NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3580 8.2649 123.5822 52.6380 20.1092 175.9361 2 T 4.5346 8.2441 114.1417 63.5364 71.2095 173.3983 3 K 5.2928 8.3682 121.4554 54.6421 37.0480 175.0093 4 A 5.3218 9.2736 124.6892 50.8432 23.5199 174.9780 5 V 4.9938 8.7182 117.1937 60.7877 35.4475 173.5077 6 C 4.9364 9.1819 122.1386 57.8993 35.3158 172.6077 7 V 4.6025 8.4262 125.9530 61.3906 33.1766 174.1907 8 L 4.7861 9.1551 129.5045 54.0848 43.0545 176.3452 9 K 4.8879 9.2161 122.3458 55.4490 37.1430 176.2554 10 G 4.0230 7.9421 108.0402 45.4217 0.0000 172.0733 11 D 4.5242 8.8016 118.1028 56.1069 41.8911 177.3829 12 G 4.1050 7.7080 110.8281 44.7280 0.0000 172.0599 13 P 4.5338 0.0000 0.0000 62.7388 32.1360 175.9380 14 V 4.0700 7.5396 120.4249 63.3857 31.8677 175.0665 15 Q 4.8156 8.7907 126.1887 54.4549 33.7916 174.1678 16 G 4.5150 7.8169 107.5611 46.5734 0.0000 171.7433 17 I 5.0442 7.7091 119.9883 59.3534 40.1570 174.9497 18 I 4.5387 8.5835 127.5646 59.4717 39.9462 174.3535 19 N 4.9193 8.4696 124.3714 51.3641 40.9549 173.9521 20 F 5.3553 9.0831 120.5243 55.8626 43.1875 173.9103 21 E 5.2161 9.4937 122.6612 55.0309 33.4486 173.5145 22 Q 4.8643 9.3669 128.2758 54.4007 30.5383 175.0906 23 K 4.1963 9.0206 127.2266 58.4636 32.8159 177.6591 24 E 4.7002 7.8394 117.3949 53.7599 32.0200 175.2301 25 S 4.1579 8.7383 117.0021 60.2016 62.6117 173.4342 26 N 4.0900 8.9988 123.1318 54.1344 37.6610 173.9616 27 G 3.9917 8.1332 105.9229 44.3858 0.0000 171.5918 28 P 4.5919 0.0000 0.0000 62.2201 32.1611 176.4558 29 V 4.5494 8.9362 124.3936 61.4137 33.4846 174.7756 30 K 4.9057 9.2153 128.4518 55.9221 33.7660 176.0706 31 V 4.8971 9.2902 124.8633 60.8711 34.3085 174.2021 32 W 6.0262 7.9410 124.0523 55.0815 31.9752 175.6571 33 G 3.9009 7.5015 105.9080 45.7190 0.0000 170.6005 34 S 5.1027 7.8269 112.9714 56.5296 66.4245 174.0422 35 I 5.0697 8.7543 126.6744 59.4193 40.2986 175.0058 36 K 4.7483 9.2594 126.6678 55.7908 35.6915 177.2288 37 G 3.7457 8.8656 107.0763 45.5769 0.0000 172.9530 38 L 4.5520 7.5829 120.2253 52.4950 43.1220 176.4853 39 T 4.1718 8.3785 113.4352 61.2557 69.2838 173.6395 40 E 4.1041 8.6927 124.7425 57.3247 30.4523 175.2938 41 G 3.7568 8.4271 111.1283 43.9209 0.0000 172.3793 42 L 4.7765 8.1991 119.3771 54.9607 42.8132 176.6922 43 H 5.0456 9.2963 119.5813 53.8178 33.1731 173.3097 44 G 4.0661 9.3320 111.5244 46.7355 0.0000 172.4334 45 F 5.4618 8.8215 124.9907 56.9424 42.3699 172.9715 46 H 5.1527 8.8340 122.7045 54.0165 33.8328 172.8615 47 V 4.3710 8.5428 121.4229 62.5415 32.6352 175.3227 48 H 5.0929 9.3457 125.8126 54.7602 30.4637 176.2455 49 E 3.6003 8.8559 121.6594 58.8660 29.9582 176.9964 50 F 4.8772 8.1654 118.7216 54.8393 41.2343 177.1947 51 G 4.5348 8.3606 114.0280 44.4849 0.0000 174.1941 52 D 4.7552 7.8939 117.5898 52.7034 42.5222 174.3156 53 N 5.1262 8.5352 125.6208 53.5217 39.2920 175.7908 54 T 3.9797 8.6843 109.7173 63.0570 69.7320 174.4762 55 A 4.7042 8.0968 124.8449 51.4766 19.2173 175.3767 56 G 3.8577 7.6843 115.7732 46.5609 0.0000 173.5612 57 C 4.0710 8.4496 116.0737 61.7820 28.6234 175.7979 58 T 4.0058 7.7272 117.7624 66.1196 67.7158 175.8047 59 S 4.4564 7.4202 113.2548 59.2147 63.6557 175.4678 60 A 4.6659 7.4456 126.1855 54.3561 18.3331 178.6790 61 G 4.2110 8.0219 105.5748 44.4776 0.0000 170.9565 62 P 4.7074 0.0000 0.0000 61.9112 33.7606 175.2642 63 H 4.4325 8.4120 116.6273 55.8138 29.3962 175.5905 64 F 4.2953 9.2166 125.7282 58.0703 40.3243 175.1599 65 N 4.6807 7.8411 125.8170 51.6902 38.9374 173.0632 66 P 4.1839 0.0000 0.0000 65.1027 32.1041 177.9229 67 L 4.1612 7.5888 116.6546 53.9553 42.3997 175.8754 68 S 