NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 G 3.9499 8.1976 109.7345 45.4848 0.0000 173.8339 0 S 4.1017 8.5094 112.4345 57.7253 63.4250 172.4393 1 M 4.7593 7.7378 120.2547 52.9443 34.5703 176.0142 2 A 4.0409 8.5801 123.4200 52.2722 19.6402 176.1661 3 L 4.9905 8.1210 121.1963 52.8332 45.2193 175.9857 4 F 5.0030 9.1806 121.1739 55.1476 42.7054 174.8768 5 S 4.6841 9.0083 117.2198 58.9889 62.8485 173.6734 6 A 4.7150 9.1744 124.3232 52.8016 20.8144 176.8054 7 Q 4.4599 7.9881 113.8755 54.3678 32.1073 174.1762 8 S 4.2435 8.5550 120.1185 58.3793 63.4712 172.6480 9 P 4.6941 0.0000 0.0000 63.0748 32.5425 175.2986 10 Y 4.6716 8.7220 119.4293 57.3127 38.9858 174.5942 11 I 4.6620 8.5126 125.6179 60.3725 38.8757 176.0958 12 N 4.4673 8.9252 124.3130 52.4721 36.5635 173.2142 13 P 4.2488 0.0000 0.0000 62.5692 32.4406 176.4429 14 I 4.0252 8.1907 122.5305 60.8769 37.8657 175.4908 15 I 4.3200 8.1504 126.5577 59.6539 38.0766 173.7723 16 P 4.7327 0.0000 0.0000 62.7563 32.2387 175.2538 17 F 4.9912 9.3234 125.6366 56.7521 42.3126 174.0767 18 T 4.6034 7.2781 120.6489 61.8376 72.1049 173.2250 19 G 3.8823 8.1589 111.4209 44.1581 0.0000 170.7129 20 P 4.9383 0.0000 0.0000 62.9525 32.4810 176.5031 21 I 4.2512 8.6641 124.0199 59.5752 37.9825 174.9101 22 Q 4.0612 8.7865 127.3705 57.2583 28.6958 177.7634 23 G 3.8537 8.8448 111.7049 44.8701 0.0000 174.2766 24 G 4.5698 8.0941 103.7185 44.7911 0.0000 173.6210 25 L 4.2765 8.4376 118.9483 55.1917 42.4946 176.7550 26 Q 4.8230 8.3059 119.3886 53.5389 32.6881 174.4606 27 E 3.8761 8.8469 121.3775 57.9664 29.9167 177.5165 28 G 3.9759 9.1091 114.8898 44.9869 0.0000 173.3333 29 L 4.4063 7.7835 122.9750 55.1706 43.5691 175.6109 30 Q 5.0928 9.4492 124.9212 54.2798 31.8972 174.5631 31 V 4.6378 9.1729 125.7417 61.7382 33.4370 174.4205 32 T 5.1810 8.9165 125.6246 61.7846 71.4270 173.2737 33 L 5.0394 9.3839 126.6044 53.1061 44.2208 175.0313 34 Q 4.4556 8.2115 125.9515 54.4797 31.0623 174.7323 35 G 3.2885 7.1006 112.7565 45.9510 0.0000 171.1993 36 T 5.0852 7.9809 115.6008 61.9289 72.9816 173.9628 37 T 4.4872 8.8505 123.3241 63.0810 69.5820 174.6829 38 K 4.2223 8.4508 125.7838 56.6438 32.3524 177.6817 39 S 3.9501 8.7399 118.4412 60.5729 62.9840 174.4482 40 F 4.4591 8.0798 117.8901 55.4728 40.1812 174.0478 41 A 4.7042 8.1277 128.0197 50.3727 21.7063 174.5494 42 Q 4.6806 8.6892 119.5758 57.2532 31.1414 175.7262 43 R 5.2346 7.7221 115.9906 54.9820 35.1789 173.5691 44 F 5.4270 8.3501 115.1005 55.4001 42.3358 173.4500 45 V 4.8033 9.1168 118.7409 61.1468 35.0351 174.0890 46 V 4.7835 8.9682 127.4960 61.1966 34.0939 173.6394 47 N 5.2748 9.0120 125.8223 51.4547 41.5971 173.6270 48 F 5.0443 9.1305 123.3974 56.0246 40.6530 174.9413 49 Q 4.9548 9.2019 121.6072 54.4974 32.8409 173.8153 50 N 5.0065 9.0995 119.8214 53.2507 39.3538 175.5042 51 S 4.2727 9.1991 119.9452 57.2990 63.3685 169.8499 52 F 4.3574 8.5457 113.9960 59.4068 37.9446 176.4705 53 N 3.8161 7.0017 119.0757 54.7915 38.1756 176.4669 54 G 3.9019 8.0066 103.6091 45.2590 0.0000 173.6586 55 N 4.3260 7.6964 117.1364 55.1005 40.1459 173.9525 56 D 5.0633 7.9656 117.6065 52.5219 44.0872 175.0093 57 I 4.7406 8.3622 125.6050 59.2618 38.8212 176.5601 58 A 4.3030 8.9024 130.6658 54.6851 19.1766 177.5869 59 F 5.0892 8.3410 118.3820 57.4846 42.8071 172.6421 60 H 5.1932 9.9347 127.6436 54.4252 31.9466 172.7085 61 F 4.8006 8.7731 128.8077 56.4816 41.8102 173.6289 62 N 5.1591 8.1563 124.7451 49.7477 40.2977 170.4865 63 P 4.0894 0.0000 0.0000 61.8625 33.0664 175.1680 64 R 4.4408 8.1682 122.6670 53.5402 33.2394 176.2399 65 F 4.8214 8.7050 128.3342 56.6480 36.8678 175.4498 66 E 4.7535 7.2765 118.0767 55.5245 34.0155 175.6545 67 E 3.9517 10.1056 117.5944 57.5443 27.1021 176.0051 68 G 3.9120 8.1833 