1.26 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 0.00 0.00 0.00 56 G 7.90 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 0.00 0.00 0.00 57 C 8.60 4.50 0.00 2.98 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 58 T 7.64 3.87 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 59 S 7.88 4.52 0.00 4.14 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 60 A 7.55 4.58 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 G 8.06 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.75 0.00 2.04 2.22 0.00 3.64 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.01 0.00 63 H 8.38 4.52 0.00 2.82 3.17 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.00 4.25 0.00 2.93 2.90 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 65 N 7.89 4.94 0.00 2.62 2.46 0.00 0.00 6.94 7.71 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 66 P 0.00 4.24 0.00 2.08 2.03 0.00 3.05 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.06 0.00 67 L 7.63 4.23 0.00 1.56 1.69 0.91 0.93 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 68 S 7.45 3.60 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 69 R 8.28 4.55 0.00 1.88 1.93 0.00 3.11 0.00 0.00 3.33 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 70 K 8.93 4.46 0.00 1.64 1.70 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.78 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.37 7.81 71 H 8.56 3.97 0.00 3.27 3.27 0.00 5.97 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 72 G 7.42 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 73 G 9.17 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 74 P 0.00 4.31 0.00 2.23 2.35 0.00 3.79 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.14 0.00 75 K 7.92 4.20 0.00 1.77 1.90 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.47 7.81 76 D 7.77 4.66 0.00 2.76 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 77 E 8.77 3.91 0.00 1.90 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 2.28 2.34 0.00 78 E 7.96 4.24 0.00 2.06 1.81 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 2.33 2.31 0.00 79 R 7.57 4.75 0.00 1.95 1.87 0.00 2.92 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.56 0.00 80 H 9.04 4.55 0.00 3.45 3.36 0.00 5.65 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.23 3.44 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 0.75 0.00 0.00 0.39 0.00 0.00 82 G 8.32 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 83 D 8.08 4.90 0.00 2.67 2.72 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 84 L 8.48 4.44 0.00 1.97 1.96 1.02 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.48 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 86 N 8.66 5.66 0.00 2.60 2.72 0.00 0.00 6.56 7.68 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 87 V 8.74 4.41 1.79 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 -0.15 0.00 0.00 0.78 0.00 0.00 88 T 8.25 5.00 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 89 A 8.95 4.72 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 90 D 8.81 5.06 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 91 K 8.50 4.15 0.00 1.87 1.98 0.00 1.45 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.40 1.52 7.81 92 D 8.70 4.59 0.00 2.78 2.72 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 93 G 8.51 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 0.00 0.00 0.00 0.00 94 V 7.83 4.71 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 1.00 0.00 0.00 0.92 0.00 0.00 95 A 8.90 5.07 1.16 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 0.00 0.00 96 D 8.56 4.79 0.00 2.56 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 97 V 8.64 3.59 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 0.56 0.00 0.00 0.58 0.00 0.00 98 S 8.31 4.61 0.00 3.90 3.72 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 99 I 9.31 4.85 1.96 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 1.15 0.49 1.03 0.00 0.00 100 E 8.77 5.24 0.00 1.95 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 2.22 2.31 0.00 101 D 9.33 4.90 0.00 2.88 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.92 4.71 0.00 3.90 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 0.00 103 V 8.01 3.95 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 0.83 0.00 0.00 0.95 0.00 0.00 104 I 7.87 4.12 1.96 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.82 1.05 0.00 0.00 105 S 8.39 4.62 0.00 3.85 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 0.00 106 L 8.91 4.40 0.00 1.76 1.63 1.03 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.89 4.44 0.00 3.93 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 0.00 108 G 8.48 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 0.00 109 D 8.79 4.48 0.00 2.68 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 0.00 110 H 8.04 5.16 0.00 3.23 3.41 0.00 5.64 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 7.93 4.47 0.00 3.09 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 0.00 112 I 8.13 3.96 1.63 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.28 1.02 0.00 0.00 113 I 7.33 3.71 1.77 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 1.22 0.73 0.83 0.00 0.00 114 G 9.29 3.79 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 0.00 0.00 0.00 115 R 7.48 4.83 0.00 1.62 1.83 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.20 0.00 116 T 7.97 5.00 4.22 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 1.22 0.00 0.00 117 L 8.59 4.77 0.00 1.79 1.50 0.34 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.76 4.90 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.72 0.00 0.00 119 V 8.60 5.09 2.32 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 0.80 0.00 0.00 1.05 0.00 0.00 120 H 8.85 5.31 0.00 3.31 3.55 0.00 5.66 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.18 4.22 0.00 2.12 2.23 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 2.36 2.34 0.00 122 K 8.39 4.83 0.00 1.79 1.66 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.35 1.39 7.81 123 A 8.41 4.36 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 D 9.52 5.02 0.00 2.73 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 0.00 125 D 9.31 4.56 0.00 2.90 2.90 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 0.00 126 L 9.88 3.77 0.00 1.86 1.80 0.94 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.74 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 0.00 0.00 0.00 0.00 128 K 7.90 4.46 0.00 1.89 1.82 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.36 7.81 129 G 7.87 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 G 8.84 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 0.00 131 N 7.63 5.02 0.00 2.76 2.77 0.00 0.00 6.14 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 0.00 132 E 8.84 4.04 0.00 2.05 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 2.37 2.37 0.00 133 E 8.15 3.93 0.00 2.11 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 2.44 2.41 0.00 134 S 8.73 4.13 0.00 4.06 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 0.00 135 T 7.82 4.31 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 1.26 0.00 0.00 136 K 7.70 4.34 0.00 1.80 1.81 0.00 1.67 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.34 1.62 7.81 137 T 7.82 4.15 4.16 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 1.18 0.00 0.00 138 G 8.23 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 0.00 139 N 7.79 4.26 0.00 3.00 2.89 0.00 0.00 6.92 8.31 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 0.00 140 A 7.08 4.27 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 0.00 141 G 7.40 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 0.00 142 S 8.84 4.42 0.00 3.92 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 0.00 143 R 8.34 4.42 0.00 1.68 1.86 0.00 3.19 0.00 0.00 3.18 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.67 0.00 144 L 8.91 4.30 0.00 1.73 1.70 0.99 0.74 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 0.00 145 A 7.74 5.12 1.26 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 0.00 0.00 0.00 146 C 8.65 5.33 0.00 3.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 G 8.09 4.68 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 0.00 0.00 0.00 148 V 8.23 4.52 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 0.80 0.00 0.00 0.95 0.00 0.00 149 I 8.89 4.11 1.78 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.28 0.35 0.00 0.00 150 G 9.02 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 I 8.34 4.29 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.54 0.91 0.00 0.00 152 A 8.43 4.80 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 8.50 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.80 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00