3.5659 7.5084 112.3757 59.7110 60.8349 170.5224 69 R 4.6453 8.1652 118.0991 53.9767 33.2656 176.4815 70 K 4.3562 9.0848 118.6558 56.2832 33.3318 176.7038 71 H 3.9700 8.6950 123.0008 56.8625 30.5605 174.8062 72 G 4.1220 7.9423 109.6793 45.4493 0.0000 172.2932 73 G 4.0810 9.2045 109.7271 43.7114 0.0000 173.2490 74 P 4.3774 0.0000 0.0000 64.9596 31.2838 177.8381 75 K 4.4105 7.8227 114.4453 56.1448 32.5935 176.2618 76 D 4.5934 7.6695 119.7816 53.6181 41.5818 176.2550 77 E 3.9679 8.8820 123.7739 58.7538 29.8796 176.6257 78 E 4.5011 7.8092 118.9138 54.4329 30.7183 174.6684 79 R 4.7125 7.7574 119.9596 56.1646 32.1659 174.0711 80 H 4.4183 8.8907 116.7373 55.4732 29.3233 176.8665 81 V 3.4851 8.3092 123.4396 66.3325 31.5853 177.0587 82 G 3.8534 8.6841 105.9906 47.3938 0.0000 173.4985 83 D 4.9821 8.1931 120.9753 54.1103 40.0825 175.6409 84 L 4.5145 8.3373 120.8543 53.1819 42.5747 178.4165 85 G 4.0443 8.4452 108.8173 46.5388 0.0000 174.0339 86 N 5.5718 8.6515 120.5804 51.4133 42.0742 173.5915 87 V 4.3415 8.7525 114.8916 60.0716 35.2122 174.8424 88 T 4.9872 8.1807 118.1636 61.8773 71.1187 173.1847 89 A 4.7631 9.1556 129.6316 51.0050 20.9467 177.3440 90 D 4.6391 9.0286 121.9786 52.2563 41.7318 176.7569 91 K 4.2111 8.5415 118.6685 59.2011 32.3310 177.6180 92 D 4.6493 8.7029 117.6842 53.8537 40.8949 176.0420 93 A 4.5011 7.9113 119.9714 53.0313 16.6853 177.4564 94 V 4.8733 7.9146 118.0339 62.5495 34.8083 173.9034 95 A 5.2128 8.8792 129.7939 49.5872 20.9149 175.2402 96 D 4.8523 8.6562 123.2014 54.1359 42.0398 176.2431 97 V 4.1069 9.0567 125.0693 61.4134 33.4850 174.8807 98 S 4.9887 8.4750 122.6243 57.4065 64.3593 172.7042 99 I 4.8692 9.1490 127.9305 59.4679 41.6928 174.2280 100 E 5.2460 8.7545 124.7302 54.6703 32.6530 174.1788 101 D 4.8422 9.2692 125.2221 53.0228 44.9284 175.5060 102 S 4.7039 8.8668 119.2079 58.4738 64.0326 175.9541 103 V 3.8297 8.1007 121.1966 65.0384 31.7602 176.4447 104 I 4.0945 7.8176 111.4779 61.1735 38.2865 174.4375 105 S 4.6220 8.3785 114.1973 57.8109 65.3452 174.0410 106 L 4.5028 8.8121 122.3116 54.2442 41.4870 176.5483 107 S 4.5105 7.9070 113.2913 58.5437 67.7236 175.6696 108 G 3.8498 8.5317 108.8911 45.1759 0.0000 173.7289 109 D 4.5157 8.6476 117.3381 56.9383 41.2421 176.7130 110 H 5.1304 8.0637 115.4198 55.5320 29.0779 173.8784 111 C 4.4602 7.8512 120.6930 59.7291 31.7817 173.4369 112 I 3.9517 8.2380 119.2279 60.4106 38.0080 175.6258 113 I 3.7079 7.2469 123.1370 63.0085 37.4069 176.2877 114 G 3.8233 9.4910 113.8688 45.0962 0.0000 172.7829 115 R 4.9717 7.4847 119.0336 54.7332 33.8232 174.3913 116 T 5.0050 7.9603 115.3369 62.0782 71.2048 173.7611 117 L 4.6880 8.7276 129.1880 54.3288 43.8732 175.4836 118 V 4.9726 8.7397 125.7253 61.0552 35.1336 174.1193 119 V 5.0298 8.5522 127.3367 60.6554 33.5946 175.2193 120 H 5.2204 9.3808 122.0095 54.2104 30.4541 174.8702 121 E 4.2245 9.2911 121.3041 58.8410 30.1616 176.1223 122 K 4.8294 8.3719 117.0787 53.8356 37.3273 175.4030 123 A 4.5595 8.3539 122.4025 52.0671 19.4689 176.5130 124 D 4.6210 9.6854 123.6909 54.0411 41.8284 175.8205 125 D 4.6075 9.4531 125.0828 53.0796 39.7585 176.9014 126 L 3.7266 9.9064 118.9986 56.0318 39.6317 175.8912 127 G 4.3925 8.7469 104.8226 46.1108 0.0000 174.8061 128 K 4.4662 8.0298 117.5449 55.9305 32.2120 178.2759 129 G 3.6667 7.8770 108.5409 45.5755 0.0000 174.6631 130 G 3.9182 7.8223 107.6754 46.1478 0.0000 173.0085 131 N 5.0528 7.8083 114.6157 50.4019 40.7341 173.7678 132 E 4.0367 8.8306 119.0992 59.3611 29.9993 178.5452 133 E 3.9361 8.2086 118.7016 59.2033 29.7518 178.3767 134 S 4.0973 8.3895 113.6282 61.4239 62.3671 175.5040 135 T 