NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3450 8.2649 123.5878 51.9155 20.2569 176.6201 3 T 4.2209 8.1149 116.2251 64.9400 69.1384 172.3013 4 K 4.7398 9.3371 124.8129 54.5448 36.7633 174.3539 5 I 4.8358 7.8853 120.0528 58.7950 41.3186 175.3882 6 D 4.5864 8.9390 128.4545 53.2031 40.4730 177.1338 7 K 3.8816 8.2573 126.6528 58.9537 32.3621 178.4726 8 E 3.8869 8.1836 118.9008 59.3196 29.5385 178.6559 9 A 4.0404 8.3822 120.7448 55.4304 18.4733 179.4695 10 C 4.4539 8.4220 115.4680 62.9798 28.1633 176.4254 11 R 3.9669 8.4972 120.0331 59.2155 29.6350 178.8696 12 A 4.0526 8.1126 120.2075 55.0914 18.4200 179.5721 13 A 3.9756 7.9422 119.3909 55.4027 18.5207 179.0680 14 Y 4.2031 8.3772 118.0708 61.2576 38.7426 178.3133 15 N 4.2331 8.8180 117.6400 55.9469 38.3358 177.1460 16 L 3.9555 7.7675 121.1633 58.3476 42.3083 179.0623 17 V 4.1011 7.4837 117.5572 65.3801 31.5951 177.8520 18 R 4.2160 7.9763 116.5791 57.0766 30.0808 176.1337 19 D 4.5889 7.7111 119.7500 53.1120 40.6543 176.4143 20 D 4.4106 8.8974 127.9673 56.8882 39.5811 177.8881 21 G 3.9517 8.6613 107.0989 45.5216 0.0000 175.3681 22 S 3.9494 8.0415 114.3037 58.8251 63.3674 175.4135 23 A 3.6056 7.3467 121.3278 52.2154 16.9402 177.3454 24 V 4.1010 7.3610 117.3949 61.4156 31.8398 175.7744 25 I 4.5262 8.2988 121.2576 60.6925 39.4145 175.2299 26 W 5.7480 7.3627 119.4439 55.2693 31.6573 174.1162 27 V 5.0832 9.0341 114.4771 59.9903 35.6588 174.7212 28 T 5.2183 8.7996 113.3382 60.1275 72.1989 172.9815 29 F 5.4962 9.5237 120.6349 55.9388 42.9301 174.4003 30 K 5.2083 9.4309 121.3414 54.8078 36.9204 174.8409 31 Y 4.6268 8.8548 119.4000 57.8644 39.5560 174.6002 32 D 4.9338 9.5311 125.4904 52.9863 42.0505 177.5444 33 G 3.9464 8.1156 118.9238 46.8292 0.0000 172.5019 34 S 4.7909 8.8765 120.1903 57.9125 63.4169 172.5852 35 T 5.0679 7.8019 118.4769 62.0667 71.1968 173.3773 36 I 4.4473 8.6723 127.9510 61.0694 38.3900 175.5734 37 V 4.9396 8.9125 119.6499 58.5864 36.1788 173.4349 38 P 4.4589 0.0000 0.0000 64.6582 31.7560 175.2342 39 G 3.7693 9.2807 110.3946 46.2999 0.0000 174.4442 40 E 5.0195 6.2289 118.8265 54.4252 34.3016 175.9250 41 Q 4.4310 8.1677 118.5117 54.2976 32.7880 174.9692 42 G 3.4660 6.9804 107.1263 44.9579 0.0000 173.3662 43 A 4.5471 8.5150 122.3759 51.8413 20.6165 177.0664 44 E 4.7847 8.0063 115.9036 54.2674 32.0995 176.3688 45 Y 4.1642 8.8871 124.8169 60.7441 39.0117 177.6866 46 Q 3.9109 8.2083 120.1277 59.3956 28.8801 177.8364 47 H 4.4199 7.9567 115.9897 58.0947 29.0308 177.3101 48 F 2.6919 7.3887 122.9143 60.7405 39.0051 176.9938 49 I 2.6877 6.8013 118.7586 64.3383 36.5845 178.2544 50 Q 3.8176 7.2697 116.9426 58.6503 28.5146 178.5026 51 Q 4.0592 7.3393 118.1103 57.3622 29.9506 176.7827 52 C 3.7483 6.7018 119.5525 58.1049 26.4138 173.1901 53 T 4.3385 7.3545 114.0111 60.3698 70.3343 176.5811 54 D 4.6250 8.6680 121.0238 56.7211 40.9352 177.7322 55 D 4.7337 7.6649 116.1227 54.4229 41.7021 176.2959 56 V 4.8049 7.7230 112.8952 59.2460 35.7559 174.6205 57 R 5.1986 8.4245 118.1859 54.6749 32.1165 174.3822 58 L 4.6264 8.8528 120.7053 55.2502 44.6561 173.5613 59 F 5.6896 9.3893 117.4622 55.8735 42.4699 174.7460 60 A 5.4209 9.6237 122.9293 50.3523 23.0739 174.6629 61 F 5.6317 9.5006 123.5082 56.5279 42.3148 174.2139 62 V 4.7308 8.3366 125.3877 60.9914 34.9043 173.8776 63 R 4.1847 8.5771 128.8999 55.1380 30.7542 175.2860 64 F 4.7435 8.7325 125.5894 56.0199 41.9428 174.7416 65 T 4.7989 8.4511 119.2288 62.3842 69.6494 174.1770 66 T 4.5036 8.6759 116.5033 60.9296 72.6323 175.6932 67 G 3.9799 9.5329 110.5577 46.2038 0.0000 172.0512 68 D 4.4880 8.6947 114.6606 54.3361 45.6962 176.2689 69 A 3.5044 8.2635 127.7590 53.1182 17.5651 179.8300 70 M 3.9845 9.0165 116.8724 60.9069 31.6142 176.7618 71 S 4.5007 8.0781 111.2859 57.9727 63.6655 173.4031 72 K 4.6558 7.8624 124.3302 57.0525 32.3395 