NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 C 5.0438 8.2976 118.1101 56.3592 42.6876 172.4792 4 S 4.1859 7.7035 111.6151 55.0549 65.8433 168.1166 5 V 4.3826 8.7756 121.2899 60.1915 35.2994 174.8582 6 D 5.0654 8.5707 123.4984 53.2363 42.1438 175.8293 7 I 4.7630 8.9622 124.1501 59.5071 41.1474 174.3941 8 Q 5.2105 10.1345 125.3175 54.0847 31.8512 174.7248 9 G 4.4234 9.1471 110.6284 44.5290 0.0000 172.2137 10 N 5.5599 8.2252 122.9884 51.2070 39.9428 174.3862 11 D 4.6597 8.8936 116.9492 56.2325 40.1037 176.8224 12 Q 4.5691 8.5144 119.7491 55.7869 29.4368 175.6228 13 M 2.8927 8.2293 113.6960 56.5941 29.5737 176.6473 14 Q 4.5788 7.4212 114.0790 54.0031 30.6126 175.6570 15 F 5.8304 8.7374 120.6442 56.3490 39.9812 176.2527 16 N 4.4340 8.8843 119.8403 54.6330 37.7274 174.8852 17 T 4.8107 7.5889 113.3036 60.6915 70.7766 172.4970 18 N 5.3551 8.9068 122.2644 52.3755 39.1482 173.5442 19 A 5.0537 8.4711 121.3975 51.8845 21.7385 176.2469 20 I 4.5359 9.3923 123.9464 60.5459 39.8641 175.2307 21 T 5.0436 8.5106 122.2491 61.7165 71.2451 173.5119 22 V 3.9206 8.4553 126.5286 60.5692 33.8073 174.5139 23 D 4.7500 8.8070 130.6676 54.6390 41.5657 177.6793 24 K 4.0878 9.1415 129.3850 57.0400 31.8171 174.9721 25 S 4.4234 8.5257 110.8681 60.5378 63.5142 174.2892 26 C 4.4153 8.1582 122.1367 57.7618 39.6021 174.3411 27 K 4.2393 8.6791 126.9947 57.3492 32.6633 174.9527 28 Q 5.0059 7.8820 116.5144 53.8054 32.9861 174.7997 29 F 4.8161 8.4818 122.1723 56.6963 43.1639 173.4939 30 T 4.6948 7.1825 121.0539 61.4858 72.0393 172.8925 31 V 4.1507 8.3651 125.9651 60.9679 34.1365 173.9484 32 N 4.9551 8.7367 126.2942 51.6673 40.1213 173.4794 33 L 5.0838 8.7616 127.7375 53.8743 44.1996 175.5376 34 S 5.0513 9.0156 119.2963 57.5010 67.6705 172.7472 35 H 6.0660 8.4638 118.4156 52.8603 30.2654 170.4774 36 P 4.5267 0.0000 0.0000 62.8794 32.4175 175.1401 37 G 3.9192 8.8995 105.3466 44.5456 0.0000 172.9403 38 N 4.9581 9.5615 114.5316 52.3896 40.8763 174.3367 39 L 4.4773 8.1619 120.0234 52.6399 43.0699 174.9446 40 P 4.8853 0.0000 0.0000 61.4967 32.2321 177.1787 41 K 4.0906 8.4512 117.1241 59.3215 32.6616 177.9648 42 N 4.8213 8.1356 115.1744 53.1390 37.8544 174.9040 43 V 4.1932 7.7118 117.2186 64.5954 33.9147 175.7827 44 M 4.8326 8.1944 116.4492 54.0359 32.1306 174.5000 45 G 4.1579 7.6558 106.4831 45.4974 0.0000 172.8855 46 H 5.3968 9.3676 119.3795 53.7116 33.0140 172.3640 47 N 5.6421 8.9131 118.0829 50.8581 41.5362 172.3947 48 W 5.1258 9.2994 128.3898 55.6692 33.5090 174.1193 49 V 4.5045 8.0154 126.7754 60.6777 34.4846 173.6851 50 L 4.8702 8.1119 128.9250 53.1784 44.8728 175.2511 51 S 5.1485 8.7729 119.4957 57.1339 67.0837 173.5877 52 T 4.2813 8.5435 109.9347 61.1729 69.1714 174.7643 53 A 4.0517 8.7968 125.0044 55.4804 18.0378 180.2002 54 A 3.8939 7.8049 117.7752 55.0466 18.8651 178.7572 55 D 4.4972 8.0146 115.9123 55.7616 41.1581 178.3179 56 M 3.7461 7.5297 119.7652 58.7017 32.0568 177.7481 57 Q 3.8923 7.9564 118.9912 59.1338 29.1395 178.4433 58 G 3.5388 7.9131 106.1364 47.7168 0.0000 175.4706 59 V 3.6319 7.8098 120.9483 65.7405 31.4660 178.3303 60 V 3.5782 7.7381 117.6212 66.3313 31.4317 177.9733 61 T 3.8420 8.1045 115.7843 67.0227 68.4806 176.4288 62 D 4.5258 8.5580 121.0652 56.9494 40.8981 179.1813 63 G 4.0217 8.3611 108.0740 47.6663 0.0000 175.5428 64 M 4.2650 8.2853 120.5390 58.2579 32.0840 178.5307 65 A 4.1725 7.8513 119.5555 55.2538 18.6834 179.6309 66 S 4.2134 8.1256 113.5608 59.1194 62.9202 175.6127 67 G 3.9634 8.0449 108.0146 44.2479 0.0000 173.7723 68 L 2.8625 7.9105 119.0649 57.8826 41.8801 178.5565 69 D 4.4342 7.8483 116.0911 56.0644 41.1222 176.8275 70 K 4.4400 7.5131 117.9574 55.5478 