107.5314 44.4654 0.0000 174.9590 69 G 3.8476 9.6293 108.1028 46.0821 0.0000 172.2536 70 Y 5.0238 8.0401 120.7126 56.3049 42.2046 173.3963 71 V 4.3518 8.7080 119.4563 60.9796 34.6910 174.1618 72 V 4.5353 8.1499 128.1942 61.9579 33.1681 174.1564 73 C 5.3407 8.9729 125.6463 58.3216 31.2757 172.5722 74 N 5.5905 8.6944 120.1800 54.2070 43.1520 172.6432 75 T 5.4406 8.9176 115.9430 61.6136 73.0032 173.0617 76 K 4.8544 9.2990 126.2535 54.6167 35.0789 174.6710 77 Q 4.7758 8.6991 125.9501 54.5270 32.1807 175.4828 78 N 4.1626 10.6125 122.6407 54.2682 36.7827 175.6654 79 G 3.7700 8.3363 105.7624 45.2802 0.0000 174.0352 80 Q 4.5130 7.9022 120.0283 53.5929 30.5073 175.0377 81 W 4.8506 8.6222 122.9827 57.0122 30.0538 176.8561 82 G 4.3440 8.8491 111.5145 44.6718 0.0000 170.6653 83 P 4.6485 0.0000 0.0000 62.7351 31.7963 176.4797 84 E 4.4568 8.9281 123.9276 56.3094 30.7746 176.1296 85 E 4.6472 9.2708 122.6451 54.9604 31.9677 175.1824 86 R 5.0281 8.6171 124.3514 54.3538 32.1380 175.7336 87 K 4.2273 8.8776 126.6483 54.7298 33.3974 177.1754 88 M 4.7504 8.1606 131.7007 53.3377 30.8624 175.4162 89 Q 4.5166 7.4238 118.0295 55.0310 32.6620 173.1657 90 M 4.3924 8.4320 123.2601 53.2125 33.0501 173.4767 91 P 4.2536 0.0000 0.0000 63.0724 32.1360 176.0591 92 F 4.8333 7.4807 117.7200 56.1114 41.0129 174.8505 93 Q 4.8234 8.4558 121.8848 53.5507 31.3244 175.5097 94 K 3.8969 8.6284 121.8340 58.0305 32.4045 177.4426 95 G 3.8483 8.3608 110.8627 45.8308 0.0000 172.9371 96 M 4.8161 7.5812 119.1013 52.4429 35.1082 173.9832 97 P 4.8756 0.0000 0.0000 62.9955 32.5388 175.4674 98 F 5.2797 8.6931 116.3390 55.5238 42.2323 172.6061 99 E 5.1431 9.5704 120.6925 54.3527 32.4493 174.2178 100 L 5.1481 9.4320 129.0735 53.4780 45.1053 174.3256 101 C 5.2138 9.0137 127.4080 57.5709 34.5350 172.2926 102 F 5.1842 9.4512 125.6073 55.8907 40.8232 174.2641 103 L 5.0588 9.2200 127.2724 53.3660 44.2294 175.2678 104 V 3.8971 8.7885 127.5567 62.1725 32.3730 175.2858 105 Q 4.7966 8.4681 127.0289 53.5202 31.5243 176.8464 106 R 3.9572 8.6371 119.0993 58.9886 30.2826 177.1344 107 S 4.7613 7.8704 110.2164 58.2183 64.6809 172.7275 108 E 4.7766 7.4011 117.7299 55.2975 33.1007 174.4034 109 F 4.9457 9.0311 120.2211 57.0938 40.8658 174.8111 110 K 5.0685 9.2037 121.9897 54.6867 35.0595 175.1933 111 V 4.7248 8.9104 124.9150 61.3915 34.0417 173.9291 112 M 5.0578 8.8688 127.9554 53.6132 34.7518 175.0815 113 V 4.5227 8.5006 123.0068 61.4014 34.5100 175.3038 114 N 4.2115 10.0298 126.3073 54.5433 36.5689 175.1945 115 K 4.0296 8.4542 112.8790 56.6096 29.8688 176.0767 116 K 4.6720 7.6711 118.8460 53.8870 34.6008 175.5764 117 F 4.4230 8.9840 125.1882 59.0061 39.8813 172.9964 118 F 4.8161 8.3796 129.2133 59.1365 40.8612 175.4652 119 V 4.2356 6.6835 116.3767 60.0344 34.6569 172.7427 120 Q 5.3256 8.7027 119.5930 54.9945 31.5324 174.5781 121 Y 4.5603 8.8714 121.7323 56.0418 41.8308 174.2154 122 Q 4.2170 8.2795 126.5178 55.8334 29.6119 176.4043 123 H 4.3765 8.4212 121.5470 56.5258 29.0648 175.7019 124 R 4.4263 8.7679 122.7509 56.8457 31.1384 176.5695 125 V 4.6130 7.4799 108.7826 58.3701 35.4474 173.2442 126 P 4.1686 0.0000 0.0000 62.8530 31.7486 177.5588 127 Y 4.3638 7.7892 120.8554 59.6558 38.3740 177.1054 128 H 4.7035 7.4001 118.5036 57.7782 30.0922 175.6956 129 L 4.0971 7.3767 116.7747 56.4546 41.9743 176.9415 130 V 4.1669 8.0203 120.7729 62.7404 32.2073 175.5164 131 D 5.2893 8.9035 126.4628 53.2130 41.1958 175.2586 132 T 5.1364 7.8918 115.3794 62.3986 73.2259 172.2749 133 I 4.7452 8.9400 126.1089 59.0993 41.0016 173.9757 134 A 5.1444 8.7394 129.8013 50.1125 22.2083 174.8859 135 V 5.0000 9.3121 122.9109 61.1293 34.6484 174.6451 136 S 4.7750 9.3087 121.1156 57.4580 66.9130 172.6600 137 G 4.0296 8.8061 104.1844 44.6306 0.0000 