NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 K 4.3082 8.3144 120.1391 55.2222 33.5799 175.8101 12 R 4.4941 8.7275 120.7723 54.5823 33.5220 173.1251 13 Q 4.4780 9.2653 123.0383 54.6472 32.5729 174.2327 14 V 4.3716 8.3019 116.3179 59.5104 34.0225 176.1440 15 A 4.8837 8.5291 125.8827 54.5582 19.5292 177.6523 16 S 4.8780 7.5107 109.4596 57.8160 63.1468 173.7708 17 G 3.9832 8.6629 116.2692 45.4823 0.0000 171.3386 18 R 4.6988 8.5552 119.7447 55.3977 34.5510 174.3604 19 A 5.1996 8.4642 127.5722 50.3962 21.9420 174.3022 20 Y 5.1483 9.4389 120.4314 56.3972 41.1656 175.1091 21 I 4.7674 9.5291 124.6478 59.9939 40.3941 174.2533 22 H 4.8247 9.8928 129.4505 54.7957 30.9671 173.8718 23 A 4.5462 8.7221 130.0618 50.7658 19.4271 175.5698 24 S 4.6397 7.9733 119.2280 58.2800 64.4140 173.4205 25 Y 4.7078 8.6701 114.9481 57.9281 39.4677 175.2866 26 N 4.9878 8.1623 115.2768 51.9477 40.2282 173.2318 27 N 4.9313 7.4565 115.6744 54.2520 41.3897 173.0512 28 T 4.8932 8.1007 115.9839 62.4684 72.6777 173.3244 29 I 4.9228 9.5683 125.4887 59.6653 42.2157 173.7592 30 V 4.9807 9.2397 121.8427 59.8253 34.6079 174.4391 31 T 5.1021 9.0681 119.9217 60.4020 70.0624 172.4702 32 I 4.8488 9.4341 131.3442 60.4830 39.0365 175.2552 33 T 5.2702 9.3095 120.7777 60.3153 72.0456 172.8738 34 D 5.2431 8.4927 120.9888 51.0738 42.1415 175.6363 35 P 4.2562 0.0000 0.0000 65.7428 31.0918 177.7408 36 D 4.4554 7.6275 117.9998 54.8995 40.9735 178.2388 37 G 5.1480 7.8259 121.3250 46.9981 0.0000 172.5744 38 N 4.4750 7.5632 119.0271 52.2920 39.0702 172.9318 39 P 4.8105 0.0000 0.0000 62.8961 32.2199 176.0620 40 I 4.0441 8.9658 122.9961 63.5118 38.4746 175.8417 41 T 4.3765 7.3744 115.6161 62.9525 72.7586 171.9482 42 W 5.6302 7.9872 119.2728 55.7634 31.9937 173.9217 43 S 4.6490 10.1546 115.0080 57.0435 65.5933 172.9078 44 S 5.1585 8.8659 120.3243 56.0812 66.0237 174.9539 45 G 3.8911 8.6853 109.9523 48.4524 0.0000 174.9135 46 G 4.1279 7.9077 107.9417 46.0010 0.0000 175.7682 47 V 3.8257 7.8003 118.6519 64.5611 33.2694 176.4428 48 I 3.7230 7.8065 121.2860 63.0074 34.8600 177.6188 49 G 4.1772 8.9105 110.5867 47.0617 0.0000 172.0608 50 Y 5.0601 7.8525 117.7090 56.4050 39.7320 175.3591 51 K 4.8481 8.2580 124.1161 54.2772 34.6395 174.3879 52 G 4.2902 8.2048 118.5730 44.7849 0.0000 172.7464 53 S 4.3672 8.9633 125.1790 60.7534 63.4901 175.8897 54 R 3.9852 8.0595 116.5017 57.6134 29.8002 176.8056 55 K 4.5968 7.9572 116.5961 56.1401 33.5788 177.1265 56 G 4.0673 8.4926 107.2297 45.4856 0.0000 174.3262 57 T 4.3929 7.5195 114.6544 60.1438 69.7814 173.1468 58 P 4.2442 0.0000 0.0000 66.5350 31.3517 177.9504 59 Y 4.1615 8.2973 119.2788 59.9727 38.2907 177.9602 60 A 3.8503 8.1553 120.2203 55.1967 18.8788 178.5969 61 A 4.0542 7.9533 119.2445 56.3835 18.3124 178.7461 62 Q 4.1755 8.3047 119.3699 58.2395 28.7220 177.3244 63 L 3.8368 7.5749 120.6110 56.2309 42.7256 177.5388 64 A 4.4624 8.1479 118.6749 54.3205 20.6754 179.0609 65 A 4.0252 8.6163 119.7527 54.8162 18.1626 180.0020 66 L 3.8860 7.6996 117.4328 58.0062 41.5867 178.6730 67 D 3.9624 8.0220 116.4562 57.0874 41.0810 176.7993 68 A 4.1616 8.2008 121.9745 53.7234 18.2001 179.0981 69 A 3.7684 8.1898 116.0014 54.6772 18.7416 179.5376 70 K 3.7598 9.0918 118.0537 59.6927 32.2029 178.5899 71 K 4.1385 7.5558 113.9878 57.4135 32.5122 178.0659 72 A 4.4816 7.8157 121.2840 54.2904 19.2877 179.2268 73 M 4.3640 8.6968 117.6018 58.4344 31.7168 178.7311 74 A 3.9462 7.4164 121.0105 55.5143 18.6211 177.8115 75 Y 4.1259 7.8165 110.1003 57.7535 37.8097 174.1749 76 G 3.8234 8.2357 114.2826 45.7505 0.0000 172.7377 77 M 5.2245 8.2520 123.6625 53.7118 34.9473 173.0428 78 Q 4.5586 8.6156 124.0749 56.9156 31.6003 174.8248 79 S 4.7798 7.8223 113.4043 58.2504 65.3077 172.9311 80 V 4.7031 7.8030 112.1210 60.7066 36.4682 172.8005 81 D 4.7548 8.2683 125.0909 53.0139 42.1009 175.9350 82 V 4.3115 8.0895 125.2157 62.5979 32.9642 174.9986 83 I 5.6918 8.6562 127.6061 58.8187 41.3743 174.7355 84 V 5.0369 8.3486 117.8934 59.9310 36.4005 174.5979 85 R 4.8038 9.6120 121.4030 55.9275 34.7488 174.3105 86 G 4.1803 10.0000 114.0004 45.9929 0.0000 173.7609 87 T 3.9937 8.5200 119.8952 63.1503 69.2803 173.9883 88 G 3.8319 7.7472 115.1993 45.3229 0.0000 173.7574 89 A 4.1589 8.4318 123.9587 53.5374 18.6332 178.5153 90 G 4.1517 7.7294 104.4023 45.1878 0.0000 174.5981 