32.6530 175.7929 71 D 4.5653 8.3722 116.5170 55.6145 39.0587 173.2159 72 Y 3.9356 7.6477 112.9788 59.0641 36.1137 170.0121 73 L 5.0326 7.5929 116.9316 52.3364 45.4235 176.7968 74 K 4.2399 8.5272 123.3401 55.0133 32.7224 174.9119 75 P 4.2349 0.0000 0.0000 64.2444 31.9310 175.3314 76 D 4.2468 8.6480 119.3181 55.0807 39.9773 173.7655 77 D 4.5150 7.8962 117.8594 53.5669 41.3067 176.5219 78 S 4.2955 8.6451 122.2736 60.7580 63.2304 175.4727 79 R 4.0428 8.4039 119.5016 57.3969 30.1739 176.5395 80 V 4.1285 7.3650 117.8044 61.6118 31.0651 175.4383 81 I 3.9855 8.5467 129.9294 64.3048 37.5621 176.6936 82 A 4.7935 7.6321 120.6124 51.5195 22.2833 174.9292 83 H 5.4978 8.5057 114.0033 54.9352 31.3126 173.5501 84 T 4.6325 8.8639 112.1199 60.6569 70.7073 173.8406 85 K 4.4948 9.1628 122.5238 56.0503 34.1869 176.1682 86 L 4.7516 8.8073 123.3352 54.7462 42.6139 175.9283 87 I 4.8882 9.2994 119.4237 59.2573 41.5112 174.8150 88 G 4.4867 9.3005 111.7312 43.8974 0.0000 172.7753 89 S 4.4478 8.2105 115.1332 59.8323 62.9994 175.2334 90 G 3.9408 8.7254 112.1457 45.4454 0.0000 173.3784 91 E 4.4800 7.8345 121.0862 56.1815 30.9651 175.8990 92 K 4.9655 8.0297 121.6109 54.5622 35.8078 174.4484 93 D 4.7796 9.0066 120.0839 53.3692 45.0273 174.2212 94 S 5.3893 8.6429 119.4835 56.6937 66.5493 173.7504 95 V 4.5850 8.4976 120.9852 60.3646 34.7627 174.3397 96 T 5.1579 8.6163 119.3223 61.8032 71.4776 173.1121 97 F 5.1159 8.4572 119.3715 55.1182 42.3022 173.4674 98 D 4.8658 8.8120 119.8045 53.8368 41.5003 178.1613 99 V 3.7157 8.8020 124.6596 65.4698 31.7322 178.0202 100 S 4.2295 8.0735 113.2144 60.6682 62.8469 175.4428 101 K 4.1787 8.1960 120.0954 58.0093 32.0754 176.8232 102 L 4.5889 7.7102 119.0297 52.7029 43.3488 175.6932 103 K 4.7136 9.2699 125.3973 54.7976 35.2308 175.9954 104 E 4.2261 8.6060 119.8362 57.0495 30.2340 178.4641 105 G 4.0119 8.9096 110.4572 44.9025 0.0000 173.2313 106 E 4.2562 7.3688 118.4889 55.1319 31.0198 174.8025 107 Q 4.5950 8.5237 122.5661 54.2960 31.3280 174.3483 108 Y 5.2183 8.4983 120.4744 56.4744 41.7616 174.4611 109 M 5.3905 9.2010 121.6140 53.5509 36.1316 174.6414 110 F 5.0214 8.4073 117.6038 55.3626 41.1350 174.2529 111 F 5.2528 7.6240 113.2897 56.7182 41.7857 171.9484 112 C 5.4184 9.0580 120.7632 57.2199 31.2932 174.5968 113 S 4.3647 9.8280 122.8072 60.9554 62.8346 174.8297 114 P 3.9358 0.0000 0.0000 64.3480 31.2849 176.2656 115 H 4.8717 7.4752 114.9336 55.2787 30.0893 175.2579 116 Q 4.1395 8.3341 123.2308 59.0495 28.9934 178.7949 117 G 3.5114 8.0524 105.3818 47.8439 0.0000 173.6676 118 A 4.3431 7.7362 121.1412 51.9913 18.9026 177.7093 119 G 3.9920 8.1034 105.1270 45.7012 0.0000 175.0535 120 M 4.5065 7.7412 121.4201 53.7291 30.8255 174.4999 121 K 4.8311 7.6346 121.0042 55.7820 36.4761 174.7679 122 G 3.7155 7.7194 106.9604 46.1533 0.0000 172.4581 123 T 5.0721 8.3331 110.0470 60.3807 71.2898 173.7029 124 L 5.4775 8.6769 124.3790 53.8544 44.9688 175.8360 125 T 4.8708 8.8677 121.7912 61.6169 72.7115 173.5276 126 L 4.6702 8.8576 128.0347 55.4553 42.9192 177.8443 127 K 4.2885 8.8591 124.7001 55.5513 33.0083 175.8220 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 3 C 8.30 5.04 0.00 2.81 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 4 S 7.70 4.19 0.00 3.52 3.44 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 5 V 8.78 4.38 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 0.73 0.00 0.00 0.86 0.00 0.00 6 D 8.57 5.07 0.00 2.51 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.96 4.76 1.65 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.53 0.83 0.00 0.00 8 Q 10.13 5.21 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.75 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 