174.0446 138 C 4.6790 8.5622 113.8892 57.8650 26.1519 172.3740 139 L 5.0201 7.2687 118.9071 54.4539 43.8498 176.3925 140 K 4.7189 8.8241 117.9087 55.0193 36.3649 174.9274 141 L 4.9028 8.1049 120.2887 53.0817 44.7006 177.6506 142 S 4.2936 8.8232 118.7784 60.9389 64.6557 173.7544 143 F 5.2573 6.9695 112.5965 56.1029 41.0258 172.9943 144 I 5.2459 9.0195 120.7495 59.8520 40.0964 175.0441 145 T 4.7940 8.8703 117.2210 59.8071 72.2627 173.4099 146 F 5.2976 8.5932 120.5271 56.0955 42.2314 174.1299 147 Q 5.2044 9.4244 122.2278 54.6485 33.5937 174.1240 148 T 4.9985 9.0732 117.0645 60.9151 71.6922 174.6543 149 Q 4.8280 8.6465 122.3035 54.9019 28.2514 177.0654 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 G 8.20 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0 S 8.51 4.10 0.00 4.08 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 1 M 7.74 4.76 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.48 0.00 2 A 8.58 4.04 1.18 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 0.00 0.00 3 L 8.12 4.99 0.00 1.39 1.51 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 4 F 9.18 5.00 0.00 2.92 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 5 S 9.01 4.68 0.00 3.92 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 6 A 9.17 4.71 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 7 Q 7.99 4.46 0.00 1.78 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.87 0.00 0.00 0.00 0.00 0.00 1.89 2.29 0.00 8 S 8.56 4.24 0.00 3.83 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 9 P 0.00 4.69 0.00 2.02 1.92 0.00 3.72 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.88 0.00 10 Y 8.72 4.67 0.00 2.95 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 11 I 8.51 4.66 1.92 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 1.38 0.56 0.97 0.00 0.00 12 N 8.93 4.47 0.00 2.75 2.78 0.00 0.00 6.98 7.60 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 13 P 0.00 4.25 0.00 1.27 1.14 0.00 3.81 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.60 0.00 14 I 8.19 4.03 1.92 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 1.42 0.56 0.93 0.00 0.00 15 I 8.15 4.32 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.88 0.92 0.00 0.00 16 P 0.00 4.73 0.00 2.08 2.07 0.00 3.73 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 1.99 1.97 0.00 17 F 9.32 4.99 0.00 3.22 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 T 7.28 4.60 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 1.12 0.00 0.00 19 G 8.16 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 20 P 0.00 4.94 0.00 2.14 2.11 0.00 3.89 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.08 0.00 21 I 8.66 4.25 2.01 0.00 0.00 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 1.60 0.91 1.04 0.00 0.00 22 Q 8.79 4.06 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.58 0.00 0.00 0.00 0.00 0.00 2.38 2.25 0.00 23 G 8.84 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 24 G 8.09 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 L 8.44 4.28 0.00 2.25 1.71 1.24 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.31 4.82 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 7.06 0.00 0.00 0.00 0.00 0.00 2.64 2.34 0.00 27 E 8.85 3.88 0.00 2.05 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 2.28 2.30 0.00 28 G 9.11 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 L 7.78 4.41 0.00 1.94 1.67 1.17 0.95 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 30 Q 9.45 5.09 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.55 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 31 V 9.17 4.64 2.49 0.00 0.00 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 1.32 0.00 0.00 32 T 8.92 5.18 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 1.32 