4.3279 7.7825 110.2229 62.4016 68.6161 175.3724 136 K 4.3039 7.6982 119.3191 58.0202 34.3964 177.3237 137 T 4.2559 8.0035 107.2431 60.2471 69.8510 175.3311 138 G 3.7098 7.8725 109.7262 45.3555 0.0000 173.4492 139 N 4.2920 7.9276 114.3392 53.9541 36.9191 175.7298 140 A 4.1758 7.0476 119.0927 51.8548 19.4768 180.0095 141 G 3.9585 7.4014 104.5011 45.6094 0.0000 174.0425 142 S 4.3647 8.5690 117.9462 58.7970 64.4460 174.2420 143 R 4.3945 8.3816 121.5449 55.5641 29.8189 176.4108 144 L 4.3505 8.8953 125.5730 57.2571 43.1432 177.0243 145 A 4.9155 7.7457 117.8010 51.4116 22.7217 174.8531 146 C 4.9901 9.1618 114.2348 57.9525 33.7390 172.7575 147 G 4.6147 8.4474 103.9363 45.9998 0.0000 172.9025 148 V 4.3163 8.3181 122.2963 62.4333 32.7784 175.4302 149 I 4.2018 8.9358 129.5174 60.7080 38.1561 175.1821 150 G 4.4166 8.7658 114.3229 43.8124 0.0000 172.2170 151 I 4.1970 8.3988 122.2395 61.3355 37.6021 175.3996 152 A 4.8103 8.9452 128.2317 49.7712 22.0260 176.3289 153 Q 4.0713 8.4952 118.7978 56.4288 29.2254 175.9279 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 4.36 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 2 T 8.24 4.53 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 1.33 0.00 0.00 3 K 8.37 5.29 0.00 1.71 1.71 0.00 1.72 0.00 0.00 1.89 0.00 0.00 2.93 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.57 1.51 7.81 4 A 9.27 5.32 1.10 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 5 V 8.72 4.99 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 0.61 0.00 0.00 0.88 0.00 0.00 6 C 9.18 4.94 0.00 3.16 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 7 V 8.43 4.60 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 0.94 0.00 0.00 0.92 0.00 0.00 8 L 9.16 4.79 0.00 1.79 1.60 1.04 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.22 4.89 0.00 1.63 1.62 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.38 7.81 10 G 7.94 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 11 D 8.80 4.52 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 7.71 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 13 P 0.00 4.53 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 1.93 1.94 0.00 14 V 7.54 4.07 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 0.84 0.00 0.00 0.95 0.00 0.00 15 Q 8.79 4.82 0.00 2.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.54 0.00 0.00 0.00 0.00 0.00 2.27 2.53 0.00 16 G 7.82 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.71 5.04 1.82 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 1.32 1.51 0.83 0.00 0.00 18 I 8.58 4.54 1.85 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 1.27 1.20 0.42 0.00 0.00 19 N 8.47 4.92 0.00 1.44 1.42 0.00 0.00 6.42 8.43 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 20 F 9.08 5.36 0.00 2.87 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 21 E 9.49 5.22 0.00 2.49 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 2.33 2.41 0.00 22 Q 9.37 4.86 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.75 0.00 0.00 0.00 0.00 0.00 2.48 2.53 0.00 23 K 9.02 4.20 0.00 1.81 1.87 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.47 1.49 7.81 24 E 7.84 4.70 0.00 1.98 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.20 0.00 25 S 8.74 4.16 0.00 3.83 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 26 N 9.00 4.09 0.00 2.86 2.86 0.00 0.00 7.11 7.98 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 27 G 8.13 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 28 P 0.00 4.59 0.00 1.99 2.14 0.00 3.74 0.00 0.00 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.95 0.00 29 V 8.94 4.55 