9 G 9.15 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 10 N 8.23 5.56 0.00 2.74 2.87 0.00 0.00 7.05 8.21 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 11 D 8.89 4.66 0.00 2.72 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 12 Q 8.51 4.57 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.24 0.00 0.00 0.00 0.00 0.00 2.26 2.42 0.00 13 M 8.23 2.89 0.00 2.00 2.06 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.10 0.00 14 Q 7.42 4.58 0.00 2.18 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.26 6.94 0.00 0.00 0.00 0.00 0.00 2.25 2.48 0.00 15 F 8.74 5.83 0.00 3.33 3.03 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 16 N 8.88 4.43 0.00 2.89 3.02 0.00 0.00 5.76 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 17 T 7.59 4.81 4.30 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 1.23 0.00 0.00 18 N 8.91 5.36 0.00 2.89 3.07 0.00 0.00 5.75 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 19 A 8.47 5.05 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 20 I 9.39 4.54 1.94 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.59 0.91 0.00 0.00 21 T 8.51 5.04 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 1.21 0.00 0.00 22 V 8.46 3.92 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 0.64 0.00 0.00 -0.19 0.00 0.00 23 D 8.81 4.75 0.00 2.73 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 24 K 9.14 4.09 0.00 1.78 1.72 0.00 1.86 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.39 1.26 7.81 25 S 8.53 4.42 0.00 3.95 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 26 C 8.16 4.42 0.00 3.10 3.30 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 27 K 8.68 4.24 0.00 1.45 1.80 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.76 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.42 1.04 7.81 28 Q 7.88 5.01 0.00 1.75 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.68 0.00 0.00 0.00 0.00 0.00 2.19 2.51 0.00 29 F 8.48 4.82 0.00 2.68 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 0.00 0.00 0.00 0.00 30 T 7.18 4.69 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 1.06 0.00 0.00 31 V 8.37 4.15 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 -0.09 0.00 0.00 -0.29 0.00 0.00 32 N 8.74 4.96 0.00 2.67 2.63 0.00 0.00 6.16 6.90 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 33 L 8.76 5.08 0.00 1.74 1.73 1.26 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 34 S 9.02 5.05 0.00 3.91 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 35 H 8.46 6.07 0.00 3.26 3.28 0.00 5.72 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.53 0.00 2.02 2.02 0.00 3.93 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.15 0.00 37 G 8.90 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 38 N 9.56 4.96 0.00 2.61 2.80 0.00 0.00 6.91 8.52 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 39 L 8.16 4.48 0.00 1.84 1.58 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.89 0.00 2.22 2.18 0.00 3.70 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.95 0.00 41 K 8.45 4.09 0.00 2.02 2.24 0.00 1.54 0.00 0.00 1.90 0.00 0.00 2.94 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.51 1.47 7.81 42 N 8.14 4.82 0.00 2.89 2.99 0.00 0.00 5.77 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 43 V 7.71 4.19 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 0.84 0.00 0.00 0.95 0.00 0.00 44 M 8.19 4.83 0.00 1.94 1.91 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.68 0.00 45 G 7.66 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 0.00 0.00 0.00 0.00 46 H 9.37 5.40 0.00 3.12 3.17 0.00 5.56 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.91 