91 R 4.1659 7.7300 122.5681 57.4308 30.8795 178.1422 92 E 3.9596 8.0845 117.1498 59.0837 29.7255 178.7197 93 Q 4.2914 8.1232 112.5774 56.8029 28.3952 177.5465 94 A 4.4569 8.0240 121.9821 54.3947 20.6229 179.0127 95 I 3.7436 7.3770 118.6321 63.2526 37.0419 178.4071 96 R 3.7695 8.0090 118.1471 59.9017 30.0481 178.6908 97 A 4.0974 7.9052 118.4331 54.2790 18.5256 178.4144 98 L 4.3321 8.2097 116.2054 56.1808 42.1770 178.1383 99 Q 4.1964 8.3403 119.3787 57.1038 29.0747 177.2684 100 A 4.3232 7.8992 129.1202 52.6124 17.7234 177.3327 101 S 4.4672 7.9305 114.7227 61.0529 65.3542 174.8027 102 G 3.8604 7.0946 106.5869 44.1424 0.0000 173.1579 103 L 4.7511 8.3163 120.8360 52.4831 44.0589 175.9185 104 Q 4.1411 8.8557 125.5613 55.6724 29.8674 177.1730 105 V 3.9976 8.7193 122.4623 66.0939 29.7280 177.8631 106 K 4.1534 5.8912 116.8096 53.4423 35.5207 174.2569 107 S 4.6165 7.4865 107.6211 57.5712 66.2801 173.9139 108 I 4.7661 8.3641 123.7876 60.0922 39.3211 175.2609 109 V 4.4062 8.8218 124.7618 61.7163 35.4331 172.4141 110 D 5.1083 8.7584 127.6170 52.6355 42.1973 175.3718 111 D 5.0513 8.8992 127.9540 54.1410 41.8777 176.2956 112 T 4.1099 7.8450 114.6972 62.7188 69.0035 172.4660 113 P 4.4332 0.0000 0.0000 61.8292 32.0206 175.9509 114 V 4.2770 8.1796 123.6104 58.4259 32.0550 173.4091 115 P 4.1949 0.0000 0.0000 63.7531 31.8297 176.9930 116 H 4.5982 8.5153 119.7109 55.9797 27.5909 176.3416 117 N 4.1089 7.8601 115.7194 53.5723 35.4587 173.8846 118 G 3.8423 7.7100 106.1483 45.7642 0.0000 170.7030 119 C 4.3606 8.1159 116.6021 57.8452 29.8996 173.9937 120 R 3.9489 8.5281 124.5080 56.1774 30.1854 173.9294 121 P 4.7692 0.0000 0.0000 60.7331 33.4852 175.8277 122 K 3.7616 8.3794 117.9505 57.1510 32.9473 177.6639 123 K 3.4527 8.9444 123.8544 59.9150 31.6620 178.3736 124 K 3.9584 8.0711 118.3972 59.8260 32.5528 178.3518 125 F 4.1059 8.5509 117.4248 60.2819 38.7829 176.9433 126 R 4.2241 8.7939 117.2286 57.2139 29.8837 177.5938 127 K 3.9685 7.5251 116.5457 59.3409 32.4362 177.1680 128 A 4.1065 7.3810 121.0433 52.1280 18.8772 177.2450 129 S 4.2783 8.5104 116.3705 58.3674 62.7769 173.5158 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 11 K 8.31 4.31 0.00 1.81 1.72 0.00 1.69 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.47 7.81 12 R 8.73 4.49 0.00 1.83 1.80 0.00 3.20 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.74 0.00 13 Q 9.27 4.48 0.00 2.05 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.49 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 14 V 8.30 4.37 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.99 0.00 0.00 15 A 8.53 4.88 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 16 S 7.51 4.88 0.00 3.90 3.78 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 17 G 8.66 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 18 R 8.56 4.70 0.00 1.87 1.76 0.00 2.88 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.54 0.00 19 A 8.46 5.20 1.22 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 0.00 0.00 20 Y 9.44 5.15 0.00 3.02 2.85 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 21 I 9.53 4.77 1.97 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 1.13 0.96 0.93 0.00 0.00 22 H 9.89 4.82 0.00 3.21 3.33 0.00 5.75 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 23 A 8.72 4.55 1.20 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 0.00 0.00 24 S 7.97 4.64 0.00 3.86 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 25 Y 8.67 4.71 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 26 N 8.16 4.99 0.00 2.69 2.85 0.00 0.00 6.73 9.06 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 27 N 7.46 4.93 0.00 2.70 2.73 0.00 0.00 7.15 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 28 T 8.10 4.89 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 1.32 0.00 0.00 29 I 9.57 4.92 1.96 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 1.35 1.89 1.00 0.00 0.00 30 V 9.24 4.98 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 1.07 0.00 0.00 31 T 9.07 5.10 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 1.33 0.00 0.00 32 I 9.43 4.85 1.97 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 1.33 0.82 0.99 0.00 0.00 33 T 9.31 5.27 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 1.41 0.00 0.00 34 D 8.49 5.24 0.00 2.74 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 