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 1.25 0.00 0.00 1.08 0.00 0.00 30 K 9.22 4.91 0.00 1.94 1.84 0.00 1.61 0.00 0.00 1.41 0.00 0.00 2.72 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.45 1.43 7.81 31 V 9.29 4.90 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 0.80 0.00 0.00 1.08 0.00 0.00 32 W 7.94 6.03 0.00 3.46 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 33 G 7.50 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 S 7.83 5.10 0.00 3.85 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 35 I 8.75 5.07 1.80 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.46 0.90 0.00 0.00 36 K 9.26 4.75 0.00 1.77 1.90 0.00 1.33 0.00 0.00 1.64 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.35 7.81 37 G 8.87 3.75 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 0.00 0.00 0.00 38 L 7.58 4.55 0.00 1.69 1.46 0.82 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.38 4.17 4.27 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 1.24 0.00 0.00 40 E 8.69 4.10 0.00 2.06 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 2.30 2.48 0.00 41 G 8.43 3.76 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 0.00 42 L 8.20 4.78 0.00 1.50 1.59 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.30 5.05 0.00 3.00 3.26 0.00 5.63 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 9.33 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 0.00 0.00 0.00 45 F 8.82 5.46 0.00 2.99 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 46 H 8.83 5.15 0.00 3.09 2.98 0.00 5.85 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 47 V 8.54 4.37 2.12 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 0.91 0.00 0.00 0.89 0.00 0.00 48 H 9.35 5.09 0.00 3.05 3.46 0.00 5.67 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.86 3.60 0.00 1.72 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 8.17 4.88 0.00 3.18 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 51 G 8.36 4.53 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 52 D 7.89 4.76 0.00 2.61 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 53 N 8.54 5.13 0.00 2.69 2.74 0.00 0.00 7.27 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 8.68 3.98 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 1.25 0.00 0.00 55 A 8.10 4.70 1.24 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 56 G 7.68 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 57 C 8.45 4.07 0.00 2.97 2.92 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 58 T 7.73 4.01 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 1.22 0.00 0.00 59 S 7.42 4.46 0.00 3.92 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 60 A 7.45 4.67 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 61 G 8.02 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 4.71 0.00 2.06 2.19 0.00 3.69 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.03 0.00 63 H 8.41 4.43 0.00 2.90 3.21 0.00 5.72 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 64 F 9.22 4.30 0.00 2.94 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 65 N 7.84 4.68 0.00 2.58 2.42 0.00 0.00 6.93 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 4.18 0.00 2.07 2.04 0.00 3.14 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 1.47 0.99 0.00 67 L 7.59 4.16 0.00 1.55 1.69 0.91 0.86 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 68 S 7.51 3.57 0.00 3.97 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 69 R 8.17 4.65 0.00 1.78 1.94 0.00 3.17 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.70 0.00 70 K 9.08 4.36 0.00 1.64 1.70 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.50 