5.64 0.00 2.97 3.15 0.00 0.00 5.59 8.88 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 48 W 9.30 5.13 0.00 3.49 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 49 V 8.02 4.50 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 0.00 0.00 0.60 0.00 0.00 0.88 0.00 0.00 50 L 8.11 4.87 0.00 1.02 1.20 0.89 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 51 S 8.77 5.15 0.00 4.09 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 52 T 8.54 4.28 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 53 A 8.80 4.05 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 54 A 7.80 3.89 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 55 D 8.01 4.50 0.00 2.76 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 56 M 7.53 3.75 0.00 1.93 1.87 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 2.07 0.00 57 Q 7.96 3.89 0.00 2.09 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.69 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 58 G 7.91 3.54 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 0.00 0.00 0.00 59 V 7.81 3.63 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 1.31 0.00 0.00 1.03 0.00 0.00 60 V 7.74 3.58 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 1.00 0.00 0.00 0.53 0.00 0.00 61 T 8.10 3.84 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 1.20 0.00 0.00 62 D 8.56 4.53 0.00 2.73 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 63 G 8.36 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 64 M 8.29 4.27 0.00 2.00 2.31 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 2.62 2.85 0.00 65 A 7.85 4.17 1.39 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 66 S 8.13 4.21 0.00 4.11 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 67 G 8.04 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 68 L 7.91 2.86 0.00 1.56 1.53 0.96 1.19 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 69 D 7.85 4.43 0.00 2.64 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 K 7.51 4.44 0.00 1.84 1.85 0.00 1.79 0.00 0.00 1.80 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.36 7.81 71 D 8.37 4.57 0.00 2.81 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 72 Y 7.65 3.94 0.00 3.19 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 73 L 7.59 5.03 0.00 1.56 1.48 0.74 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.53 4.24 0.00 1.73 1.89 0.00 1.62 0.00 0.00 0.61 0.00 0.00 3.03 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.43 7.81 75 P 0.00 4.23 0.00 2.08 1.98 0.00 3.88 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 76 D 8.65 4.25 0.00 2.72 2.67 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 77 D 7.90 4.51 0.00 2.95 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 78 S 8.65 4.30 0.00 4.03 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 79 R 8.40 4.04 0.00 1.99 2.06 0.00 3.16 0.00 0.00 3.16 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.57 0.00 80 V 7.37 4.13 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 0.81 0.00 0.00 0.95 0.00 0.00 81 I 8.55 3.99 1.72 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 1.16 0.65 0.64 0.00 0.00 82 A 7.63 4.79 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 83 H 8.51 5.50 0.00 3.16 3.24 0.00 5.72 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 84 T 8.86 4.63 4.50 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 0.00 0.00 0.00 1.34 0.00 0.00 85 K 9.16 4.49 0.00 1.98 1.94 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.65 1.45 7.81 86 L 8.81 4.75 0.00 1.79 1.80 1.16 1.05 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 87 I 9.30 4.89 1.94 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 