0.00 0.00 33 L 9.38 5.04 0.00 1.80 1.74 1.14 0.82 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 34 Q 8.21 4.46 0.00 1.18 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.44 0.00 0.00 0.00 0.00 0.00 1.43 1.74 0.00 35 G 7.10 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 0.00 0.00 0.00 36 T 7.98 5.09 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 1.19 0.00 0.00 37 T 8.85 4.49 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 1.13 0.00 0.00 38 K 8.45 4.22 0.00 1.60 1.74 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.49 7.81 39 S 8.74 3.95 0.00 3.84 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 40 F 8.08 4.46 0.00 2.91 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 41 A 8.13 4.70 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 Q 8.69 4.68 0.00 2.01 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.71 0.00 0.00 0.00 0.00 0.00 2.39 2.33 0.00 43 R 7.72 5.23 0.00 1.70 1.78 0.00 3.01 0.00 0.00 3.25 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 44 F 8.35 5.43 0.00 3.16 3.11 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 0.00 0.00 0.00 45 V 9.12 4.80 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.98 0.00 0.00 46 V 8.97 4.78 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 1.16 0.00 0.00 47 N 9.01 5.27 0.00 2.60 2.75 0.00 0.00 6.47 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 F 9.13 5.04 0.00 3.02 3.17 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 49 Q 9.20 4.95 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 50 N 9.10 5.01 0.00 2.76 2.78 0.00 0.00 7.28 7.28 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 51 S 9.20 4.27 0.00 4.14 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 52 F 8.55 4.36 0.00 3.15 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 53 N 7.00 3.82 0.00 2.35 2.60 0.00 0.00 7.10 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.01 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 55 N 7.70 4.33 0.00 2.52 2.74 0.00 0.00 6.86 8.08 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 56 D 7.97 5.06 0.00 2.49 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.36 4.74 1.84 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 1.15 0.65 1.12 0.00 0.00 58 A 8.90 4.30 1.64 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 0.00 0.00 0.00 0.00 0.00 0.00 59 F 8.34 5.09 0.00 2.85 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 60 H 9.93 5.19 0.00 3.56 3.60 0.00 5.78 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 F 8.77 4.80 0.00 2.41 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 62 N 8.16 5.16 0.00 2.26 2.32 0.00 0.00 7.07 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 P 0.00 4.09 0.00 0.72 1.13 0.00 2.66 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.16 0.00 64 R 8.17 4.44 0.00 0.67 1.32 0.00 2.34 0.00 0.00 2.86 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.14 0.00 65 F 8.70 4.82 0.00 3.09 3.04 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 66 E 7.28 4.75 0.00 2.05 1.86 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 2.33 2.32 0.00 67 E 10.11 3.95 0.00 2.19 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 2.23 2.34 0.00 68 G 8.18 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 0.00 0.00 0.00 69 G 9.63 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 70 Y 8.04 5.02 0.00 3.18 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 71 V 8.71 4.35 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 0.22 0.00 0.00 0.80 0.00 0.00 72 V 8.15 4.54 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 0.90 0.00 0.00 0.89 0.00 0.00 73 C 8.97 5.34 0.00 3.08 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 74 N 8.69 5.59 0.00 2.77 2.75 0.00 