176.0517 73 R 4.5443 8.7944 121.9833 55.6401 33.1521 173.7570 74 S 4.8246 8.6088 116.2809 57.9385 64.0634 173.9409 75 K 4.7125 8.8559 122.7412 54.6016 35.9084 175.0419 76 F 5.3393 9.0453 121.5176 55.7033 42.0593 174.2890 77 A 5.5838 9.2501 124.4144 50.2025 22.5602 174.5598 78 L 5.3407 8.6918 122.7794 53.6011 44.2831 175.1489 79 I 5.1469 9.2369 127.5694 60.0157 40.3033 174.6364 80 T 4.9625 9.2708 124.9741 61.9980 70.0818 173.4523 81 W 5.1617 9.0911 135.0000 56.1813 32.5296 175.1623 82 I 4.2486 7.6385 127.7288 58.6707 38.9858 175.3172 83 G 3.4647 8.1136 114.7926 46.0964 0.0000 172.6289 84 E 4.0288 8.6932 121.0331 58.6628 29.6450 177.9152 85 N 4.5545 7.9901 114.5930 53.7155 39.0681 175.6654 86 V 3.7088 7.4750 119.5939 62.0544 32.3245 176.5099 87 S 4.4014 8.4718 121.6805 58.1927 64.8986 175.5872 88 G 3.6293 8.5496 109.6353 47.9011 0.0000 175.7395 89 L 3.9491 7.7848 122.0652 58.2173 42.2501 179.0358 90 Q 3.9909 8.1161 117.8773 58.5118 28.5674 178.5383 91 R 3.7940 8.3894 120.3014 59.3443 30.0337 178.4787 92 A 4.0089 8.0852 120.5467 55.1187 18.3168 179.7824 93 K 3.9658 8.1249 117.0720 59.8147 32.0675 179.7817 94 T 4.3568 7.6342 117.5970 66.2617 68.2004 177.0857 95 G 3.7504 8.0108 106.3823 47.8322 0.0000 175.6805 96 T 4.0902 8.3175 118.4071 66.7856 68.5425 176.3749 97 D 4.5621 8.5184 120.4649 56.3519 40.8236 178.6429 98 K 3.7951 8.1337 119.2817 59.6356 32.2214 179.2286 99 T 3.8033 7.5679 116.7789 66.5870 68.6773 175.7570 100 L 3.9642 7.7180 121.6361 58.0099 42.1128 178.7596 101 V 3.1285 7.2995 118.1765 65.8452 31.1131 177.6090 102 K 4.3854 7.6310 116.3962 57.1399 31.9873 178.5509 103 E 3.9610 7.8837 119.3790 58.3354 29.3173 178.3801 104 V 3.7465 6.9954 116.4773 63.8524 33.8642 176.9870 105 V 2.7203 7.0671 121.1916 61.4398 29.7245 176.0834 106 Q 4.1356 7.2237 121.7394 57.1246 29.5786 176.3927 107 N 4.8556 8.0930 115.4312 51.1366 40.5551 173.8732 108 F 5.2288 7.6089 116.1045 55.5234 40.6732 174.0379 109 A 4.3366 9.3346 125.4268 55.0882 18.9914 177.9740 110 K 4.7953 8.3274 114.1721 55.3782 35.6147 174.4289 111 E 5.2768 8.7120 123.1697 54.6231 32.5326 174.9322 112 F 5.0406 9.2877 118.6681 55.8019 43.7261 174.1954 113 V 4.9170 8.7120 120.8075 61.4336 33.7206 174.6528 114 I 4.9138 9.0795 129.2038 59.6608 40.3821 176.4198 115 S 3.6595 8.8912 118.5075 57.1917 64.5402 173.0253 116 D 4.7968 7.8767 121.9139 52.5703 41.8632 176.1854 117 R 3.8920 9.2139 130.1026 60.4412 29.6620 178.7822 118 K 3.9838 8.4481 123.2231 59.4744 31.4275 181.2970 119 E 3.7014 7.8598 115.8205 57.0249 29.6416 177.5045 120 L 4.3552 7.6470 118.8424 56.1353 42.4848 177.9172 121 E 4.2363 7.7962 119.8440 56.0988 31.1839 177.1958 122 E 3.6432 9.0627 123.4239 59.7739 29.6671 179.1301 123 D 4.4045 8.0509 118.1564 57.0815 40.8837 178.4864 124 F 4.0262 8.0818 120.6898 61.3713 39.5426 176.9880 125 I 3.2662 7.6971 119.3655 64.3335 36.8456 178.6523 126 K 3.6286 8.0894 119.7104 59.1987 31.7876 179.6189 127 S 4.0621 7.9711 114.6205 61.3823 62.9142 176.4952 128 E 3.8765 7.9199 122.2141 59.0430 28.9356 179.2181 129 L 4.0545 7.8407 118.5891 57.5452 41.7066 179.1349 130 K 4.1359 8.0043 121.4062 59.9148 32.2173 179.4035 131 K 4.0901 7.8389 123.0099 59.4972 31.6817 179.2563 132 A 4.4894 7.6610 124.6521 52.3119 18.5648 177.0346 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 2 A 8.26 4.35 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 3 T 8.11 4.22 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 1.39 0.00 0.00 4 K 9.34 4.74 0.00 1.66 1.67 0.00 1.61 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.53 7.81 5 I 7.89 4.84 1.71 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.92 0.79 0.00 0.00 6 D 8.94 4.59 0.00 2.79 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 K 8.26 3.88 0.00 1.79 1.77 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.42 7.81 8 E 8.18 3.89 