1.49 1.12 0.98 0.00 0.00 88 G 9.30 4.49 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.21 4.45 0.00 4.01 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 90 G 8.73 3.94 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 0.00 0.00 0.00 91 E 7.83 4.48 0.00 2.13 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 2.31 2.25 0.00 92 K 8.03 4.97 0.00 1.48 1.50 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.26 1.01 7.81 93 D 9.01 4.78 0.00 2.81 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 94 S 8.64 5.39 0.00 3.68 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 V 8.50 4.58 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 1.03 0.00 0.00 1.12 0.00 0.00 96 T 8.62 5.16 4.19 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 1.12 0.00 0.00 97 F 8.46 5.12 0.00 3.07 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 98 D 8.81 4.87 0.00 2.82 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 99 V 8.80 3.72 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 1.08 0.00 0.00 0.84 0.00 0.00 100 S 8.07 4.23 0.00 4.05 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 0.00 101 K 8.20 4.18 0.00 1.93 1.92 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.56 1.71 7.81 102 L 7.71 4.59 0.00 1.66 1.36 0.85 -0.19 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 0.00 103 K 9.27 4.71 0.00 1.87 1.74 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.31 1.21 7.81 104 E 8.61 4.23 0.00 2.03 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 2.23 1.87 0.00 105 G 8.91 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 0.00 0.00 0.00 106 E 7.37 4.26 0.00 1.87 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 1.86 1.47 0.00 107 Q 8.52 4.59 0.00 1.84 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.51 0.00 0.00 0.00 0.00 0.00 2.23 2.22 0.00 108 Y 8.50 5.22 0.00 3.17 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 0.00 109 M 9.20 5.39 0.00 1.91 1.99 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.58 0.00 110 F 8.41 5.02 0.00 1.86 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 F 7.62 5.25 0.00 3.13 3.03 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 0.00 112 C 9.06 5.42 0.00 3.10 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 0.00 113 S 9.83 4.36 0.00 4.15 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 0.00 114 P 0.00 3.94 0.00 1.50 0.88 0.00 3.62 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 115 H 7.48 4.87 0.00 3.29 3.21 0.00 5.64 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 Q 8.33 4.14 0.00 2.32 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.80 0.00 0.00 0.00 0.00 0.00 2.26 2.05 0.00 117 G 8.05 3.51 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 0.00 118 A 7.74 4.34 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 0.00 119 G 8.10 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 0.00 120 M 7.74 4.51 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.56 0.00 121 K 7.63 4.83 0.00 1.78 1.74 0.00 1.56 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.35 7.81 122 G 7.72 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 0.00 0.00 0.00 123 T 8.33 5.07 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 1.22 0.00 0.00 124 L 8.68 5.48 0.00 1.97 1.74 1.15 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 125 T 8.87 4.87 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 1.26 0.00 0.00 126 L 8.86 4.67 0.00 1.57 1.61 0.98 0.76 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 0.00 127 K 8.86 4.29 0.00 1.38 1.57 0.00 1.84 0.00 0.00 1.68 0.00 0.00 2.78 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.26 1.25 7.81