7.81 71 H 8.70 3.97 0.00 3.17 3.26 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 7.94 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 73 G 9.20 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 0.00 0.00 0.00 74 P 0.00 4.38 0.00 2.08 2.18 0.00 3.68 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.28 0.00 75 K 7.82 4.41 0.00 1.74 1.84 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.39 7.81 76 D 7.67 4.59 0.00 2.81 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 77 E 8.88 3.97 0.00 1.92 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 2.29 0.00 78 E 7.81 4.50 0.00 1.93 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 2.33 2.24 0.00 79 R 7.76 4.71 0.00 1.96 1.77 0.00 2.71 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 1.61 1.60 0.00 80 H 8.89 4.42 0.00 3.55 3.37 0.00 5.65 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.31 3.49 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.38 0.00 0.00 82 G 8.68 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 D 8.19 4.98 0.00 2.68 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 84 L 8.34 4.51 0.00 1.86 1.88 0.96 0.98 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 85 G 8.45 4.04 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 0.00 86 N 8.65 5.57 0.00 2.59 2.70 0.00 0.00 6.64 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 8.75 4.34 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 -0.07 0.00 0.00 0.78 0.00 0.00 88 T 8.18 4.99 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 9.16 4.76 1.29 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 90 D 9.03 4.64 0.00 2.87 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 8.54 4.21 0.00 1.74 1.88 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.42 1.46 7.81 92 D 8.70 4.65 0.00 2.79 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 93 A 7.91 4.50 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 94 V 7.91 4.87 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 1.03 0.00 0.00 0.95 0.00 0.00 95 A 8.88 5.21 1.15 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 96 D 8.66 4.85 0.00 2.56 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 97 V 9.06 4.11 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 0.69 0.00 0.00 0.63 0.00 0.00 98 S 8.48 4.99 0.00 3.88 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 99 I 9.15 4.87 1.98 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.51 1.02 0.00 0.00 100 E 8.75 5.25 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 2.32 0.00 101 D 9.27 4.84 0.00 2.88 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 8.87 4.70 0.00 3.92 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 V 8.10 3.83 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 0.84 0.00 0.00 0.95 0.00 0.00 104 I 7.82 4.09 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 1.49 0.81 1.03 0.00 0.00 105 S 8.38 4.62 0.00 3.83 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.81 4.50 0.00 1.92 1.63 1.00 0.97 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 7.91 4.51 0.00 3.85 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 0.00 108 G 8.53 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 D 8.65 4.52 0.00 2.70 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 8.06 5.13 0.00 3.23 3.41 0.00 5.64 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 0.00 111 C 7.85 4.46 0.00 3.20 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 0.00 112 I 8.24 3.95 1.64 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.24 0.92 0.00 0.00 113 I 7.25 3.71 1.77 