0.00 2.03 1.95 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 2.39 2.39 0.00 9 A 8.38 4.04 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 10 C 8.42 4.45 0.00 2.96 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 11 R 8.50 3.97 0.00 2.06 2.02 0.00 3.18 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 12 A 8.11 4.05 1.41 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 0.00 0.00 0.00 13 A 7.94 3.98 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.38 4.20 0.00 3.00 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 15 N 8.82 4.23 0.00 2.91 2.85 0.00 0.00 6.72 6.67 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 16 L 7.77 3.96 0.00 1.77 1.98 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 17 V 7.48 4.10 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 1.08 0.00 0.00 1.13 0.00 0.00 18 R 7.98 4.22 0.00 1.73 1.74 0.00 2.25 0.00 0.00 2.25 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 1.27 0.00 19 D 7.71 4.59 0.00 2.71 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.90 4.41 0.00 2.73 2.75 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 21 G 8.66 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 22 S 8.04 3.95 0.00 3.98 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 23 A 7.35 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 24 V 7.36 4.10 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 0.83 0.00 0.00 0.86 0.00 0.00 25 I 8.30 4.53 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 1.40 1.28 0.86 0.00 0.00 26 W 7.36 5.75 0.00 3.11 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 27 V 9.03 5.08 1.83 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 0.67 0.00 0.00 1.13 0.00 0.00 28 T 8.80 5.22 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 1.49 0.00 0.00 29 F 9.52 5.50 0.00 3.15 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 K 9.43 5.21 0.00 1.75 1.79 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.49 1.54 7.81 31 Y 8.85 4.63 0.00 3.02 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 32 D 9.53 4.93 0.00 2.72 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 33 G 8.12 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 34 S 8.88 4.79 0.00 4.08 4.15 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 35 T 7.80 5.07 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 1.27 0.00 0.00 36 I 8.67 4.45 1.65 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.13 0.77 0.00 0.00 37 V 8.91 4.94 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 0.85 0.00 0.00 1.07 0.00 0.00 38 P 0.00 4.46 0.00 1.95 1.98 0.00 3.72 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.31 0.00 39 G 9.28 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 40 E 6.23 5.02 0.00 2.37 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 0.00 2.36 2.37 0.00 41 Q 8.17 4.43 0.00 1.58 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.76 0.00 0.00 0.00 0.00 0.00 2.06 2.18 0.00 42 G 6.98 3.47 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 A 8.52 4.55 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 44 E 8.01 4.78 0.00 2.07 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 45 Y 8.89 4.16 0.00 3.06 3.06 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 46 Q 8.21 3.91 0.00 2.20 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.69 0.00 0.00 0.00 0.00 0.00 2.39 2.58 0.00 47 H 7.96 4.42 0.00 3.79 3.61 0.00 5.73 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 F 7.39 2.69 0.00 1.51 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 I 6.80 2.69 1.65 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.10 0.57 0.00 0.00 50 Q 7.27 3.82 0.00 2.10 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.01 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 51 Q 7.34 4.06 0.00 1.76 