0.00 6.84 7.32 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 75 T 8.92 5.44 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 1.46 0.00 0.00 76 K 9.30 4.85 0.00 0.79 1.24 0.00 0.61 0.00 0.00 1.22 0.00 0.00 2.47 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.63 0.21 7.81 77 Q 8.70 4.78 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.03 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 78 N 10.61 4.16 0.00 2.74 2.83 0.00 0.00 7.19 7.62 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 79 G 8.34 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 80 Q 7.90 4.51 0.00 2.06 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.95 0.00 0.00 0.00 0.00 0.00 2.50 2.43 0.00 81 W 8.62 4.85 0.00 3.21 3.07 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 82 G 8.85 4.34 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 0.00 83 P 0.00 4.65 0.00 2.14 2.13 0.00 3.88 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.05 0.00 84 E 8.93 4.46 0.00 1.89 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 85 E 9.27 4.65 0.00 2.12 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.41 0.00 86 R 8.62 5.03 0.00 1.66 1.89 0.00 3.10 0.00 0.00 2.92 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.63 0.00 87 K 8.88 4.23 0.00 1.68 1.59 0.00 1.38 0.00 0.00 1.34 0.00 0.00 2.83 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.59 1.37 7.81 88 M 8.16 4.75 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.41 0.00 89 Q 7.42 4.52 0.00 2.04 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.87 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 90 M 8.43 4.39 0.00 1.91 1.78 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.38 0.00 91 P 0.00 4.25 0.00 1.31 1.41 0.00 3.36 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 92 F 7.48 4.83 0.00 3.21 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 Q 8.46 4.82 0.00 2.13 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 7.05 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 94 K 8.63 3.90 0.00 1.53 1.55 0.00 1.64 0.00 0.00 1.54 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.78 1.05 7.81 95 G 8.36 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 96 M 7.58 4.82 0.00 1.99 2.14 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.82 0.00 97 P 0.00 4.88 0.00 1.87 1.85 0.00 3.64 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 98 F 8.69 5.28 0.00 3.21 3.33 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 99 E 9.57 5.14 0.00 2.04 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 2.23 2.23 0.00 100 L 9.43 5.15 0.00 1.98 1.90 0.43 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 101 C 9.01 5.21 0.00 2.98 2.70 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 0.00 102 F 9.45 5.18 0.00 3.07 2.98 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 0.00 103 L 9.22 5.06 0.00 1.80 1.80 1.01 0.74 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 0.00 104 V 8.79 3.90 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 -0.29 0.00 0.00 0.86 0.00 0.00 105 Q 8.47 4.80 0.00 2.24 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.57 0.00 0.00 0.00 0.00 0.00 2.26 2.25 0.00 106 R 8.64 3.96 0.00 1.81 1.99 0.00 3.22 0.00 0.00 3.30 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 107 S 7.87 4.76 0.00 4.02 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 0.00 108 E 7.40 4.78 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.30 0.00 109 F 9.03 4.95 0.00 2.82 3.12 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 0.00 110 K 9.20 5.07 0.00 1.83 1.96 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.68 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.61 1.60 7.81 111 V 8.91 4.72 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 