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.73 0.87 0.00 0.00 114 G 9.49 3.82 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 0.00 0.00 0.00 115 R 7.48 4.97 0.00 1.58 1.89 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 1.28 1.30 0.00 116 T 7.96 5.01 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 1.20 0.00 0.00 117 L 8.73 4.69 0.00 1.78 1.53 0.32 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.74 4.97 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 0.79 0.00 0.00 0.74 0.00 0.00 119 V 8.55 5.03 2.33 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 0.78 0.00 0.00 1.00 0.00 0.00 120 H 9.38 5.22 0.00 3.11 3.62 0.00 5.66 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.29 4.22 0.00 2.01 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 2.37 2.34 0.00 122 K 8.37 4.83 0.00 1.78 1.68 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.39 7.81 123 A 8.35 4.56 1.24 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 0.00 124 D 9.69 4.62 0.00 2.77 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 0.00 125 D 9.45 4.61 0.00 2.91 2.89 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 0.00 126 L 9.91 3.73 0.00 1.85 1.78 0.94 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.75 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.03 4.47 0.00 1.81 1.81 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.55 1.50 7.81 129 G 7.88 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.82 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 0.00 131 N 7.81 5.05 0.00 2.76 2.75 0.00 0.00 6.18 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 8.83 4.04 0.00 2.02 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 2.38 2.30 0.00 133 E 8.21 3.94 0.00 2.11 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 2.43 2.42 0.00 134 S 8.39 4.10 0.00 4.12 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 0.00 135 T 7.78 4.33 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 1.25 0.00 0.00 136 K 7.70 4.30 0.00 1.80 1.82 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.34 1.56 7.81 137 T 8.00 4.26 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 1.14 0.00 0.00 138 G 7.87 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 0.00 139 N 7.93 4.29 0.00 2.88 2.88 0.00 0.00 6.91 8.89 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 0.00 140 A 7.05 4.18 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 0.00 141 G 7.40 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 0.00 142 S 8.57 4.36 0.00 3.97 3.82 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 0.00 143 R 8.38 4.39 0.00 1.65 1.78 0.00 3.22 0.00 0.00 3.15 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.63 0.00 144 L 8.90 4.35 0.00 1.61 1.70 0.93 0.35 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 0.00 145 A 7.75 4.92 1.24 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 0.00 146 C 9.16 4.99 0.00 2.99 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 0.00 147 G 8.45 4.61 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 0.00 148 V 8.32 4.32 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 0.76 0.00 0.00 0.95 0.00 0.00 149 I 8.94 4.20 1.78 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.40 0.35 0.00 0.00 150 G 8.77 4.42 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 0.00 151 I 8.40 4.20 1.86 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 1.24 0.54 0.91 0.00 0.00 152 A 8.95 4.81 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 0.00 153 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 6.78 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00