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.27 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 52 C 6.70 3.75 0.00 1.77 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 53 T 7.35 4.34 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 1.16 0.00 0.00 54 D 8.67 4.62 0.00 2.78 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 55 D 7.66 4.73 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 56 V 7.72 4.80 2.18 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 0.79 0.00 0.00 1.20 0.00 0.00 57 R 8.42 5.20 0.00 1.65 1.76 0.00 2.94 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.66 0.00 58 L 8.85 4.63 0.00 2.04 1.90 1.20 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 59 F 9.39 5.69 0.00 3.33 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 A 9.62 5.42 1.11 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 0.00 0.00 61 F 9.50 5.63 0.00 3.46 3.26 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 62 V 8.34 4.73 1.90 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 0.31 0.00 0.00 0.61 0.00 0.00 63 R 8.58 4.18 0.00 1.69 1.62 0.00 3.17 0.00 0.00 3.10 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.93 0.00 64 F 8.73 4.74 0.00 3.04 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 T 8.45 4.80 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 1.18 0.00 0.00 66 T 8.68 4.50 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 1.19 0.00 0.00 67 G 9.53 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 68 D 8.69 4.49 0.00 2.72 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.26 3.50 1.11 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 0.00 0.00 70 M 9.02 3.98 0.00 1.96 2.12 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 2.59 2.61 0.00 71 S 8.08 4.50 0.00 4.06 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 72 K 7.86 4.66 0.00 1.88 1.80 0.00 1.82 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.38 7.81 73 R 8.79 4.54 0.00 1.86 1.96 0.00 2.83 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.54 0.00 74 S 8.61 4.82 0.00 3.65 3.25 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 75 K 8.86 4.71 0.00 1.66 1.72 0.00 1.62 0.00 0.00 1.68 0.00 0.00 2.82 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.37 7.81 76 F 9.05 5.34 0.00 3.24 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 77 A 9.25 5.58 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 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.69 5.34 0.00 1.75 1.13 1.12 0.61 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 79 I 9.24 5.15 2.10 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 1.40 0.93 1.25 0.00 0.00 80 T 9.27 4.96 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 1.24 0.00 0.00 81 W 9.09 5.16 0.00 3.48 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 I 7.64 4.25 1.60 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.63 0.72 0.00 0.00 83 G 8.11 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 E 8.69 4.03 0.00 1.92 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 2.22 2.34 0.00 85 N 7.99 4.55 0.00 2.85 2.84 0.00 0.00 6.93 7.22 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 86 V 7.47 3.71 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.84 0.00 0.00 87 S 8.47 4.40 0.00 4.05 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 88 G 8.55 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 0.00 0.00 0.00 89 L 7.78 3.95 0.00 1.74 1.64 0.91 0.73 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 90 Q 8.12 3.99 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.58 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 91 R 8.39 3.79 0.00 1.86 2.10 0.00 3.04 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.56 0.00 92 A 8.09 4.01 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 93 K 8.12 3.97 0.00 1.81 1.89 