35 P 0.00 4.26 0.00 2.07 2.18 0.00 3.70 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 36 D 7.63 4.46 0.00 2.84 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 37 G 7.83 5.15 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 0.00 38 N 7.56 4.47 0.00 2.97 2.76 0.00 0.00 7.18 8.03 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 39 P 0.00 4.81 0.00 2.09 2.04 0.00 3.65 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 2.01 2.08 0.00 40 I 8.97 4.04 1.77 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.77 0.52 0.00 0.00 41 T 7.37 4.38 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 0.99 0.00 0.00 42 W 7.99 5.63 0.00 3.52 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 S 10.15 4.65 0.00 3.69 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 44 S 8.87 5.16 0.00 4.06 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 0.00 45 G 8.69 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 7.91 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 7.80 3.83 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 0.59 0.00 0.00 0.96 0.00 0.00 48 I 7.81 3.72 1.54 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.68 0.59 0.00 0.00 49 G 8.91 4.18 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 0.00 50 Y 7.85 5.06 0.00 3.14 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 51 K 8.26 4.85 0.00 1.73 1.73 0.00 1.86 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.48 7.81 52 G 8.20 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 0.00 0.00 0.00 0.00 53 S 8.96 4.37 0.00 3.90 3.93 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 54 R 8.06 3.99 0.00 1.82 1.74 0.00 2.74 0.00 0.00 3.06 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.58 0.00 55 K 7.96 4.60 0.00 2.05 1.86 0.00 1.71 0.00 0.00 2.05 0.00 0.00 3.01 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.72 1.50 7.81 56 G 8.49 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 57 T 7.52 4.39 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 1.42 0.00 0.00 58 P 0.00 4.24 0.00 2.37 2.49 0.00 3.82 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.07 0.00 59 Y 8.30 4.16 0.00 3.11 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 8.16 3.85 1.54 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 61 A 7.95 4.05 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 62 Q 8.30 4.18 0.00 2.31 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.85 0.00 0.00 0.00 0.00 0.00 2.25 2.20 0.00 63 L 7.57 3.84 0.00 1.08 1.32 0.64 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.15 4.46 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 A 8.62 4.03 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.70 3.89 0.00 1.78 1.66 0.89 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.02 3.96 0.00 2.61 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 68 A 8.20 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 69 A 8.19 3.77 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.09 3.76 0.00 1.77 1.87 0.00 1.50 0.00 0.00 1.62 0.00 0.00 3.07 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.55 7.81 71 K 7.56 4.14 0.00 1.84 1.87 0.00 1.74 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.42 1.52 7.81 72 A 7.82 4.48 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 73 M 8.70 4.36 0.00 1.99 2.26 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 2.66 2.77 0.00 74 A 7.42 3.95 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 75 Y 7.82 4.13 0.00 3.12 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 76 G 8.24 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 77 M 8.25 5.22 0.00 1.92 2.09 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.62 0.00 78 Q 8.62 4.56 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.72 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 79 S 7.82 4.78 0.00 3.89 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 80 V 7.80 4.70 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 0.58 0.00 0.00 0.92 0.00 0.00 81 D 8.27 4.75 0.00 2.71 2.53 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 82 V 8.09 4.31 2.03 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 0.88 0.00 0.00 0.89 0.00 0.00 83 I 8.66 5.69 1.11 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.97 1.05 0.00 0.00 84 V 8.35 5.04 2.17 