0.41 0.00 0.00 1.22 0.00 0.00 112 M 8.87 5.06 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.65 0.00 113 V 8.50 4.52 1.66 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 0.23 0.00 0.00 0.51 0.00 0.00 114 N 10.03 4.21 0.00 2.77 2.85 0.00 0.00 7.16 7.59 0.00 0.00 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 K 8.45 4.03 0.00 1.94 1.99 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.34 1.52 7.81 116 K 7.67 4.67 0.00 1.81 1.73 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.34 7.81 117 F 8.98 4.42 0.00 3.00 3.04 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 0.00 118 F 8.38 4.82 0.00 2.77 2.98 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 0.00 119 V 6.68 4.24 1.35 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 1.08 0.00 0.00 0.84 0.00 0.00 120 Q 8.70 5.33 0.00 2.17 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.84 0.00 0.00 0.00 0.00 0.00 2.36 2.60 0.00 121 Y 8.87 4.56 0.00 2.86 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 Q 8.28 4.22 0.00 1.73 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.69 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 123 H 8.42 4.38 0.00 3.21 3.51 0.00 5.64 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 R 8.77 4.43 0.00 1.93 2.04 0.00 3.34 0.00 0.00 3.31 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.70 0.00 125 V 7.48 4.61 2.13 0.00 0.00 0.00 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 1.08 0.00 0.00 126 P 0.00 4.17 0.00 2.08 1.80 0.00 3.59 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.01 0.00 127 Y 7.79 4.36 0.00 3.11 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 0.00 128 H 7.40 4.70 0.00 2.93 3.25 0.00 5.55 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 L 7.38 4.10 0.00 1.76 1.72 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 130 V 8.02 4.17 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 1.21 0.00 0.00 131 D 8.90 5.29 0.00 2.78 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 0.00 132 T 7.89 5.14 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 0.00 133 I 8.94 4.75 1.94 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 1.02 0.93 1.28 0.00 0.00 134 A 8.74 5.14 1.19 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 0.00 0.00 135 V 9.31 5.00 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 1.08 0.00 0.00 0.98 0.00 0.00 136 S 9.31 4.78 0.00 3.92 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 0.00 137 G 8.81 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 0.00 138 C 8.56 4.68 0.00 2.99 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 0.00 139 L 7.27 5.02 0.00 1.51 1.07 0.38 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 140 K 8.82 4.72 0.00 1.72 1.83 0.00 1.17 0.00 0.00 1.59 0.00 0.00 2.75 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.20 1.24 7.81 141 L 8.10 4.90 0.00 1.42 1.38 0.83 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 142 S 8.82 4.29 0.00 3.77 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 0.00 143 F 6.97 5.26 0.00 3.04 3.12 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 0.00 144 I 9.02 5.25 2.04 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.70 0.71 0.00 0.00 145 T 8.87 4.79 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 0.84 0.00 0.00 146 F 8.59 5.30 0.00 3.15 3.07 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 0.00 147 Q 9.42 5.20 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.71 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 148 T 9.07 5.00 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 1.32 0.00 0.00 149 Q 8.65 4.83 0.00 2.11 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.42 0.00 0.00 0.00 0.00 0.00 2.28 1.88 0.00