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.58 7.81 94 T 7.63 4.36 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 95 G 8.01 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 96 T 8.32 4.09 4.47 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 0.00 0.00 0.00 1.24 0.00 0.00 97 D 8.52 4.56 0.00 3.20 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 98 K 8.13 3.80 0.00 2.02 2.37 0.00 1.52 0.00 0.00 1.80 0.00 0.00 3.00 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.77 1.52 7.81 99 T 7.57 3.80 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 1.19 0.00 0.00 100 L 7.72 3.96 0.00 1.67 1.68 0.87 0.80 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 0.00 101 V 7.30 3.13 1.68 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 0.45 0.00 0.00 -0.30 0.00 0.00 102 K 7.63 4.39 0.00 1.93 1.89 0.00 1.96 0.00 0.00 1.48 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.70 1.36 7.81 103 E 7.88 3.96 0.00 1.92 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 104 V 7.00 3.75 1.76 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 0.46 0.00 0.00 0.71 0.00 0.00 105 V 7.07 2.72 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 0.89 0.00 0.00 0.46 0.00 0.00 106 Q 7.22 4.14 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.89 6.47 0.00 0.00 0.00 0.00 0.00 2.41 2.29 0.00 107 N 8.09 4.86 0.00 2.80 2.74 0.00 0.00 6.84 7.49 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 0.00 108 F 7.61 5.23 0.00 3.49 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 A 9.33 4.34 1.49 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 0.00 110 K 8.33 4.80 0.00 1.84 1.64 0.00 1.54 0.00 0.00 1.71 0.00 0.00 2.74 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.54 1.19 7.81 111 E 8.71 5.28 0.00 1.87 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 2.16 2.23 0.00 112 F 9.29 5.04 0.00 3.12 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 8.71 4.92 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 0.84 0.00 0.00 1.01 0.00 0.00 114 I 9.08 4.91 2.23 0.00 0.00 1.00 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 0.84 1.24 0.00 0.00 115 S 8.89 3.66 0.00 3.61 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 0.00 116 D 7.88 4.80 0.00 2.67 2.57 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 0.00 117 R 9.21 3.89 0.00 1.96 1.95 0.00 3.17 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.48 0.00 118 K 8.45 3.98 0.00 1.82 1.81 0.00 1.85 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.37 1.36 7.81 119 E 7.86 3.70 0.00 1.95 1.71 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 1.47 1.95 0.00 120 L 7.65 4.36 0.00 1.62 1.58 -0.09 0.76 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 0.00 121 E 7.80 4.24 0.00 2.00 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 2.43 2.47 0.00 122 E 9.06 3.64 0.00 1.66 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 2.27 2.26 0.00 123 D 8.05 4.40 0.00 2.75 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 0.00 124 F 8.08 4.03 0.00 3.12 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 0.00 125 I 7.70 3.27 1.26 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 1.68 0.69 0.16 0.00 0.00 126 K 8.09 3.63 0.00 1.62 1.67 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.98 0.96 7.81 127 S 7.97 4.06 0.00 3.94 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 0.00 128 E 7.92 3.88 0.00 2.14 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 1.52 1.88 0.00 129 L 7.84 4.05 0.00 1.67 1.71 0.71 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 130 K 8.00 4.14 0.00 1.80 1.93 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.42 7.81 131 K 7.84 4.09 0.00 1.92 1.72 0.00 1.86 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.39 1.33 7.81 132 A 7.66 4.49 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00