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 0.74 0.00 0.00 0.99 0.00 0.00 85 R 9.61 4.80 0.00 1.73 1.80 0.00 3.19 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 86 G 10.00 4.18 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 0.00 87 T 8.52 3.99 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 1.27 0.00 0.00 88 G 7.75 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 A 8.43 4.16 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 G 7.73 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 0.00 0.00 0.00 91 R 7.73 4.17 0.00 1.87 1.89 0.00 3.24 0.00 0.00 3.16 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.70 0.00 92 E 8.08 3.96 0.00 2.12 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 2.36 2.38 0.00 93 Q 8.12 4.29 0.00 2.15 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.69 0.00 0.00 0.00 0.00 0.00 2.48 2.36 0.00 94 A 8.02 4.46 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 I 7.38 3.74 1.98 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 1.80 1.10 0.91 0.00 0.00 96 R 8.01 3.77 0.00 1.85 2.03 0.00 3.14 0.00 0.00 3.35 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 97 A 7.91 4.10 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 98 L 8.21 4.33 0.00 1.67 1.70 0.92 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 8.34 4.20 0.00 2.06 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.19 0.00 0.00 0.00 0.00 0.00 2.63 2.43 0.00 100 A 7.90 4.32 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 0.00 101 S 7.93 4.47 0.00 3.94 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 0.00 102 G 7.09 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 0.00 103 L 8.32 4.75 0.00 1.56 1.57 1.01 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 104 Q 8.86 4.14 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 7.21 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 105 V 8.72 4.00 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 0.88 0.00 0.00 1.03 0.00 0.00 106 K 5.89 4.15 0.00 1.78 1.79 0.00 1.69 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.73 1.53 7.81 107 S 7.49 4.62 0.00 3.86 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 I 8.36 4.77 1.85 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 1.20 0.59 0.89 0.00 0.00 109 V 8.82 4.41 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 0.86 0.00 0.00 0.90 0.00 0.00 110 D 8.76 5.11 0.00 2.71 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 0.00 111 D 8.90 5.05 0.00 2.73 2.71 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 0.00 112 T 7.85 4.11 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 0.00 113 P 0.00 4.43 0.00 2.18 2.08 0.00 3.74 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 114 V 8.18 4.28 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 0.86 0.00 0.00 0.98 0.00 0.00 115 P 0.00 4.19 0.00 2.20 2.11 0.00 3.79 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 2.02 2.02 0.00 116 H 8.52 4.60 0.00 3.16 3.31 0.00 5.85 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 N 7.86 4.11 0.00 2.87 2.84 0.00 0.00 6.98 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 G 7.71 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 0.00 0.00 0.00 119 C 8.12 4.36 0.00 2.95 2.85 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 0.00 120 R 8.53 3.95 0.00 1.76 1.83 0.00 3.22 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 121 P 0.00 4.77 0.00 2.25 2.03 0.00 3.61 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.11 0.00 122 K 8.38 3.76 0.00 1.71 1.86 0.00 1.53 0.00 0.00 1.61 0.00 0.00 2.83 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.47 7.81 123 K 8.94 3.45 0.00 1.83 1.86 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.55 7.81 124 K 8.07 3.96 0.00 1.87 2.04 0.00 1.91 0.00 0.00 1.71 0.00 0.00 3.16 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.39 1.55 7.81 125 F 8.55 4.11 0.00 3.17 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 0.00 126 R 8.79 4.22 0.00 1.94 2.10 0.00 3.31 0.00 0.00 3.24 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 127 K 7.53 3.97 0.00 1.77 1.88 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.48 1.61 7.81 128 A 7.38 4.11 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 0.00 129 S 8.51 4.28 0.00 3.79 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00